*HEADER    LIGAND BINDING PROTEIN                  02-FEB-07   2JNT              
*TITLE     STRUCTURE OF BOMBYX MORI CHEMOSENSORY PROTEIN 1 IN SOLUTION           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CHEMOSENSORY PROTEIN CSP1;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SEQUENCE DATABASE RESIDUES 20-127;                         
*COMPND   5 SYNONYM: CHEMOSENSORY PROTEIN 4, HYPOTHETICAL PROTEIN;               
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BOMBYX MORI;                                    
*SOURCE   3 ORGANISM_COMMON: SILK MOTH;                                          
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR: PET32A                                     
*KEYWDS    BMORCSP1, CSP1, LIGAND BINDING PROTEIN                                
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    S.JANSEN, L.ZIDEK, J.CHMELIK, P.NOVAK, P.PADRTA, J.PICIMBON,          
*AUTHOR   2 C.LOFSTEDT, V.SKLENAR                                                
*REVDAT   1   20-NOV-07 2JNT    0                                                


! unambiguous distance restraints
assign (resid 4 and name HB1) (resid 4 and name HA) 3.013 1.089 2.089
assign (resid 4 and name HD1) (resid 5 and name HE1) 3.401 1.388 2.388
    or (resid    4 and name  HD1) (resid    5 and name  HE2)
assign (resid 5 and name HA) (resid 23 and name HB2) 2.916 1.020 2.02
assign (resid 5 and name HB2) (resid 6 and name HN) 3.253 1.270 2.27
assign (resid 5 and name HB2) (resid 5 and name HB1) 2.172 0.566 1.566
assign (resid 6 and name HB2) (resid 6 and name HN) 3.017 1.092 2.092
assign (resid 6 and name HB1) (resid 6 and name HN) 3.366 1.360 2.36
assign (resid 7 and name HB2) (resid 7 and name HA) 2.765 0.917 1.917
    or (resid    7 and name  HB1) (resid    7 and name   HA)
assign (resid 15 and name HB2) (resid 69 and name HB2) 2.698 0.874 1.874
assign (resid 8 and name HN) (resid 8 and name HA) 3.025 1.098 2.098
assign (resid 8 and name HD12) (resid 8 and name HG11) 2.320 0.646 1.646
    or (resid    8 and name HD11) (resid    8 and name HG11)
    or (resid    8 and name HD13) (resid    8 and name HG11)
assign (resid 8 and name HD12) (resid 8 and name HG12) 2.315 0.643 1.643
    or (resid    8 and name HD11) (resid    8 and name HG12)
    or (resid    8 and name HD13) (resid    8 and name HG12)
assign (resid 8 and name HD12) (resid 8 and name HB) 2.462 0.727 1.727
    or (resid    8 and name HD11) (resid    8 and name   HB)
    or (resid    8 and name HD13) (resid    8 and name   HB)
assign (resid 8 and name HG12) (resid 8 and name HG11) 2.218 0.591 1.591
assign (resid 8 and name HG22) (resid 8 and name HB) 2.254 0.610 1.61
    or (resid    8 and name HG21) (resid    8 and name   HB)
    or (resid    8 and name HG23) (resid    8 and name   HB)
assign (resid 8 and name HG22) (resid 8 and name HA) 2.504 0.752 1.752
    or (resid    8 and name HG21) (resid    8 and name   HA)
    or (resid    8 and name HG23) (resid    8 and name   HA)
assign (resid 9 and name HB1) (resid 9 and name HB2) 2.422 0.704 1.704
assign (resid 10 and name HD12) (resid 10 and name HB2) 2.554 0.782 1.782
    or (resid   10 and name HD11) (resid   10 and name  HB2)
    or (resid   10 and name HD13) (resid   10 and name  HB2)
assign (resid 10 and name HD12) (resid 10 and name HB1) 2.875 0.992 1.992
    or (resid   10 and name HD11) (resid   10 and name  HB1)
    or (resid   10 and name HD13) (resid   10 and name  HB1)
assign (resid 10 and name HD12) (resid 10 and name HD22) 2.546 0.778 1.778
    or (resid   10 and name HD12) (resid   10 and name HD21)
    or (resid   10 and name HD12) (resid   10 and name HD23)
    or (resid   10 and name HD11) (resid   10 and name HD22)
    or (resid   10 and name HD11) (resid   10 and name HD21)
    or (resid   10 and name HD11) (resid   10 and name HD23)
    or (resid   10 and name HD13) (resid   10 and name HD22)
    or (resid   10 and name HD13) (resid   10 and name HD21)
    or (resid   10 and name HD13) (resid   10 and name HD23)
assign (resid 10 and name HD22) (resid 10 and name HB2) 3.001 1.081 2.081
    or (resid   10 and name HD21) (resid   10 and name  HB2)
    or (resid   10 and name HD23) (resid   10 and name  HB2)
assign (resid 10 and name HD22) (resid 10 and name HD21) 1.844 0.408 1.408
    or (resid   10 and name HD22) (resid   10 and name HD23)
    or (resid   10 and name HD22) (resid   10 and name HD21)
    or (resid   10 and name HD21) (resid   10 and name HD23)
    or (resid   10 and name HD22) (resid   10 and name HD23)
    or (resid   10 and name HD21) (resid   10 and name HD23)
assign (resid 10 and name HG) (resid 10 and name HD12) 3.038 1.107 2.107
    or (resid   10 and name   HG) (resid   10 and name HD11)
    or (resid   10 and name   HG) (resid   10 and name HD13)
assign (resid 11 and name HG2) (resid 11 and name HA) 2.925 1.027 2.027
    or (resid   11 and name  HG1) (resid   11 and name   HA)
assign (resid 12 and name HA) (resid 12 and name HG2) 2.604 0.814 1.814
    or (resid   12 and name   HA) (resid   12 and name  HG1)
assign (resid 12 and name HB2) (resid 12 and name HN) 2.639 0.835 1.835
assign (resid 12 and name HB1) (resid 12 and name HN) 2.822 0.956 1.956
assign (resid 13 and name HD12) (resid 13 and name HG12) 2.514 0.758 1.758
    or (resid   13 and name HD11) (resid   13 and name HG12)
    or (resid   13 and name HD13) (resid   13 and name HG12)
assign (resid 13 and name HD12) (resid 13 and name HG11) 2.443 0.716 1.716
    or (resid   13 and name HD11) (resid   13 and name HG11)
    or (resid   13 and name HD13) (resid   13 and name HG11)
assign (resid 13 and name HN) (resid 13 and name HG22) 2.976 1.063 2.063
    or (resid   13 and name   HN) (resid   13 and name HG21)
    or (resid   13 and name   HN) (resid   13 and name HG23)
assign (resid 13 and name HG22) (resid 13 and name HA) 2.762 0.915 1.915
    or (resid   13 and name HG21) (resid   13 and name   HA)
    or (resid   13 and name HG23) (resid   13 and name   HA)
assign (resid 14 and name HD12) (resid 14 and name HA) 2.995 1.077 2.077
    or (resid   14 and name HD11) (resid   14 and name   HA)
    or (resid   14 and name HD13) (resid   14 and name   HA)
assign (resid 14 and name HD12) (resid 14 and name HB1) 2.533 0.770 1.77
    or (resid   14 and name HD11) (resid   14 and name  HB1)
    or (resid   14 and name HD13) (resid   14 and name  HB1)
assign (resid 14 and name HD12) (resid 14 and name HB2) 2.758 0.913 1.913
    or (resid   14 and name HD11) (resid   14 and name  HB2)
    or (resid   14 and name HD13) (resid   14 and name  HB2)
assign (resid 14 and name HN) (resid 14 and name HD22) 3.180 1.213 2.213
    or (resid   14 and name   HN) (resid   14 and name HD21)
    or (resid   14 and name   HN) (resid   14 and name HD23)
assign (resid 14 and name HG) (resid 14 and name HA) 3.215 1.241 2.241
assign (resid 15 and name HN) (resid 15 and name HG2) 3.473 1.447 2.447
    or (resid   15 and name   HN) (resid   15 and name  HG1)
assign (resid 16 and name HB1) (resid 16 and name HA) 3.235 1.256 2.256
assign (resid 16 and name HN) (resid 16 and name HB1) 3.244 1.263 2.263
assign (resid 17 and name HB1) (resid 17 and name HA) 3.224 1.247 2.247
assign (resid 17 and name HN) (resid 17 and name HB1) 2.841 0.969 1.969
assign (resid 18 and name HN) (resid 17 and name HB2) 3.173 1.208 2.208
assign (resid 17 and name HD2) (resid 17 and name HD1) 2.010 0.485 1.485
assign (resid 17 and name HD1) (resid 17 and name HA) 3.022 1.096 2.096
assign (resid 17 and name HG2) (resid 17 and name HB2) 2.552 0.781 1.781
assign (resid 19 and name HD12) (resid 19 and name HA) 2.871 0.989 1.989
    or (resid   19 and name HD11) (resid   19 and name   HA)
    or (resid   19 and name HD13) (resid   19 and name   HA)
assign (resid 19 and name HD22) (resid 19 and name HA) 2.613 0.819 1.819
    or (resid   19 and name HD21) (resid   19 and name   HA)
    or (resid   19 and name HD23) (resid   19 and name   HA)
assign (resid 19 and name HD22) (resid 19 and name HD21) 1.384 0.230 1.23
    or (resid   19 and name HD22) (resid   19 and name HD23)
    or (resid   19 and name HD22) (resid   19 and name HD21)
    or (resid   19 and name HD21) (resid   19 and name HD23)
    or (resid   19 and name HD22) (resid   19 and name HD23)
    or (resid   19 and name HD21) (resid   19 and name HD23)
assign (resid 20 and name HN) (resid 20 and name HD12) 3.432 1.413 2.413
    or (resid   20 and name   HN) (resid   20 and name HD11)
    or (resid   20 and name   HN) (resid   20 and name HD13)
assign (resid 21 and name HB1) (resid 21 and name HN) 3.011 1.088 2.088
assign (resid 21 and name HG2) (resid 21 and name HG1) 2.239 0.602 1.602
assign (resid 22 and name HA) (resid 22 and name HB2) 2.618 0.822 1.822
assign (resid 22 and name HB2) (resid 22 and name HN) 3.046 1.113 2.113
assign (resid 24 and name HA) (resid 24 and name HB2) 2.557 0.785 1.785
    or (resid   24 and name   HA) (resid   24 and name  HB1)
assign (resid 25 and name HA) (resid 25 and name HB1) 2.837 0.966 1.966
assign (resid 25 and name HA) (resid 30 and name HG1) 2.701 0.875 1.875
assign (resid 25 and name HB2) (resid 25 and name HN) 3.255 1.272 2.272
assign (resid 27 and name HG12) (resid 27 and name HA) 3.000 1.080 2.08
    or (resid   27 and name HG11) (resid   27 and name   HA)
    or (resid   27 and name HG13) (resid   27 and name   HA)
assign (resid 27 and name HG22) (resid 27 and name HB) 2.526 0.766 1.766
    or (resid   27 and name HG21) (resid   27 and name   HB)
    or (resid   27 and name HG23) (resid   27 and name   HB)
assign (resid 27 and name HG22) (resid 27 and name HA) 2.826 0.958 1.958
    or (resid   27 and name HG21) (resid   27 and name   HA)
    or (resid   27 and name HG23) (resid   27 and name   HA)
assign (resid 28 and name HB2) (resid 28 and name HD22) 3.343 1.341 2.341
    or (resid   28 and name  HB2) (resid   28 and name HD21)
    or (resid   28 and name  HB2) (resid   28 and name HD23)
assign (resid 28 and name HB1) (resid 28 and name HD22) 3.385 1.375 2.375
    or (resid   28 and name  HB1) (resid   28 and name HD21)
    or (resid   28 and name  HB1) (resid   28 and name HD23)
assign (resid 28 and name HD12) (resid 28 and name HD11) 1.699 0.346 1.346
    or (resid   28 and name HD12) (resid   28 and name HD13)
    or (resid   28 and name HD12) (resid   28 and name HD11)
    or (resid   28 and name HD11) (resid   28 and name HD13)
    or (resid   28 and name HD12) (resid   28 and name HD13)
    or (resid   28 and name HD11) (resid   28 and name HD13)
assign (resid 28 and name HD12) (resid 28 and name HD22) 2.488 0.743 1.743
    or (resid   28 and name HD12) (resid   28 and name HD21)
    or (resid   28 and name HD12) (resid   28 and name HD23)
    or (resid   28 and name HD11) (resid   28 and name HD22)
    or (resid   28 and name HD11) (resid   28 and name HD21)
    or (resid   28 and name HD11) (resid   28 and name HD23)
    or (resid   28 and name HD13) (resid   28 and name HD22)
    or (resid   28 and name HD13) (resid   28 and name HD21)
    or (resid   28 and name HD13) (resid   28 and name HD23)
assign (resid 28 and name HA) (resid 28 and name HD22) 2.739 0.900 1.9
    or (resid   28 and name   HA) (resid   28 and name HD21)
    or (resid   28 and name   HA) (resid   28 and name HD23)
assign (resid 28 and name HD22) (resid 28 and name HD21) 1.687 0.342 1.342
    or (resid   28 and name HD22) (resid   28 and name HD23)
    or (resid   28 and name HD22) (resid   28 and name HD21)
    or (resid   28 and name HD21) (resid   28 and name HD23)
    or (resid   28 and name HD22) (resid   28 and name HD23)
    or (resid   28 and name HD21) (resid   28 and name HD23)
assign (resid 30 and name HA) (resid 30 and name HB2) 2.639 0.835 1.835
assign (resid 30 and name HB1) (resid 30 and name HB2) 2.557 0.785 1.785
assign (resid 30 and name HB1) (resid 30 and name HA) 3.397 1.385 2.385
assign (resid 30 and name HD2) (resid 30 and name HB1) 2.301 0.636 1.636
    or (resid   30 and name  HD1) (resid   30 and name  HB1)
assign (resid 30 and name HD2) (resid 30 and name HN) 3.310 1.315 2.315
    or (resid   30 and name  HD1) (resid   30 and name   HN)
assign (resid 30 and name HE2) (resid 30 and name HB2) 2.736 0.898 1.898
    or (resid   30 and name  HE1) (resid   30 and name  HB2)
assign (resid 30 and name HG1) (resid 30 and name HA) 3.226 1.249 2.249
assign (resid 30 and name HG2) (resid 30 and name HB2) 2.947 1.042 2.042
assign (resid 30 and name HG2) (resid 30 and name HG1) 2.384 0.682 1.682
assign (resid 31 and name HA2) (resid 31 and name HA1) 2.378 0.679 1.679
assign (resid 32 and name HE2) (resid 32 and name HN) 3.132 1.177 2.177
    or (resid   32 and name  HE1) (resid   32 and name   HN)
assign (resid 32 and name HB2) (resid 32 and name HG2) 2.135 0.547 1.547
    or (resid   32 and name  HB1) (resid   32 and name  HG2)
assign (resid 34 and name HG21) (resid 34 and name HG22) 1.395 0.233 1.233
    or (resid   34 and name HG21) (resid   34 and name HG23)
    or (resid   34 and name HG21) (resid   34 and name HG22)
    or (resid   34 and name HG22) (resid   34 and name HG23)
    or (resid   34 and name HG21) (resid   34 and name HG23)
    or (resid   34 and name HG22) (resid   34 and name HG23)
assign (resid 34 and name HG21) (resid 34 and name HA) 2.486 0.742 1.742
    or (resid   34 and name HG22) (resid   34 and name   HA)
    or (resid   34 and name HG23) (resid   34 and name   HA)
assign (resid 34 and name HG21) (resid 34 and name HB) 2.375 0.677 1.677
    or (resid   34 and name HG22) (resid   34 and name   HB)
    or (resid   34 and name HG23) (resid   34 and name   HB)
assign (resid 36 and name HG1) (resid 36 and name HN) 3.093 1.148 2.148
assign (resid 36 and name HG2) (resid 36 and name HN) 3.267 1.281 2.281
assign (resid 36 and name HG1) (resid 36 and name HG2) 1.852 0.411 1.411
assign (resid 38 and name HA) (resid 41 and name HD2) 2.862 0.983 1.983
assign (resid 38 and name HN) (resid 38 and name HB1) 3.115 1.164 2.164
assign (resid 17 and name HB2) (resid 17 and name HA) 2.923 1.025 2.025
assign (resid 38 and name HB2) (resid 38 and name HA) 3.291 1.299 2.299
assign (resid 38 and name HG2) (resid 38 and name HA) 2.830 0.961 1.961
assign (resid 39 and name HN) (resid 39 and name HB1) 3.095 1.149 2.149
assign (resid 40 and name HA) (resid 40 and name HD12) 2.739 0.900 1.9
    or (resid   40 and name   HA) (resid   40 and name HD11)
    or (resid   40 and name   HA) (resid   40 and name HD13)
assign (resid 40 and name HA) (resid 40 and name HG) 3.100 1.153 2.153
assign (resid 106 and name HG12) (resid 105 and name HA) 3.510 1.479 2.479
assign (resid 40 and name HD12) (resid 40 and name HG) 2.460 0.726 1.726
    or (resid   40 and name HD11) (resid   40 and name   HG)
    or (resid   40 and name HD13) (resid   40 and name   HG)
assign (resid 40 and name HD22) (resid 40 and name HA) 3.549 1.511 2.511
    or (resid   40 and name HD21) (resid   40 and name   HA)
    or (resid   40 and name HD23) (resid   40 and name   HA)
assign (resid 40 and name HD22) (resid 40 and name HB1) 2.879 0.995 1.995
    or (resid   40 and name HD21) (resid   40 and name  HB1)
    or (resid   40 and name HD23) (resid   40 and name  HB1)
assign (resid 41 and name HE2) (resid 41 and name HD1) 2.314 0.642 1.642
    or (resid   41 and name  HE1) (resid   41 and name  HD1)
assign (resid 41 and name HE2) (resid 41 and name HD2) 2.411 0.698 1.698
    or (resid   41 and name  HE1) (resid   41 and name  HD2)
assign (resid 44 and name HA) (resid 44 and name HD22) 2.634 0.832 1.832
    or (resid   44 and name   HA) (resid   44 and name HD21)
    or (resid   44 and name   HA) (resid   44 and name HD23)
assign (resid 44 and name HD12) (resid 44 and name HN) 3.212 1.238 2.238
    or (resid   44 and name HD11) (resid   44 and name   HN)
    or (resid   44 and name HD13) (resid   44 and name   HN)
assign (resid 46 and name HG2) (resid 46 and name HB1) 2.632 0.831 1.831
    or (resid   46 and name  HG1) (resid   46 and name  HB1)
assign (resid 46 and name HG2) (resid 46 and name HG1) 1.891 0.429 1.429
    or (resid   46 and name  HG2) (resid   46 and name  HG1)
assign (resid 46 and name HG2) (resid 46 and name HN) 3.470 1.445 2.445
    or (resid   46 and name  HG1) (resid   46 and name   HN)
assign (resid 47 and name HN) (resid 47 and name HB2) 2.866 0.986 1.986
    or (resid   47 and name   HN) (resid   47 and name  HB1)
    or (resid   47 and name   HN) (resid   47 and name  HB3)
assign (resid 47 and name HA) (resid 47 and name HB2) 2.587 0.803 1.803
    or (resid   47 and name   HA) (resid   47 and name  HB1)
    or (resid   47 and name   HA) (resid   47 and name  HB3)
assign (resid 47 and name HB2) (resid 47 and name HB1) 1.710 0.351 1.351
    or (resid   47 and name  HB2) (resid   47 and name  HB3)
    or (resid   47 and name  HB2) (resid   47 and name  HB1)
    or (resid   47 and name  HB1) (resid   47 and name  HB3)
    or (resid   47 and name  HB2) (resid   47 and name  HB3)
    or (resid   47 and name  HB1) (resid   47 and name  HB3)
assign (resid 48 and name HA) (resid 48 and name HD12) 2.555 0.784 1.784
    or (resid   48 and name   HA) (resid   48 and name HD11)
    or (resid   48 and name   HA) (resid   48 and name HD13)
assign (resid 50 and name HG21) (resid 50 and name HA) 2.463 0.728 1.728
    or (resid   50 and name HG22) (resid   50 and name   HA)
    or (resid   50 and name HG23) (resid   50 and name   HA)
assign (resid 50 and name HG21) (resid 50 and name HB) 2.420 0.703 1.703
    or (resid   50 and name HG22) (resid   50 and name   HB)
    or (resid   50 and name HG23) (resid   50 and name   HB)
assign (resid 52 and name HA) (resid 52 and name HB1) 2.755 0.911 1.911
assign (resid 53 and name HB2) (resid 53 and name HA) 2.609 0.817 1.817
assign (resid 54 and name HA) (resid 54 and name HG2) 2.935 1.034 2.034
assign (resid 54 and name HB2) (resid 54 and name HB1) 1.498 0.269 1.269
    or (resid   54 and name  HB2) (resid   54 and name  HB1)
assign (resid 54 and name HB2) (resid 54 and name HA) 2.902 1.010 2.01
    or (resid   54 and name  HB1) (resid   54 and name   HA)
assign (resid 54 and name HD2) (resid 54 and name HN) 2.850 0.974 1.974
    or (resid   54 and name  HD1) (resid   54 and name   HN)
assign (resid 54 and name HE2) (resid 54 and name HB2) 2.401 0.692 1.692
    or (resid   54 and name  HE2) (resid   54 and name  HB1)
    or (resid   54 and name  HE1) (resid   54 and name  HB2)
    or (resid   54 and name  HE1) (resid   54 and name  HB1)
assign (resid 54 and name HG2) (resid 54 and name HB2) 2.397 0.690 1.69
    or (resid   54 and name  HG2) (resid   54 and name  HB1)
assign (resid 55 and name HA) (resid 55 and name HB1) 3.173 1.208 2.208
assign (resid 55 and name HA) (resid 55 and name HB2) 3.071 1.131 2.131
assign (resid 56 and name HA) (resid 56 and name HG21) 2.286 0.627 1.627
    or (resid   56 and name   HA) (resid   56 and name HG22)
    or (resid   56 and name   HA) (resid   56 and name HG23)
assign (resid 56 and name HG21) (resid 56 and name HB) 2.350 0.663 1.663
    or (resid   56 and name HG22) (resid   56 and name   HB)
    or (resid   56 and name HG23) (resid   56 and name   HB)
assign (resid 58 and name HN) (resid 58 and name HB2) 2.217 0.590 1.59
    or (resid   58 and name   HN) (resid   58 and name  HB1)
    or (resid   58 and name   HN) (resid   58 and name  HB3)
assign (resid 58 and name HA) (resid 58 and name HB2) 2.054 0.506 1.506
    or (resid   58 and name   HA) (resid   58 and name  HB1)
    or (resid   58 and name   HA) (resid   58 and name  HB3)
assign (resid 76 and name HB2) (resid 76 and name HG2) 2.363 0.670 1.67
assign (resid 61 and name HA) (resid 61 and name HB2) 2.478 0.737 1.737
    or (resid   61 and name   HA) (resid   61 and name  HB1)
assign (resid 61 and name HG2) (resid 61 and name HN) 3.150 1.190 2.19
    or (resid   61 and name  HG1) (resid   61 and name   HN)
assign (resid 62 and name HA1) (resid 62 and name HA2) 2.311 0.641 1.641
    or (resid   62 and name  HA1) (resid   62 and name  HA2)
assign (resid 63 and name HB2) (resid 63 and name HB1) 1.584 0.301 1.301
    or (resid   63 and name  HB2) (resid   63 and name  HB3)
    or (resid   63 and name  HB2) (resid   63 and name  HB1)
    or (resid   63 and name  HB1) (resid   63 and name  HB3)
    or (resid   63 and name  HB2) (resid   63 and name  HB3)
    or (resid   63 and name  HB1) (resid   63 and name  HB3)
assign (resid 63 and name HA) (resid 63 and name HB2) 2.492 0.745 1.745
    or (resid   63 and name   HA) (resid   63 and name  HB1)
    or (resid   63 and name   HA) (resid   63 and name  HB3)
assign (resid 65 and name HA) (resid 65 and name HG21) 2.366 0.672 1.672
    or (resid   65 and name   HA) (resid   65 and name HG22)
    or (resid   65 and name   HA) (resid   65 and name HG23)
assign (resid 65 and name HB) (resid 65 and name HG21) 2.380 0.680 1.68
    or (resid   65 and name   HB) (resid   65 and name HG22)
    or (resid   65 and name   HB) (resid   65 and name HG23)
assign (resid 67 and name HA) (resid 67 and name HD12) 3.250 1.267 2.267
    or (resid   67 and name   HA) (resid   67 and name HD11)
    or (resid   67 and name   HA) (resid   67 and name HD13)
assign (resid 67 and name HA) (resid 67 and name HG11) 3.222 1.246 2.246
assign (resid 67 and name HA) (resid 67 and name HG12) 3.237 1.257 2.257
assign (resid 67 and name HD12) (resid 67 and name HD11) 1.793 0.386 1.386
    or (resid   67 and name HD12) (resid   67 and name HD13)
    or (resid   67 and name HD12) (resid   67 and name HD11)
    or (resid   67 and name HD11) (resid   67 and name HD13)
    or (resid   67 and name HD12) (resid   67 and name HD13)
    or (resid   67 and name HD11) (resid   67 and name HD13)
assign (resid 67 and name HD12) (resid 67 and name HG22) 2.613 0.819 1.819
    or (resid   67 and name HD12) (resid   67 and name HG21)
    or (resid   67 and name HD12) (resid   67 and name HG23)
    or (resid   67 and name HD11) (resid   67 and name HG22)
    or (resid   67 and name HD11) (resid   67 and name HG21)
    or (resid   67 and name HD11) (resid   67 and name HG23)
    or (resid   67 and name HD13) (resid   67 and name HG22)
    or (resid   67 and name HD13) (resid   67 and name HG21)
    or (resid   67 and name HD13) (resid   67 and name HG23)
assign (resid 67 and name HG22) (resid 67 and name HB) 2.778 0.926 1.926
    or (resid   67 and name HG21) (resid   67 and name   HB)
    or (resid   67 and name HG23) (resid   67 and name   HB)
assign (resid 67 and name HN) (resid 67 and name HG22) 3.013 1.089 2.089
    or (resid   67 and name   HN) (resid   67 and name HG21)
    or (resid   67 and name   HN) (resid   67 and name HG23)
assign (resid 70 and name HD12) (resid 70 and name HG) 2.352 0.664 1.664
    or (resid   70 and name HD11) (resid   70 and name   HG)
    or (resid   70 and name HD13) (resid   70 and name   HG)
assign (resid 70 and name HD12) (resid 70 and name HA) 2.506 0.753 1.753
    or (resid   70 and name HD11) (resid   70 and name   HA)
    or (resid   70 and name HD13) (resid   70 and name   HA)
assign (resid 70 and name HN) (resid 70 and name HD12) 3.063 1.126 2.126
    or (resid   70 and name   HN) (resid   70 and name HD11)
    or (resid   70 and name   HN) (resid   70 and name HD13)
assign (resid 70 and name HD12) (resid 70 and name HD11) 1.541 0.285 1.285
    or (resid   70 and name HD12) (resid   70 and name HD13)
    or (resid   70 and name HD12) (resid   70 and name HD11)
    or (resid   70 and name HD11) (resid   70 and name HD13)
    or (resid   70 and name HD12) (resid   70 and name HD13)
    or (resid   70 and name HD11) (resid   70 and name HD13)
assign (resid 70 and name HD22) (resid 70 and name HG) 2.682 0.863 1.863
    or (resid   70 and name HD21) (resid   70 and name   HG)
    or (resid   70 and name HD23) (resid   70 and name   HG)
assign (resid 70 and name HN) (resid 70 and name HD22) 3.270 1.283 2.283
    or (resid   70 and name   HN) (resid   70 and name HD21)
    or (resid   70 and name   HN) (resid   70 and name HD23)
assign (resid 71 and name HD12) (resid 71 and name HB) 2.937 1.035 2.035
    or (resid   71 and name HD11) (resid   71 and name   HB)
    or (resid   71 and name HD13) (resid   71 and name   HB)
assign (resid 71 and name HD12) (resid 71 and name HA) 3.349 1.346 2.346
    or (resid   71 and name HD11) (resid   71 and name   HA)
    or (resid   71 and name HD13) (resid   71 and name   HA)
assign (resid 71 and name HD12) (resid 71 and name HD11) 1.761 0.372 1.372
    or (resid   71 and name HD12) (resid   71 and name HD13)
    or (resid   71 and name HD12) (resid   71 and name HD11)
    or (resid   71 and name HD11) (resid   71 and name HD13)
    or (resid   71 and name HD12) (resid   71 and name HD13)
    or (resid   71 and name HD11) (resid   71 and name HD13)
assign (resid 71 and name HA) (resid 71 and name HG22) 2.792 0.936 1.936
    or (resid   71 and name   HA) (resid   71 and name HG21)
    or (resid   71 and name   HA) (resid   71 and name HG23)
assign (resid 71 and name HB) (resid 71 and name HG22) 2.542 0.776 1.776
    or (resid   71 and name   HB) (resid   71 and name HG21)
    or (resid   71 and name   HB) (resid   71 and name HG23)
assign (resid 71 and name HG22) (resid 71 and name HG21) 1.596 0.306 1.306
    or (resid   71 and name HG22) (resid   71 and name HG23)
    or (resid   71 and name HG22) (resid   71 and name HG21)
    or (resid   71 and name HG21) (resid   71 and name HG23)
    or (resid   71 and name HG22) (resid   71 and name HG23)
    or (resid   71 and name HG21) (resid   71 and name HG23)
assign (resid 71 and name HD12) (resid 71 and name HG22) 2.318 0.645 1.645
    or (resid   71 and name HD12) (resid   71 and name HG21)
    or (resid   71 and name HD12) (resid   71 and name HG23)
    or (resid   71 and name HD11) (resid   71 and name HG22)
    or (resid   71 and name HD11) (resid   71 and name HG21)
    or (resid   71 and name HD11) (resid   71 and name HG23)
    or (resid   71 and name HD13) (resid   71 and name HG22)
    or (resid   71 and name HD13) (resid   71 and name HG21)
    or (resid   71 and name HD13) (resid   71 and name HG23)
assign (resid 72 and name HA) (resid 72 and name HB2) 2.721 0.888 1.888
    or (resid   72 and name   HA) (resid   72 and name  HB1)
assign (resid 72 and name HN) (resid 72 and name HA) 3.033 1.104 2.104
assign (resid 72 and name HN) (resid 72 and name HB2) 3.017 1.092 2.092
    or (resid   72 and name   HN) (resid   72 and name  HB1)
assign (resid 73 and name HB2) (resid 73 and name HA) 3.335 1.335 2.335
    or (resid   73 and name  HB1) (resid   73 and name   HA)
assign (resid 74 and name HB2) (resid 74 and name HN) 2.983 1.068 2.068
    or (resid   74 and name  HB1) (resid   74 and name   HN)
assign (resid 75 and name HA) (resid 75 and name HD22) 3.313 1.317 2.317
    or (resid   75 and name   HA) (resid   75 and name HD21)
    or (resid   75 and name   HA) (resid   75 and name HD23)
assign (resid 75 and name HN) (resid 75 and name HB2) 3.051 1.117 2.117
    or (resid   75 and name   HN) (resid   75 and name  HB1)
assign (resid 75 and name HD12) (resid 75 and name HB2) 2.220 0.591 1.591
    or (resid   75 and name HD12) (resid   75 and name  HB1)
    or (resid   75 and name HD11) (resid   75 and name  HB2)
    or (resid   75 and name HD11) (resid   75 and name  HB1)
    or (resid   75 and name HD13) (resid   75 and name  HB2)
    or (resid   75 and name HD13) (resid   75 and name  HB1)
assign (resid 75 and name HD12) (resid 75 and name HD22) 2.251 0.608 1.608
    or (resid   75 and name HD12) (resid   75 and name HD21)
    or (resid   75 and name HD12) (resid   75 and name HD23)
    or (resid   75 and name HD11) (resid   75 and name HD22)
    or (resid   75 and name HD11) (resid   75 and name HD21)
    or (resid   75 and name HD11) (resid   75 and name HD23)
    or (resid   75 and name HD13) (resid   75 and name HD22)
    or (resid   75 and name HD13) (resid   75 and name HD21)
    or (resid   75 and name HD13) (resid   75 and name HD23)
assign (resid 75 and name HB2) (resid 75 and name HD22) 2.294 0.632 1.632
    or (resid   75 and name  HB2) (resid   75 and name HD21)
    or (resid   75 and name  HB2) (resid   75 and name HD23)
    or (resid   75 and name  HB1) (resid   75 and name HD22)
    or (resid   75 and name  HB1) (resid   75 and name HD21)
    or (resid   75 and name  HB1) (resid   75 and name HD23)
assign (resid 75 and name HG) (resid 75 and name HD22) 2.945 1.041 2.041
    or (resid   75 and name   HG) (resid   75 and name HD21)
    or (resid   75 and name   HG) (resid   75 and name HD23)
assign (resid 75 and name HG) (resid 75 and name HN) 3.016 1.092 2.092
assign (resid 76 and name HA) (resid 76 and name HG2) 2.646 0.840 1.84
assign (resid 76 and name HB1) (resid 76 and name HN) 2.950 1.044 2.044
assign (resid 76 and name HB1) (resid 76 and name HG2) 2.420 0.703 1.703
assign (resid 77 and name HA) (resid 77 and name HG12) 2.841 0.969 1.969
assign (resid 77 and name HD12) (resid 77 and name HG11) 2.291 0.630 1.63
    or (resid   77 and name HD11) (resid   77 and name HG11)
    or (resid   77 and name HD13) (resid   77 and name HG11)
assign (resid 77 and name HN) (resid 77 and name HD12) 2.922 1.024 2.024
    or (resid   77 and name   HN) (resid   77 and name HD11)
    or (resid   77 and name   HN) (resid   77 and name HD13)
assign (resid 77 and name HG11) (resid 77 and name HG12) 2.627 0.828 1.828
assign (resid 77 and name HG22) (resid 77 and name HB) 2.478 0.737 1.737
    or (resid   77 and name HG21) (resid   77 and name   HB)
    or (resid   77 and name HG23) (resid   77 and name   HB)
assign (resid 77 and name HG22) (resid 77 and name HG21) 1.453 0.253 1.253
    or (resid   77 and name HG22) (resid   77 and name HG23)
    or (resid   77 and name HG22) (resid   77 and name HG21)
    or (resid   77 and name HG21) (resid   77 and name HG23)
    or (resid   77 and name HG22) (resid   77 and name HG23)
    or (resid   77 and name HG21) (resid   77 and name HG23)
assign (resid 77 and name HA) (resid 77 and name HG22) 2.629 0.830 1.83
    or (resid   77 and name   HA) (resid   77 and name HG21)
    or (resid   77 and name   HA) (resid   77 and name HG23)
assign (resid 77 and name HN) (resid 77 and name HG22) 3.044 1.112 2.112
    or (resid   77 and name   HN) (resid   77 and name HG21)
    or (resid   77 and name   HN) (resid   77 and name HG23)
assign (resid 79 and name HA) (resid 78 and name HB1) 3.101 1.154 2.154
assign (resid 80 and name HA) (resid 80 and name HG2) 2.563 0.788 1.788
assign (resid 80 and name HG1) (resid 80 and name HG2) 1.873 0.421 1.421
assign (resid 81 and name HA) (resid 81 and name HD22) 2.755 0.911 1.911
    or (resid   81 and name   HA) (resid   81 and name HD21)
    or (resid   81 and name   HA) (resid   81 and name HD23)
assign (resid 81 and name HD12) (resid 81 and name HD11) 1.704 0.348 1.348
    or (resid   81 and name HD12) (resid   81 and name HD13)
    or (resid   81 and name HD12) (resid   81 and name HD11)
    or (resid   81 and name HD11) (resid   81 and name HD13)
    or (resid   81 and name HD12) (resid   81 and name HD13)
    or (resid   81 and name HD11) (resid   81 and name HD13)
assign (resid 82 and name HG21) (resid 82 and name HG22) 1.744 0.365 1.365
    or (resid   82 and name HG21) (resid   82 and name HG23)
    or (resid   82 and name HG21) (resid   82 and name HG22)
    or (resid   82 and name HG22) (resid   82 and name HG23)
    or (resid   82 and name HG21) (resid   82 and name HG23)
    or (resid   82 and name HG22) (resid   82 and name HG23)
assign (resid 82 and name HB) (resid 82 and name HG21) 2.785 0.931 1.931
    or (resid   82 and name   HB) (resid   82 and name HG22)
    or (resid   82 and name   HB) (resid   82 and name HG23)
assign (resid 82 and name HA) (resid 82 and name HG21) 2.862 0.983 1.983
    or (resid   82 and name   HA) (resid   82 and name HG22)
    or (resid   82 and name   HA) (resid   82 and name HG23)
assign (resid 84 and name HA) (resid 83 and name HB2) 3.264 1.278 2.278
    or (resid   84 and name   HA) (resid   83 and name  HB1)
    or (resid   84 and name   HA) (resid   83 and name  HB3)
assign (resid 85 and name HN) (resid 85 and name HA) 2.879 0.995 1.995
assign (resid 87 and name HA) (resid 87 and name HB2) 2.643 0.839 1.839
assign (resid 87 and name HA) (resid 87 and name HB1) 2.554 0.782 1.782
assign (resid 87 and name HB1) (resid 87 and name HB2) 2.424 0.705 1.705
assign (resid 87 and name HB1) (resid 87 and name HD2) 3.466 1.442 2.442
assign (resid 87 and name HB2) (resid 87 and name HD2) 3.444 1.424 2.424
assign (resid 88 and name HB2) (resid 88 and name HA) 2.921 1.024 2.024
    or (resid   88 and name  HB1) (resid   88 and name   HA)
assign (resid 88 and name HB2) (resid 88 and name HB1) 1.587 0.302 1.302
    or (resid   88 and name  HB2) (resid   88 and name  HB1)
assign (resid 91 and name HB2) (resid 91 and name HA) 3.184 1.217 2.217
    or (resid   91 and name  HB1) (resid   91 and name   HA)
assign (resid 93 and name HB2) (resid 93 and name HA) 2.439 0.714 1.714
    or (resid   93 and name  HB1) (resid   93 and name   HA)
assign (resid 93 and name HB2) (resid 93 and name HG1) 2.575 0.796 1.796
    or (resid   93 and name  HB1) (resid   93 and name  HG1)
assign (resid 94 and name HB2) (resid 94 and name HA) 2.927 1.028 2.028
    or (resid   94 and name  HB1) (resid   94 and name   HA)
assign (resid 94 and name HE2) (resid 94 and name HD2) 2.469 0.732 1.732
    or (resid   94 and name  HE1) (resid   94 and name  HD2)
assign (resid 94 and name HE2) (resid 94 and name HD1) 2.362 0.669 1.669
    or (resid   94 and name  HE1) (resid   94 and name  HD1)
assign (resid 94 and name HN) (resid 94 and name HG2) 3.183 1.216 2.216
    or (resid   94 and name   HN) (resid   94 and name  HG1)
assign (resid 95 and name HN) (resid 95 and name HA) 3.105 1.157 2.157
assign (resid 97 and name HA) (resid 97 and name HB1) 2.755 0.911 1.911
assign (resid 97 and name HA) (resid 97 and name HB2) 2.987 1.071 2.071
assign (resid 97 and name HB2) (resid 97 and name HB1) 2.502 0.751 1.751
assign (resid 99 and name HA) (resid 99 and name HB2) 2.472 0.733 1.733
    or (resid   99 and name   HA) (resid   99 and name  HB1)
    or (resid   99 and name   HA) (resid   99 and name  HB3)
assign (resid 101 and name HN) (resid 101 and name HB2) 2.068 0.513 1.513
    or (resid  101 and name   HN) (resid  101 and name  HB1)
    or (resid  101 and name   HN) (resid  101 and name  HB3)
assign (resid 101 and name HA) (resid 101 and name HB2) 2.007 0.483 1.483
    or (resid  101 and name   HA) (resid  101 and name  HB1)
    or (resid  101 and name   HA) (resid  101 and name  HB3)
assign (resid 103 and name HA2) (resid 103 and name HA1) 2.497 0.748 1.748
assign (resid 104 and name HA) (resid 104 and name HG11) 2.987 1.071 2.071
assign (resid 104 and name HA) (resid 104 and name HD12) 2.609 0.817 1.817
    or (resid  104 and name   HA) (resid  104 and name HD11)
    or (resid  104 and name   HA) (resid  104 and name HD13)
assign (resid 104 and name HB) (resid 104 and name HD12) 2.953 1.047 2.047
    or (resid  104 and name   HB) (resid  104 and name HD11)
    or (resid  104 and name   HB) (resid  104 and name HD13)
assign (resid 104 and name HD12) (resid 104 and name HG22) 2.188 0.574 1.574
    or (resid  104 and name HD12) (resid  104 and name HG21)
    or (resid  104 and name HD12) (resid  104 and name HG23)
    or (resid  104 and name HD11) (resid  104 and name HG22)
    or (resid  104 and name HD11) (resid  104 and name HG21)
    or (resid  104 and name HD11) (resid  104 and name HG23)
    or (resid  104 and name HD13) (resid  104 and name HG22)
    or (resid  104 and name HD13) (resid  104 and name HG21)
    or (resid  104 and name HD13) (resid  104 and name HG23)
assign (resid 104 and name HG11) (resid 104 and name HG12) 2.449 0.720 1.72
assign (resid 104 and name HG22) (resid 104 and name HG21) 1.527 0.280 1.28
    or (resid  104 and name HG22) (resid  104 and name HG23)
    or (resid  104 and name HG22) (resid  104 and name HG21)
    or (resid  104 and name HG21) (resid  104 and name HG23)
    or (resid  104 and name HG22) (resid  104 and name HG23)
    or (resid  104 and name HG21) (resid  104 and name HG23)
assign (resid 104 and name HB) (resid 104 and name HG22) 2.327 0.650 1.65
    or (resid  104 and name   HB) (resid  104 and name HG21)
    or (resid  104 and name   HB) (resid  104 and name HG23)
assign (resid 104 and name HA) (resid 104 and name HG22) 2.589 0.805 1.805
    or (resid  104 and name   HA) (resid  104 and name HG21)
    or (resid  104 and name   HA) (resid  104 and name HG23)
assign (resid 104 and name HN) (resid 104 and name HG22) 3.071 1.132 2.132
    or (resid  104 and name   HN) (resid  104 and name HG21)
    or (resid  104 and name   HN) (resid  104 and name HG23)
assign (resid 105 and name HG22) (resid 105 and name HB) 2.011 0.485 1.485
    or (resid  105 and name HG21) (resid  105 and name   HB)
    or (resid  105 and name HG23) (resid  105 and name   HB)
assign (resid 105 and name HA) (resid 105 and name HG22) 2.348 0.661 1.661
    or (resid  105 and name   HA) (resid  105 and name HG21)
    or (resid  105 and name   HA) (resid  105 and name HG23)
assign (resid 105 and name HB) (resid 105 and name HG12) 2.036 0.497 1.497
    or (resid  105 and name   HB) (resid  105 and name HG11)
    or (resid  105 and name   HB) (resid  105 and name HG13)
assign (resid 105 and name HA) (resid 105 and name HG12) 2.246 0.605 1.605
    or (resid  105 and name   HA) (resid  105 and name HG11)
    or (resid  105 and name   HA) (resid  105 and name HG13)
assign (resid 105 and name HN) (resid 105 and name HG12) 2.360 0.669 1.669
    or (resid  105 and name   HN) (resid  105 and name HG11)
    or (resid  105 and name   HN) (resid  105 and name HG13)
assign (resid 106 and name HN) (resid 106 and name HB) 2.926 1.028 2.028
assign (resid 106 and name HD12) (resid 106 and name HD11) 1.391 0.232 1.232
    or (resid  106 and name HD12) (resid  106 and name HD13)
    or (resid  106 and name HD12) (resid  106 and name HD11)
    or (resid  106 and name HD11) (resid  106 and name HD13)
    or (resid  106 and name HD12) (resid  106 and name HD13)
    or (resid  106 and name HD11) (resid  106 and name HD13)
assign (resid 106 and name HD12) (resid 106 and name HG12) 2.101 0.530 1.53
    or (resid  106 and name HD11) (resid  106 and name HG12)
    or (resid  106 and name HD13) (resid  106 and name HG12)
assign (resid 106 and name HB) (resid 106 and name HD12) 2.316 0.644 1.644
    or (resid  106 and name   HB) (resid  106 and name HD11)
    or (resid  106 and name   HB) (resid  106 and name HD13)
assign (resid 106 and name HG12) (resid 106 and name HG11) 2.157 0.558 1.558
assign (resid 106 and name HG22) (resid 106 and name HA) 2.429 0.708 1.708
    or (resid  106 and name HG21) (resid  106 and name   HA)
    or (resid  106 and name HG23) (resid  106 and name   HA)
assign (resid 107 and name HB2) (resid 107 and name HB1) 1.825 0.400 1.4
assign (resid 107 and name HB2) (resid 107 and name HA) 2.483 0.740 1.74
assign (resid 107 and name HB1) (resid 107 and name HA) 2.489 0.744 1.744
assign (resid 108 and name HN) (resid 107 and name HB2) 2.800 0.940 1.94
assign (resid 107 and name HB1) (resid 108 and name HN) 2.932 1.032 2.032
assign (resid 107 and name HG2) (resid 107 and name HA) 2.907 1.014 2.014
assign (resid 107 and name HG1) (resid 107 and name HA) 2.875 0.992 1.992
assign (resid 108 and name HA) (resid 108 and name HB2) 2.618 0.822 1.822
assign (resid 108 and name HN) (resid 108 and name HB2) 2.976 1.063 2.063
assign (resid 108 and name HB1) (resid 108 and name HB2) 1.783 0.382 1.382
assign (resid 108 and name HA) (resid 108 and name HG2) 2.661 0.850 1.85
    or (resid  108 and name   HA) (resid  108 and name  HG1)
assign (resid 102 and name HA) (resid 102 and name HB2) 2.643 0.839 1.839
assign (resid 102 and name HN) (resid 102 and name HB2) 3.053 1.118 2.118
assign (resid 102 and name HG2) (resid 102 and name HA) 3.218 1.243 2.243
assign (resid 17 and name HG2) (resid 18 and name HB1) 2.239 0.602 1.602
assign (resid 30 and name HG1) (resid 30 and name HD2) 1.850 0.411 1.411
    or (resid   30 and name  HG1) (resid   30 and name  HD1)
assign (resid 100 and name HN) (resid 100 and name HB1) 2.830 0.961 1.961
assign (resid 100 and name HB1) (resid 100 and name HA) 2.618 0.822 1.822
assign (resid 4 and name HB2) (resid 4 and name HA) 2.768 0.920 1.92
assign (resid 4 and name HB2) (resid 4 and name HN) 3.156 1.195 2.195
assign (resid 4 and name HB2) (resid 4 and name HG2) 2.837 0.966 1.966
    or (resid    4 and name  HB2) (resid    4 and name  HG1)
assign (resid 4 and name HB1) (resid 4 and name HG2) 2.837 0.966 1.966
    or (resid    4 and name  HB1) (resid    4 and name  HG1)
assign (resid 5 and name HA) (resid 23 and name HA) 2.765 0.917 1.917
assign (resid 8 and name HN) (resid 8 and name HG22) 2.706 0.879 1.879
    or (resid    8 and name   HN) (resid    8 and name HG21)
    or (resid    8 and name   HN) (resid    8 and name HG23)
assign (resid 8 and name HG22) (resid 8 and name HG12) 2.497 0.748 1.748
    or (resid    8 and name HG21) (resid    8 and name HG12)
    or (resid    8 and name HG23) (resid    8 and name HG12)
assign (resid 8 and name HB) (resid 8 and name HG12) 2.983 1.068 2.068
assign (resid 8 and name HB) (resid 8 and name HA) 2.752 0.909 1.909
assign (resid 8 and name HA) (resid 8 and name HG12) 3.562 1.523 2.523
assign (resid 8 and name HG11) (resid 7 and name HA) 3.670 1.617 2.617
assign (resid 8 and name HG11) (resid 4 and name HA) 3.656 1.604 2.604
assign (resid 8 and name HG11) (resid 8 and name HB) 2.980 1.066 2.066
assign (resid 8 and name HD12) (resid 8 and name HN) 3.256 1.272 2.272
    or (resid    8 and name HD11) (resid    8 and name   HN)
    or (resid    8 and name HD13) (resid    8 and name   HN)
assign (resid 9 and name HD21) (resid 9 and name HB1) 3.180 1.214 2.214
assign (resid 9 and name HB2) (resid 9 and name HA) 3.130 1.176 2.176
assign (resid 9 and name HB1) (resid 8 and name HA) 3.468 1.443 2.443
assign (resid 9 and name HB1) (resid 12 and name HB1) 3.315 1.319 2.319
assign (resid 9 and name HN) (resid 9 and name HB2) 3.062 1.125 2.125
assign (resid 5 and name HA) (resid 9 and name HB1) 3.165 1.202 2.202
assign (resid 10 and name HA) (resid 13 and name HB) 2.742 0.902 1.902
assign (resid 10 and name HG) (resid 41 and name HB2) 3.373 1.365 2.365
    or (resid   10 and name   HG) (resid   41 and name  HB1)
assign (resid 10 and name HG) (resid 41 and name HG1) 2.943 1.040 2.04
assign (resid 106 and name HG11) (resid 100 and name HD1) 2.709 0.881 1.881
assign (resid 10 and name HG) (resid 10 and name HB2) 2.916 1.020 2.02
assign (resid 10 and name HD12) (resid 44 and name HD12) 2.316 0.644 1.644
    or (resid   10 and name HD12) (resid   44 and name HD11)
    or (resid   10 and name HD12) (resid   44 and name HD13)
    or (resid   10 and name HD11) (resid   44 and name HD12)
    or (resid   10 and name HD11) (resid   44 and name HD11)
    or (resid   10 and name HD11) (resid   44 and name HD13)
    or (resid   10 and name HD13) (resid   44 and name HD12)
    or (resid   10 and name HD13) (resid   44 and name HD11)
    or (resid   10 and name HD13) (resid   44 and name HD13)
assign (resid 10 and name HD22) (resid 10 and name HA) 3.519 1.486 2.486
    or (resid   10 and name HD21) (resid   10 and name   HA)
    or (resid   10 and name HD23) (resid   10 and name   HA)
assign (resid 11 and name HA) (resid 11 and name HB2) 2.911 1.017 2.017
assign (resid 11 and name HA) (resid 14 and name HD22) 2.974 1.062 2.062
    or (resid   11 and name   HA) (resid   14 and name HD21)
    or (resid   11 and name   HA) (resid   14 and name HD23)
assign (resid 87 and name HG2) (resid 88 and name HN) 3.496 1.467 2.467
assign (resid 11 and name HB1) (resid 11 and name HG2) 2.571 0.793 1.793
    or (resid   11 and name  HB1) (resid   11 and name  HG1)
assign (resid 11 and name HB1) (resid 11 and name HB2) 2.152 0.556 1.556
assign (resid 11 and name HE21) (resid 11 and name HG2) 2.690 0.868 1.868
    or (resid   11 and name HE21) (resid   11 and name  HG1)
assign (resid 11 and name HG2) (resid 12 and name HN) 3.428 1.410 2.41
    or (resid   11 and name  HG1) (resid   12 and name   HN)
assign (resid 11 and name HG2) (resid 11 and name HG1) 1.591 0.304 1.304
    or (resid   11 and name  HG2) (resid   11 and name  HG1)
assign (resid 11 and name HG2) (resid 65 and name HG21) 3.366 1.360 2.36
    or (resid   11 and name  HG2) (resid   65 and name HG22)
    or (resid   11 and name  HG2) (resid   65 and name HG23)
    or (resid   11 and name  HG1) (resid   65 and name HG21)
    or (resid   11 and name  HG1) (resid   65 and name HG22)
    or (resid   11 and name  HG1) (resid   65 and name HG23)
assign (resid 13 and name HN) (resid 12 and name HA) 3.162 1.200 2.2
assign (resid 12 and name HB2) (resid 9 and name HA) 3.692 1.636 2.636
assign (resid 12 and name HB2) (resid 12 and name HG2) 2.076 0.517 1.517
    or (resid   12 and name  HB2) (resid   12 and name  HG1)
assign (resid 18 and name HB1) (resid 18 and name HA) 2.822 0.956 1.956
assign (resid 12 and name HB1) (resid 12 and name HA) 2.663 0.851 1.851
assign (resid 12 and name HB1) (resid 12 and name HG2) 2.158 0.559 1.559
    or (resid   12 and name  HB1) (resid   12 and name  HG1)
assign (resid 13 and name HB) (resid 9 and name HD22) 3.370 1.363 2.363
assign (resid 13 and name HG11) (resid 23 and name HB2) 3.116 1.165 2.165
assign (resid 13 and name HG22) (resid 14 and name HA) 2.695 0.872 1.872
    or (resid   13 and name HG21) (resid   14 and name   HA)
    or (resid   13 and name HG23) (resid   14 and name   HA)
assign (resid 13 and name HB) (resid 13 and name HG22) 2.573 0.794 1.794
    or (resid   13 and name   HB) (resid   13 and name HG21)
    or (resid   13 and name   HB) (resid   13 and name HG23)
assign (resid 13 and name HG22) (resid 13 and name HG11) 2.478 0.737 1.737
    or (resid   13 and name HG21) (resid   13 and name HG11)
    or (resid   13 and name HG23) (resid   13 and name HG11)
assign (resid 13 and name HD12) (resid 13 and name HA) 3.109 1.160 2.16
    or (resid   13 and name HD11) (resid   13 and name   HA)
    or (resid   13 and name HD13) (resid   13 and name   HA)
assign (resid 13 and name HD12) (resid 13 and name HB) 2.782 0.929 1.929
    or (resid   13 and name HD11) (resid   13 and name   HB)
    or (resid   13 and name HD13) (resid   13 and name   HB)
assign (resid 14 and name HA) (resid 14 and name HB2) 2.796 0.938 1.938
assign (resid 14 and name HA) (resid 14 and name HB1) 2.749 0.907 1.907
assign (resid 14 and name HA) (resid 20 and name HD12) 2.778 0.926 1.926
    or (resid   14 and name   HA) (resid   20 and name HD11)
    or (resid   14 and name   HA) (resid   20 and name HD13)
assign (resid 14 and name HD12) (resid 14 and name HN) 3.151 1.192 2.192
    or (resid   14 and name HD11) (resid   14 and name   HN)
    or (resid   14 and name HD13) (resid   14 and name   HN)
assign (resid 14 and name HD12) (resid 70 and name HG) 3.233 1.254 2.254
    or (resid   14 and name HD11) (resid   70 and name   HG)
    or (resid   14 and name HD13) (resid   70 and name   HG)
assign (resid 40 and name HD22) (resid 36 and name HG1) 3.394 1.383 2.383
    or (resid   40 and name HD21) (resid   36 and name  HG1)
    or (resid   40 and name HD23) (resid   36 and name  HG1)
assign (resid 14 and name HD12) (resid 14 and name HG) 2.858 0.980 1.98
    or (resid   14 and name HD11) (resid   14 and name   HG)
    or (resid   14 and name HD13) (resid   14 and name   HG)
assign (resid 14 and name HD22) (resid 70 and name HG) 3.077 1.136 2.136
    or (resid   14 and name HD21) (resid   70 and name   HG)
    or (resid   14 and name HD23) (resid   70 and name   HG)
assign (resid 14 and name HD22) (resid 14 and name HG) 2.627 0.828 1.828
    or (resid   14 and name HD21) (resid   14 and name   HG)
    or (resid   14 and name HD23) (resid   14 and name   HG)
assign (resid 14 and name HD22) (resid 14 and name HB1) 2.646 0.840 1.84
    or (resid   14 and name HD21) (resid   14 and name  HB1)
    or (resid   14 and name HD23) (resid   14 and name  HB1)
assign (resid 15 and name HA) (resid 15 and name HG2) 3.206 1.233 2.233
    or (resid   15 and name   HA) (resid   15 and name  HG1)
assign (resid 15 and name HA) (resid 15 and name HB1) 2.911 1.017 2.017
assign (resid 17 and name HA) (resid 20 and name HN) 3.291 1.299 2.299
assign (resid 38 and name HB2) (resid 38 and name HG2) 2.548 0.779 1.779
assign (resid 17 and name HG2) (resid 17 and name HE2) 2.964 1.055 2.055
assign (resid 17 and name HG2) (resid 21 and name HG1) 3.132 1.177 2.177
assign (resid 18 and name HA) (resid 21 and name HG1) 3.044 1.112 2.112
assign (resid 19 and name HA) (resid 19 and name HB1) 2.969 1.058 2.058
assign (resid 19 and name HD12) (resid 16 and name HD21) 3.214 1.240 2.24
    or (resid   19 and name HD11) (resid   16 and name HD21)
    or (resid   19 and name HD13) (resid   16 and name HD21)
assign (resid 19 and name HD12) (resid 16 and name HB2) 3.180 1.213 2.213
    or (resid   19 and name HD11) (resid   16 and name  HB2)
    or (resid   19 and name HD13) (resid   16 and name  HB2)
assign (resid 20 and name HA) (resid 20 and name HD12) 2.858 0.980 1.98
    or (resid   20 and name   HA) (resid   20 and name HD11)
    or (resid   20 and name   HA) (resid   20 and name HD13)
assign (resid 20 and name HD12) (resid 20 and name HD22) 2.175 0.568 1.568
    or (resid   20 and name HD12) (resid   20 and name HD21)
    or (resid   20 and name HD12) (resid   20 and name HD23)
    or (resid   20 and name HD11) (resid   20 and name HD22)
    or (resid   20 and name HD11) (resid   20 and name HD21)
    or (resid   20 and name HD11) (resid   20 and name HD23)
    or (resid   20 and name HD13) (resid   20 and name HD22)
    or (resid   20 and name HD13) (resid   20 and name HD21)
    or (resid   20 and name HD13) (resid   20 and name HD23)
assign (resid 20 and name HA) (resid 20 and name HD22) 2.373 0.676 1.676
    or (resid   20 and name   HA) (resid   20 and name HD21)
    or (resid   20 and name   HA) (resid   20 and name HD23)
assign (resid 41 and name HA) (resid 43 and name HB2) 3.381 1.371 2.371
assign (resid 41 and name HA) (resid 41 and name HG2) 3.020 1.094 2.094
assign (resid 21 and name HG2) (resid 21 and name HB2) 2.833 0.963 1.963
assign (resid 21 and name HG1) (resid 21 and name HA) 2.884 0.998 1.998
assign (resid 21 and name HG1) (resid 21 and name HN) 3.117 1.166 2.166
assign (resid 27 and name HB) (resid 28 and name HD22) 3.590 1.547 2.547
    or (resid   27 and name   HB) (resid   28 and name HD21)
    or (resid   27 and name   HB) (resid   28 and name HD23)
assign (resid 27 and name HB) (resid 27 and name HG12) 2.629 0.830 1.83
    or (resid   27 and name   HB) (resid   27 and name HG11)
    or (resid   27 and name   HB) (resid   27 and name HG13)
assign (resid 27 and name HG12) (resid 24 and name HA) 2.943 1.039 2.039
    or (resid   27 and name HG11) (resid   24 and name   HA)
    or (resid   27 and name HG13) (resid   24 and name   HA)
assign (resid 27 and name HG12) (resid 28 and name HB1) 2.792 0.936 1.936
    or (resid   27 and name HG11) (resid   28 and name  HB1)
    or (resid   27 and name HG13) (resid   28 and name  HB1)
assign (resid 28 and name HB2) (resid 28 and name HD12) 3.322 1.324 2.324
    or (resid   28 and name  HB2) (resid   28 and name HD11)
    or (resid   28 and name  HB2) (resid   28 and name HD13)
assign (resid 30 and name HB1) (resid 30 and name HN) 3.713 1.654 2.654
assign (resid 30 and name HG2) (resid 30 and name HA) 3.423 1.406 2.406
assign (resid 30 and name HG2) (resid 30 and name HE2) 3.229 1.251 2.251
    or (resid   30 and name  HG2) (resid   30 and name  HE1)
assign (resid 100 and name HG2) (resid 108 and name HB1) 2.850 0.974 1.974
    or (resid  100 and name  HG1) (resid  108 and name  HB1)
assign (resid 17 and name HD2) (resid 16 and name HA) 2.811 0.948 1.948
assign (resid 30 and name HE2) (resid 30 and name HD2) 2.162 0.561 1.561
    or (resid   30 and name  HE2) (resid   30 and name  HD1)
    or (resid   30 and name  HE1) (resid   30 and name  HD2)
    or (resid   30 and name  HE1) (resid   30 and name  HD1)
assign (resid 31 and name HA2) (resid 32 and name HN) 2.775 0.924 1.924
assign (resid 31 and name HA2) (resid 25 and name HB1) 3.085 1.142 2.142
assign (resid 34 and name HG21) (resid 33 and name HA) 2.845 0.972 1.972
    or (resid   34 and name HG22) (resid   33 and name   HA)
    or (resid   34 and name HG23) (resid   33 and name   HA)
assign (resid 36 and name HG1) (resid 40 and name HN) 3.055 1.120 2.12
assign (resid 80 and name HG1) (resid 79 and name HB2) 2.446 0.718 1.718
assign (resid 38 and name HB1) (resid 38 and name HB2) 2.395 0.688 1.688
assign (resid 32 and name HG2) (resid 31 and name HA1) 3.162 1.200 2.2
assign (resid 38 and name HG2) (resid 33 and name HB1) 3.186 1.218 2.218
assign (resid 94 and name HG2) (resid 94 and name HE2) 2.939 1.036 2.036
    or (resid   94 and name  HG2) (resid   94 and name  HE1)
    or (resid   94 and name  HG1) (resid   94 and name  HE2)
    or (resid   94 and name  HG1) (resid   94 and name  HE1)
assign (resid 80 and name HG1) (resid 77 and name HA) 2.811 0.948 1.948
assign (resid 80 and name HG1) (resid 77 and name HD12) 3.124 1.171 2.171
    or (resid   80 and name  HG1) (resid   77 and name HD11)
    or (resid   80 and name  HG1) (resid   77 and name HD13)
assign (resid 41 and name HN) (resid 39 and name HA) 3.153 1.193 2.193
assign (resid 57 and name HB2) (resid 57 and name HN) 2.875 0.992 1.992
assign (resid 39 and name HB1) (resid 42 and name HB1) 3.245 1.263 2.263
assign (resid 40 and name HD12) (resid 40 and name HB2) 2.792 0.936 1.936
    or (resid   40 and name HD11) (resid   40 and name  HB2)
    or (resid   40 and name HD13) (resid   40 and name  HB2)
assign (resid 106 and name HG12) (resid 107 and name HB1) 3.685 1.630 2.63
assign (resid 41 and name HA) (resid 41 and name HD1) 2.833 0.963 1.963
assign (resid 43 and name HB2) (resid 43 and name HA) 3.708 1.650 2.65
assign (resid 46 and name HG2) (resid 46 and name HA) 2.565 0.790 1.79
    or (resid   46 and name  HG1) (resid   46 and name   HA)
assign (resid 46 and name HA) (resid 46 and name HB1) 2.975 1.062 2.062
assign (resid 47 and name HA) (resid 46 and name HG2) 3.349 1.346 2.346
    or (resid   47 and name   HA) (resid   46 and name  HG1)
assign (resid 47 and name HB2) (resid 60 and name HA) 3.229 1.251 2.251
    or (resid   47 and name  HB1) (resid   60 and name   HA)
    or (resid   47 and name  HB3) (resid   60 and name   HA)
assign (resid 47 and name HB2) (resid 48 and name HA) 3.474 1.449 2.449
    or (resid   47 and name  HB1) (resid   48 and name   HA)
    or (resid   47 and name  HB3) (resid   48 and name   HA)
assign (resid 52 and name HA) (resid 54 and name HG1) 3.369 1.362 2.362
assign (resid 54 and name HA) (resid 55 and name HA) 3.130 1.175 2.175
assign (resid 108 and name HB2) (resid 108 and name HG2) 1.936 0.450 1.45
    or (resid  108 and name  HB2) (resid  108 and name  HG1)
assign (resid 54 and name HD2) (resid 55 and name HA) 2.778 0.926 1.926
    or (resid   54 and name  HD1) (resid   55 and name   HA)
assign (resid 54 and name HD2) (resid 54 and name HB2) 2.293 0.631 1.631
    or (resid   54 and name  HD2) (resid   54 and name  HB1)
    or (resid   54 and name  HD1) (resid   54 and name  HB2)
    or (resid   54 and name  HD1) (resid   54 and name  HB1)
assign (resid 56 and name HN) (resid 55 and name HA) 2.676 0.859 1.859
assign (resid 58 and name HN) (resid 56 and name HA) 2.854 0.977 1.977
assign (resid 57 and name HN) (resid 56 and name HG21) 2.559 0.786 1.786
    or (resid   57 and name   HN) (resid   56 and name HG22)
    or (resid   57 and name   HN) (resid   56 and name HG23)
assign (resid 57 and name HB2) (resid 57 and name HA) 2.573 0.794 1.794
assign (resid 58 and name HA) (resid 61 and name HB2) 2.814 0.950 1.95
    or (resid   58 and name   HA) (resid   61 and name  HB1)
assign (resid 58 and name HB2) (resid 57 and name HG2) 2.850 0.974 1.974
    or (resid   58 and name  HB1) (resid   57 and name  HG2)
    or (resid   58 and name  HB3) (resid   57 and name  HG2)
assign (resid 60 and name HA) (resid 60 and name HG1) 2.648 0.842 1.842
assign (resid 75 and name HA) (resid 71 and name HA) 3.244 1.263 2.263
assign (resid 61 and name HB2) (resid 61 and name HG2) 2.676 0.859 1.859
    or (resid   61 and name  HB2) (resid   61 and name  HG1)
    or (resid   61 and name  HB1) (resid   61 and name  HG2)
    or (resid   61 and name  HB1) (resid   61 and name  HG1)
assign (resid 93 and name HG1) (resid 97 and name HB2) 3.598 1.554 2.554
assign (resid 63 and name HB2) (resid 67 and name HD12) 2.923 1.025 2.025
    or (resid   63 and name  HB2) (resid   67 and name HD11)
    or (resid   63 and name  HB2) (resid   67 and name HD13)
    or (resid   63 and name  HB1) (resid   67 and name HD12)
    or (resid   63 and name  HB1) (resid   67 and name HD11)
    or (resid   63 and name  HB1) (resid   67 and name HD13)
    or (resid   63 and name  HB3) (resid   67 and name HD12)
    or (resid   63 and name  HB3) (resid   67 and name HD11)
    or (resid   63 and name  HB3) (resid   67 and name HD13)
assign (resid 60 and name HA) (resid 63 and name HB2) 2.690 0.868 1.868
    or (resid   60 and name   HA) (resid   63 and name  HB1)
    or (resid   60 and name   HA) (resid   63 and name  HB3)
assign (resid 67 and name HG12) (resid 98 and name HB2) 3.033 1.104 2.104
assign (resid 67 and name HA) (resid 67 and name HG22) 2.902 1.010 2.01
    or (resid   67 and name   HA) (resid   67 and name HG21)
    or (resid   67 and name   HA) (resid   67 and name HG23)
assign (resid 67 and name HB) (resid 67 and name HD12) 3.119 1.168 2.168
    or (resid   67 and name   HB) (resid   67 and name HD11)
    or (resid   67 and name   HB) (resid   67 and name HD13)
assign (resid 67 and name HD12) (resid 67 and name HG12) 2.875 0.992 1.992
    or (resid   67 and name HD11) (resid   67 and name HG12)
    or (resid   67 and name HD13) (resid   67 and name HG12)
assign (resid 67 and name HG11) (resid 67 and name HD12) 2.811 0.948 1.948
    or (resid   67 and name HG11) (resid   67 and name HD11)
    or (resid   67 and name HG11) (resid   67 and name HD13)
assign (resid 68 and name HA) (resid 104 and name HG12) 2.923 1.025 2.025
assign (resid 70 and name HD12) (resid 14 and name HG) 2.739 0.900 1.9
    or (resid   70 and name HD11) (resid   14 and name   HG)
    or (resid   70 and name HD13) (resid   14 and name   HG)
assign (resid 71 and name HG22) (resid 72 and name HA) 3.071 1.132 2.132
    or (resid   71 and name HG21) (resid   72 and name   HA)
    or (resid   71 and name HG23) (resid   72 and name   HA)
assign (resid 71 and name HG22) (resid 106 and name HG22) 2.676 0.859 1.859
    or (resid   71 and name HG22) (resid  106 and name HG21)
    or (resid   71 and name HG22) (resid  106 and name HG23)
    or (resid   71 and name HG21) (resid  106 and name HG22)
    or (resid   71 and name HG21) (resid  106 and name HG21)
    or (resid   71 and name HG21) (resid  106 and name HG23)
    or (resid   71 and name HG23) (resid  106 and name HG22)
    or (resid   71 and name HG23) (resid  106 and name HG21)
    or (resid   71 and name HG23) (resid  106 and name HG23)
assign (resid 71 and name HG22) (resid 104 and name HG22) 2.254 0.609 1.609
    or (resid   71 and name HG22) (resid  104 and name HG21)
    or (resid   71 and name HG22) (resid  104 and name HG23)
    or (resid   71 and name HG21) (resid  104 and name HG22)
    or (resid   71 and name HG21) (resid  104 and name HG21)
    or (resid   71 and name HG21) (resid  104 and name HG23)
    or (resid   71 and name HG23) (resid  104 and name HG22)
    or (resid   71 and name HG23) (resid  104 and name HG21)
    or (resid   71 and name HG23) (resid  104 and name HG23)
assign (resid 72 and name HA) (resid 72 and name HG1) 3.054 1.119 2.119
assign (resid 72 and name HB2) (resid 72 and name HG2) 3.310 1.315 2.315
    or (resid   72 and name  HB1) (resid   72 and name  HG2)
assign (resid 75 and name HA) (resid 78 and name HB2) 3.135 1.179 2.179
assign (resid 75 and name HN) (resid 75 and name HD22) 3.468 1.443 2.443
    or (resid   75 and name   HN) (resid   75 and name HD21)
    or (resid   75 and name   HN) (resid   75 and name HD23)
assign (resid 76 and name HA) (resid 76 and name HB2) 2.548 0.779 1.779
assign (resid 77 and name HN) (resid 76 and name HB1) 3.517 1.485 2.485
assign (resid 76 and name HB1) (resid 76 and name HA) 2.742 0.902 1.902
assign (resid 76 and name HB2) (resid 77 and name HA) 3.152 1.192 2.192
assign (resid 77 and name HA) (resid 77 and name HB) 3.133 1.178 2.178
assign (resid 80 and name HG2) (resid 77 and name HA) 3.075 1.135 2.135
assign (resid 77 and name HG22) (resid 81 and name HG) 2.604 0.814 1.814
    or (resid   77 and name HG21) (resid   81 and name   HG)
    or (resid   77 and name HG23) (resid   81 and name   HG)
assign (resid 77 and name HG22) (resid 77 and name HG11) 2.600 0.811 1.811
    or (resid   77 and name HG21) (resid   77 and name HG11)
    or (resid   77 and name HG23) (resid   77 and name HG11)
assign (resid 77 and name HA) (resid 77 and name HD12) 3.006 1.084 2.084
    or (resid   77 and name   HA) (resid   77 and name HD11)
    or (resid   77 and name   HA) (resid   77 and name HD13)
assign (resid 77 and name HD12) (resid 20 and name HG) 2.706 0.879 1.879
    or (resid   77 and name HD11) (resid   20 and name   HG)
    or (resid   77 and name HD13) (resid   20 and name   HG)
assign (resid 80 and name HA) (resid 83 and name HB2) 2.932 1.031 2.031
    or (resid   80 and name   HA) (resid   83 and name  HB1)
    or (resid   80 and name   HA) (resid   83 and name  HB3)
assign (resid 80 and name HG1) (resid 80 and name HA) 2.897 1.007 2.007
assign (resid 81 and name HB2) (resid 81 and name HD12) 3.508 1.477 2.477
    or (resid   81 and name  HB2) (resid   81 and name HD11)
    or (resid   81 and name  HB2) (resid   81 and name HD13)
assign (resid 81 and name HB1) (resid 81 and name HD22) 3.214 1.240 2.24
    or (resid   81 and name  HB1) (resid   81 and name HD21)
    or (resid   81 and name  HB1) (resid   81 and name HD23)
assign (resid 83 and name HA) (resid 87 and name HA) 3.273 1.286 2.286
assign (resid 84 and name HN) (resid 83 and name HB2) 2.521 0.763 1.763
    or (resid   84 and name   HN) (resid   83 and name  HB1)
    or (resid   84 and name   HN) (resid   83 and name  HB3)
assign (resid 83 and name HA) (resid 83 and name HB2) 2.135 0.547 1.547
    or (resid   83 and name   HA) (resid   83 and name  HB1)
    or (resid   83 and name   HA) (resid   83 and name  HB3)
assign (resid 84 and name HA) (resid 84 and name HB1) 2.939 1.037 2.037
assign (resid 86 and name HA) (resid 86 and name HB2) 3.103 1.156 2.156
assign (resid 87 and name HB1) (resid 82 and name HA) 3.550 1.513 2.513
assign (resid 93 and name HB2) (resid 93 and name HG2) 2.611 0.818 1.818
    or (resid   93 and name  HB1) (resid   93 and name  HG2)
assign (resid 38 and name HG2) (resid 35 and name HA) 2.845 0.972 1.972
assign (resid 7 and name HG2) (resid 36 and name HG1) 3.079 1.138 2.138
    or (resid    7 and name  HG1) (resid   36 and name  HG1)
assign (resid 97 and name HB2) (resid 97 and name HN) 3.130 1.176 2.176
assign (resid 99 and name HA) (resid 102 and name HG1) 3.261 1.276 2.276
assign (resid 99 and name HA) (resid 104 and name HG12) 2.830 0.961 1.961
assign (resid 99 and name HB2) (resid 100 and name HA) 2.943 1.040 2.04
    or (resid   99 and name  HB1) (resid  100 and name   HA)
    or (resid   99 and name  HB3) (resid  100 and name   HA)
assign (resid 71 and name HD12) (resid 99 and name HB2) 2.423 0.704 1.704
    or (resid   71 and name HD12) (resid   99 and name  HB1)
    or (resid   71 and name HD12) (resid   99 and name  HB3)
    or (resid   71 and name HD11) (resid   99 and name  HB2)
    or (resid   71 and name HD11) (resid   99 and name  HB1)
    or (resid   71 and name HD11) (resid   99 and name  HB3)
    or (resid   71 and name HD13) (resid   99 and name  HB2)
    or (resid   71 and name HD13) (resid   99 and name  HB1)
    or (resid   71 and name HD13) (resid   99 and name  HB3)
assign (resid 71 and name HG22) (resid 99 and name HB2) 2.502 0.751 1.751
    or (resid   71 and name HG22) (resid   99 and name  HB1)
    or (resid   71 and name HG22) (resid   99 and name  HB3)
    or (resid   71 and name HG21) (resid   99 and name  HB2)
    or (resid   71 and name HG21) (resid   99 and name  HB1)
    or (resid   71 and name HG21) (resid   99 and name  HB3)
    or (resid   71 and name HG23) (resid   99 and name  HB2)
    or (resid   71 and name HG23) (resid   99 and name  HB1)
    or (resid   71 and name HG23) (resid   99 and name  HB3)
assign (resid 101 and name HB2) (resid 102 and name HN) 2.524 0.765 1.765
    or (resid  101 and name  HB1) (resid  102 and name   HN)
    or (resid  101 and name  HB3) (resid  102 and name   HN)
assign (resid 101 and name HB2) (resid 98 and name HA) 2.384 0.682 1.682
    or (resid  101 and name  HB1) (resid   98 and name   HA)
    or (resid  101 and name  HB3) (resid   98 and name   HA)
assign (resid 17 and name HB1) (resid 18 and name HN) 3.264 1.278 2.278
assign (resid 38 and name HB1) (resid 39 and name HA) 3.248 1.266 2.266
assign (resid 102 and name HB1) (resid 64 and name HA) 3.229 1.251 2.251
assign (resid 104 and name HG12) (resid 104 and name HG22) 3.229 1.251 2.251
    or (resid  104 and name HG12) (resid  104 and name HG21)
    or (resid  104 and name HG12) (resid  104 and name HG23)
assign (resid 104 and name HG12) (resid 72 and name HD2) 3.166 1.203 2.203
    or (resid  104 and name HG12) (resid   72 and name  HD1)
assign (resid 104 and name HG12) (resid 104 and name HA) 3.508 1.477 2.477
assign (resid 104 and name HG12) (resid 104 and name HN) 3.687 1.632 2.632
assign (resid 104 and name HG11) (resid 71 and name HB) 3.300 1.307 2.307
assign (resid 72 and name HB2) (resid 104 and name HG22) 2.561 0.787 1.787
    or (resid   72 and name  HB2) (resid  104 and name HG21)
    or (resid   72 and name  HB2) (resid  104 and name HG23)
    or (resid   72 and name  HB1) (resid  104 and name HG22)
    or (resid   72 and name  HB1) (resid  104 and name HG21)
    or (resid   72 and name  HB1) (resid  104 and name HG23)
assign (resid 72 and name HA) (resid 104 and name HG22) 2.749 0.907 1.907
    or (resid   72 and name   HA) (resid  104 and name HG21)
    or (resid   72 and name   HA) (resid  104 and name HG23)
assign (resid 104 and name HG22) (resid 105 and name HA) 2.946 1.042 2.042
    or (resid  104 and name HG21) (resid  105 and name   HA)
    or (resid  104 and name HG23) (resid  105 and name   HA)
assign (resid 104 and name HD12) (resid 72 and name HD2) 2.305 0.638 1.638
    or (resid  104 and name HD12) (resid   72 and name  HD1)
    or (resid  104 and name HD11) (resid   72 and name  HD2)
    or (resid  104 and name HD11) (resid   72 and name  HD1)
    or (resid  104 and name HD13) (resid   72 and name  HD2)
    or (resid  104 and name HD13) (resid   72 and name  HD1)
assign (resid 104 and name HD12) (resid 104 and name HG11) 2.023 0.491 1.491
    or (resid  104 and name HD11) (resid  104 and name HG11)
    or (resid  104 and name HD13) (resid  104 and name HG11)
assign (resid 105 and name HA) (resid 105 and name HB) 3.015 1.091 2.091
assign (resid 104 and name HA) (resid 105 and name HG12) 2.792 0.936 1.936
    or (resid  104 and name   HA) (resid  105 and name HG11)
    or (resid  104 and name   HA) (resid  105 and name HG13)
assign (resid 106 and name HG11) (resid 106 and name HG22) 2.501 0.750 1.75
    or (resid  106 and name HG11) (resid  106 and name HG21)
    or (resid  106 and name HG11) (resid  106 and name HG23)
assign (resid 106 and name HG11) (resid 106 and name HA) 3.160 1.198 2.198
assign (resid 106 and name HB) (resid 106 and name HG12) 2.893 1.004 2.004
assign (resid 106 and name HG12) (resid 106 and name HA) 3.331 1.331 2.331
assign (resid 106 and name HG11) (resid 106 and name HN) 3.410 1.395 2.395
assign (resid 106 and name HB) (resid 106 and name HG22) 2.170 0.565 1.565
    or (resid  106 and name   HB) (resid  106 and name HG21)
    or (resid  106 and name   HB) (resid  106 and name HG23)
assign (resid 106 and name HD12) (resid 96 and name HB2) 2.671 0.856 1.856
    or (resid  106 and name HD12) (resid   96 and name  HB1)
    or (resid  106 and name HD11) (resid   96 and name  HB2)
    or (resid  106 and name HD11) (resid   96 and name  HB1)
    or (resid  106 and name HD13) (resid   96 and name  HB2)
    or (resid  106 and name HD13) (resid   96 and name  HB1)
assign (resid 107 and name HG2) (resid 107 and name HB2) 2.163 0.561 1.561
assign (resid 107 and name HG1) (resid 107 and name HB2) 2.125 0.542 1.542
assign (resid 108 and name HA) (resid 108 and name HB1) 2.701 0.875 1.875
assign (resid 3 and name HN) (resid 7 and name HN) 3.451 1.430 2.43
assign (resid 3 and name HN) (resid 2 and name HN) 3.448 1.427 2.427
assign (resid 10 and name HN) (resid 9 and name HA) 2.433 0.710 1.71
assign (resid 3 and name HN) (resid 2 and name HB) 3.401 1.388 2.388
assign (resid 10 and name HN) (resid 10 and name HA) 2.932 1.032 2.032
assign (resid 10 and name HN) (resid 9 and name HB1) 3.214 1.240 2.24
assign (resid 3 and name HN) (resid 7 and name HB2) 3.537 1.501 2.501
    or (resid    3 and name   HN) (resid    7 and name  HB1)
assign (resid 10 and name HN) (resid 10 and name HB2) 2.423 0.705 1.705
assign (resid 10 and name HN) (resid 10 and name HB1) 2.959 1.050 2.05
assign (resid 10 and name HN) (resid 10 and name HD12) 3.095 1.150 2.15
    or (resid   10 and name   HN) (resid   10 and name HD11)
    or (resid   10 and name   HN) (resid   10 and name HD13)
assign (resid 10 and name HN) (resid 10 and name HD22) 3.403 1.390 2.39
    or (resid   10 and name   HN) (resid   10 and name HD21)
    or (resid   10 and name   HN) (resid   10 and name HD23)
assign (resid 4 and name HN) (resid 9 and name HN) 3.247 1.265 2.265
assign (resid 5 and name HN) (resid 7 and name HN) 2.859 0.981 1.981
assign (resid 4 and name HN) (resid 4 and name HA) 2.722 0.889 1.889
assign (resid 4 and name HN) (resid 7 and name HB2) 3.405 1.391 2.391
    or (resid    4 and name   HN) (resid    7 and name  HB1)
assign (resid 5 and name HN) (resid 4 and name HB2) 2.956 1.049 2.049
assign (resid 4 and name HN) (resid 4 and name HB1) 2.557 0.784 1.784
assign (resid 70 and name HN) (resid 68 and name HN) 3.160 1.198 2.198
assign (resid 5 and name HN) (resid 4 and name HA) 2.634 0.832 1.832
assign (resid 70 and name HN) (resid 70 and name HA) 2.903 1.011 2.011
assign (resid 70 and name HN) (resid 67 and name HA) 2.859 0.981 1.981
assign (resid 5 and name HN) (resid 5 and name HB1) 2.981 1.066 2.066
assign (resid 5 and name HN) (resid 5 and name HB2) 2.768 0.919 1.919
assign (resid 5 and name HN) (resid 9 and name HB2) 3.159 1.197 2.197
assign (resid 70 and name HN) (resid 70 and name HG) 2.524 0.765 1.765
assign (resid 5 and name HN) (resid 4 and name HG2) 3.077 1.136 2.136
    or (resid    5 and name   HN) (resid    4 and name  HG1)
assign (resid 70 and name HN) (resid 14 and name HD22) 2.995 1.077 2.077
    or (resid   70 and name   HN) (resid   14 and name HD21)
    or (resid   70 and name   HN) (resid   14 and name HD23)
assign (resid 6 and name HN) (resid 9 and name HN) 3.498 1.468 2.468
assign (resid 6 and name HN) (resid 9 and name HD22) 3.472 1.446 2.446
assign (resid 6 and name HN) (resid 33 and name HA) 3.544 1.507 2.507
assign (resid 6 and name HN) (resid 6 and name HA) 2.437 0.712 1.712
assign (resid 6 and name HN) (resid 4 and name HA) 3.535 1.499 2.499
assign (resid 7 and name HN) (resid 7 and name HA) 2.694 0.871 1.871
assign (resid 7 and name HN) (resid 4 and name HA) 3.436 1.417 2.417
assign (resid 7 and name HN) (resid 8 and name HA) 3.477 1.450 2.45
assign (resid 7 and name HN) (resid 6 and name HB2) 2.839 0.967 1.967
assign (resid 8 and name HN) (resid 7 and name HN) 3.113 1.163 2.163
assign (resid 8 and name HN) (resid 7 and name HA) 2.540 0.774 1.774
assign (resid 8 and name HN) (resid 8 and name HB) 2.670 0.855 1.855
assign (resid 8 and name HN) (resid 8 and name HG12) 2.939 1.036 2.036
assign (resid 8 and name HN) (resid 8 and name HG11) 3.034 1.105 2.105
assign (resid 9 and name HN) (resid 10 and name HN) 2.940 1.037 2.037
assign (resid 5 and name HN) (resid 9 and name HN) 3.500 1.470 2.47
assign (resid 9 and name HN) (resid 9 and name HA) 2.876 0.993 1.993
assign (resid 9 and name HN) (resid 8 and name HA) 2.319 0.645 1.645
assign (resid 9 and name HN) (resid 10 and name HA) 3.348 1.345 2.345
assign (resid 9 and name HN) (resid 9 and name HB1) 2.680 0.862 1.862
assign (resid 9 and name HN) (resid 12 and name HG2) 3.441 1.421 2.421
    or (resid    9 and name   HN) (resid   12 and name  HG1)
assign (resid 9 and name HN) (resid 8 and name HB) 3.432 1.413 2.413
assign (resid 9 and name HN) (resid 10 and name HB2) 3.542 1.506 2.506
assign (resid 9 and name HN) (resid 8 and name HG11) 3.236 1.257 2.257
assign (resid 10 and name HN) (resid 11 and name HN) 2.655 0.846 1.846
assign (resid 11 and name HN) (resid 9 and name HA) 3.180 1.214 2.214
assign (resid 11 and name HN) (resid 10 and name HA) 3.094 1.149 2.149
assign (resid 11 and name HN) (resid 11 and name HA) 2.739 0.901 1.901
assign (resid 11 and name HN) (resid 11 and name HB2) 2.503 0.752 1.752
assign (resid 11 and name HN) (resid 11 and name HB1) 2.553 0.782 1.782
assign (resid 11 and name HN) (resid 10 and name HB1) 2.781 0.928 1.928
assign (resid 11 and name HN) (resid 10 and name HB2) 3.334 1.333 2.333
assign (resid 11 and name HN) (resid 12 and name HN) 2.546 0.778 1.778
assign (resid 12 and name HN) (resid 9 and name HD22) 3.392 1.381 2.381
assign (resid 12 and name HN) (resid 14 and name HN) 3.264 1.279 2.279
assign (resid 12 and name HN) (resid 13 and name HN) 2.426 0.706 1.706
assign (resid 12 and name HN) (resid 12 and name HA) 2.570 0.793 1.793
assign (resid 12 and name HN) (resid 11 and name HA) 2.876 0.993 1.993
assign (resid 12 and name HN) (resid 9 and name HB1) 3.323 1.325 2.325
assign (resid 12 and name HN) (resid 9 and name HB2) 3.436 1.417 2.417
assign (resid 12 and name HN) (resid 12 and name HG2) 2.397 0.690 1.69
    or (resid   12 and name   HN) (resid   12 and name  HG1)
assign (resid 12 and name HN) (resid 10 and name HB2) 3.441 1.421 2.421
assign (resid 12 and name HN) (resid 13 and name HG12) 3.415 1.399 2.399
assign (resid 13 and name HN) (resid 11 and name HN) 3.430 1.412 2.412
assign (resid 13 and name HN) (resid 14 and name HN) 2.540 0.774 1.774
assign (resid 13 and name HN) (resid 13 and name HA) 2.727 0.893 1.893
assign (resid 13 and name HN) (resid 9 and name HB1) 3.500 1.470 2.47
assign (resid 13 and name HN) (resid 9 and name HB2) 3.491 1.463 2.463
assign (resid 13 and name HN) (resid 13 and name HB) 2.319 0.645 1.645
assign (resid 13 and name HN) (resid 13 and name HG12) 2.479 0.738 1.738
assign (resid 14 and name HN) (resid 14 and name HA) 2.771 0.921 1.921
assign (resid 14 and name HN) (resid 11 and name HA) 2.907 1.014 2.014
assign (resid 14 and name HN) (resid 13 and name HB) 2.691 0.869 1.869
assign (resid 14 and name HN) (resid 14 and name HB2) 2.725 0.891 1.891
assign (resid 14 and name HN) (resid 14 and name HB1) 2.907 1.014 2.014
assign (resid 14 and name HN) (resid 13 and name HG22) 2.872 0.990 1.99
    or (resid   14 and name   HN) (resid   13 and name HG21)
    or (resid   14 and name   HN) (resid   13 and name HG23)
assign (resid 15 and name HN) (resid 14 and name HN) 2.828 0.960 1.96
assign (resid 15 and name HN) (resid 69 and name HD1) 3.337 1.336 2.336
    or (resid   15 and name   HN) (resid   69 and name  HD2)
assign (resid 15 and name HN) (resid 15 and name HA) 2.907 1.014 2.014
assign (resid 15 and name HN) (resid 14 and name HA) 3.010 1.087 2.087
assign (resid 15 and name HN) (resid 15 and name HB2) 2.806 0.945 1.945
assign (resid 15 and name HN) (resid 15 and name HB1) 2.574 0.795 1.795
assign (resid 15 and name HN) (resid 14 and name HB1) 2.966 1.055 2.055
assign (resid 15 and name HN) (resid 14 and name HB2) 3.294 1.302 2.302
assign (resid 16 and name HN) (resid 17 and name HN) 3.019 1.093 2.093
assign (resid 15 and name HN) (resid 16 and name HN) 2.391 0.686 1.686
assign (resid 13 and name HN) (resid 16 and name HN) 3.495 1.466 2.466
assign (resid 16 and name HN) (resid 73 and name HD21) 3.371 1.364 2.364
assign (resid 16 and name HN) (resid 16 and name HA) 2.562 0.788 1.788
assign (resid 16 and name HN) (resid 15 and name HA) 2.894 1.005 2.005
assign (resid 16 and name HN) (resid 13 and name HA) 3.044 1.112 2.112
assign (resid 16 and name HN) (resid 16 and name HB2) 2.366 0.672 1.672
assign (resid 16 and name HN) (resid 15 and name HG2) 3.134 1.179 2.179
    or (resid   16 and name   HN) (resid   15 and name  HG1)
assign (resid 16 and name HN) (resid 15 and name HB1) 2.778 0.926 1.926
assign (resid 16 and name HN) (resid 14 and name HB1) 3.384 1.374 2.374
assign (resid 16 and name HN) (resid 20 and name HD12) 3.315 1.318 2.318
    or (resid   16 and name   HN) (resid   20 and name HD11)
    or (resid   16 and name   HN) (resid   20 and name HD13)
assign (resid 17 and name HN) (resid 18 and name HN) 2.648 0.841 1.841
assign (resid 17 and name HN) (resid 16 and name HA) 2.321 0.647 1.647
assign (resid 17 and name HN) (resid 17 and name HA) 2.806 0.945 1.945
assign (resid 17 and name HN) (resid 16 and name HB1) 3.498 1.468 2.468
assign (resid 17 and name HN) (resid 17 and name HB2) 2.504 0.753 1.753
assign (resid 17 and name HN) (resid 20 and name HB2) 2.806 0.945 1.945
assign (resid 17 and name HN) (resid 17 and name HG2) 2.982 1.067 2.067
assign (resid 18 and name HN) (resid 20 and name HN) 3.213 1.239 2.239
assign (resid 18 and name HN) (resid 21 and name HN) 3.112 1.162 2.162
assign (resid 18 and name HN) (resid 16 and name HA) 2.952 1.046 2.046
assign (resid 18 and name HN) (resid 18 and name HA) 2.501 0.751 1.751
assign (resid 18 and name HN) (resid 17 and name HA) 3.028 1.100 2.1
assign (resid 18 and name HN) (resid 18 and name HD2) 3.068 1.130 2.13
assign (resid 18 and name HN) (resid 18 and name HB1) 2.086 0.522 1.522
assign (resid 18 and name HN) (resid 17 and name HG2) 2.774 0.924 1.924
assign (resid 19 and name HN) (resid 20 and name HN) 2.381 0.680 1.68
assign (resid 19 and name HN) (resid 21 and name HN) 3.225 1.248 2.248
assign (resid 18 and name HN) (resid 19 and name HN) 2.314 0.643 1.643
assign (resid 19 and name HN) (resid 16 and name HD21) 3.366 1.359 2.359
assign (resid 19 and name HN) (resid 16 and name HA) 3.187 1.219 2.219
assign (resid 19 and name HN) (resid 18 and name HA) 2.912 1.017 2.017
assign (resid 19 and name HN) (resid 19 and name HA) 2.645 0.840 1.84
assign (resid 19 and name HN) (resid 17 and name HA) 3.108 1.159 2.159
assign (resid 19 and name HN) (resid 16 and name HB2) 3.036 1.106 2.106
assign (resid 19 and name HN) (resid 19 and name HB1) 2.259 0.612 1.612
assign (resid 19 and name HN) (resid 19 and name HG) 2.809 0.947 1.947
assign (resid 19 and name HN) (resid 19 and name HD22) 2.742 0.903 1.903
    or (resid   19 and name   HN) (resid   19 and name HD21)
    or (resid   19 and name   HN) (resid   19 and name HD23)
assign (resid 20 and name HN) (resid 18 and name HA) 3.520 1.487 2.487
assign (resid 20 and name HN) (resid 19 and name HA) 3.191 1.222 2.222
assign (resid 20 and name HN) (resid 20 and name HA) 2.643 0.838 1.838
assign (resid 20 and name HN) (resid 16 and name HB1) 3.298 1.305 2.305
assign (resid 20 and name HN) (resid 21 and name HB1) 3.401 1.388 2.388
assign (resid 20 and name HN) (resid 20 and name HB1) 2.312 0.641 1.641
assign (resid 20 and name HN) (resid 19 and name HB2) 2.683 0.864 1.864
assign (resid 20 and name HN) (resid 19 and name HG) 3.433 1.415 2.415
assign (resid 76 and name HN) (resid 78 and name HN) 3.465 1.441 2.441
assign (resid 20 and name HN) (resid 21 and name HN) 2.707 0.880 1.88
assign (resid 76 and name HN) (resid 77 and name HN) 2.342 0.658 1.658
assign (resid 76 and name HN) (resid 74 and name HA) 3.034 1.105 2.105
assign (resid 21 and name HN) (resid 18 and name HA) 2.749 0.907 1.907
assign (resid 76 and name HN) (resid 76 and name HA) 2.421 0.703 1.703
assign (resid 21 and name HN) (resid 21 and name HA) 2.643 0.838 1.838
assign (resid 21 and name HN) (resid 21 and name HG2) 2.598 0.810 1.81
assign (resid 76 and name HN) (resid 76 and name HG2) 2.157 0.558 1.558
assign (resid 76 and name HN) (resid 76 and name HB2) 2.154 0.557 1.557
assign (resid 22 and name HN) (resid 20 and name HN) 3.456 1.433 2.433
assign (resid 21 and name HN) (resid 22 and name HN) 2.564 0.789 1.789
assign (resid 22 and name HN) (resid 23 and name HN) 2.705 0.878 1.878
assign (resid 22 and name HN) (resid 22 and name HA) 2.519 0.762 1.762
assign (resid 22 and name HN) (resid 22 and name HB1) 2.248 0.607 1.607
assign (resid 22 and name HN) (resid 21 and name HG2) 3.262 1.277 2.277
assign (resid 22 and name HN) (resid 18 and name HB2) 3.505 1.474 2.474
assign (resid 22 and name HN) (resid 13 and name HG11) 3.498 1.468 2.468
assign (resid 23 and name HN) (resid 21 and name HN) 3.433 1.415 2.415
assign (resid 23 and name HN) (resid 5 and name HN) 3.330 1.331 2.331
assign (resid 23 and name HN) (resid 23 and name HA) 3.324 1.326 2.326
assign (resid 23 and name HN) (resid 5 and name HA) 3.531 1.496 2.496
assign (resid 23 and name HN) (resid 23 and name HB2) 3.168 1.204 2.204
assign (resid 23 and name HN) (resid 23 and name HB1) 2.898 1.008 2.008
assign (resid 23 and name HN) (resid 24 and name HN) 3.048 1.115 2.115
assign (resid 24 and name HN) (resid 21 and name HA) 3.519 1.486 2.486
assign (resid 24 and name HN) (resid 23 and name HB1) 3.201 1.230 2.23
assign (resid 24 and name HN) (resid 5 and name HB2) 3.258 1.274 2.274
assign (resid 24 and name HN) (resid 25 and name HB2) 3.528 1.493 2.493
assign (resid 24 and name HN) (resid 24 and name HG2) 3.144 1.186 2.186
    or (resid   24 and name   HN) (resid   24 and name  HG1)
assign (resid 24 and name HN) (resid 30 and name HB1) 3.533 1.498 2.498
assign (resid 25 and name HN) (resid 32 and name HN) 2.965 1.055 2.055
assign (resid 68 and name HN) (resid 71 and name HN) 3.210 1.237 2.237
assign (resid 25 and name HN) (resid 26 and name HN) 2.660 0.849 1.849
assign (resid 24 and name HN) (resid 25 and name HN) 2.835 0.965 1.965
assign (resid 25 and name HN) (resid 25 and name HA) 2.670 0.855 1.855
assign (resid 25 and name HN) (resid 25 and name HB1) 2.463 0.728 1.728
assign (resid 26 and name HN) (resid 28 and name HN) 3.403 1.390 2.39
assign (resid 26 and name HN) (resid 33 and name HA) 3.351 1.347 2.347
assign (resid 26 and name HN) (resid 26 and name HA) 2.950 1.045 2.045
assign (resid 26 and name HN) (resid 26 and name HB2) 2.820 0.954 1.954
assign (resid 26 and name HN) (resid 26 and name HB1) 2.657 0.847 1.847
assign (resid 26 and name HN) (resid 25 and name HB1) 3.032 1.103 2.103
assign (resid 26 and name HN) (resid 27 and name HB) 3.249 1.267 2.267
assign (resid 26 and name HN) (resid 25 and name HB2) 3.151 1.191 2.191
assign (resid 25 and name HN) (resid 27 and name HN) 3.384 1.374 2.374
assign (resid 26 and name HN) (resid 27 and name HN) 2.859 0.981 1.981
assign (resid 27 and name HN) (resid 26 and name HA) 2.960 1.051 2.051
assign (resid 27 and name HN) (resid 26 and name HB2) 3.073 1.133 2.133
assign (resid 27 and name HN) (resid 27 and name HA) 3.143 1.185 2.185
assign (resid 27 and name HN) (resid 26 and name HB1) 2.970 1.059 2.059
assign (resid 27 and name HN) (resid 25 and name HB1) 3.390 1.379 2.379
assign (resid 27 and name HN) (resid 27 and name HB) 2.645 0.840 1.84
assign (resid 27 and name HN) (resid 28 and name HB1) 3.510 1.478 2.478
assign (resid 27 and name HN) (resid 27 and name HG22) 2.531 0.769 1.769
    or (resid   27 and name   HN) (resid   27 and name HG21)
    or (resid   27 and name   HN) (resid   27 and name HG23)
assign (resid 85 and name HN) (resid 84 and name HA) 3.357 1.352 2.352
assign (resid 28 and name HN) (resid 25 and name HA) 3.351 1.347 2.347
assign (resid 85 and name HN) (resid 82 and name HA) 3.531 1.496 2.496
assign (resid 28 and name HN) (resid 28 and name HA) 2.959 1.050 2.05
assign (resid 28 and name HN) (resid 27 and name HB) 2.872 0.990 1.99
assign (resid 28 and name HN) (resid 30 and name HG1) 2.484 0.740 1.74
assign (resid 28 and name HN) (resid 27 and name HG12) 3.080 1.139 2.139
    or (resid   28 and name   HN) (resid   27 and name HG11)
    or (resid   28 and name   HN) (resid   27 and name HG13)
assign (resid 28 and name HN) (resid 28 and name HD22) 3.021 1.095 2.095
    or (resid   28 and name   HN) (resid   28 and name HD21)
    or (resid   28 and name   HN) (resid   28 and name HD23)
assign (resid 29 and name HN) (resid 30 and name HN) 2.443 0.716 1.716
assign (resid 29 and name HN) (resid 27 and name HN) 3.131 1.176 2.176
assign (resid 28 and name HN) (resid 29 and name HN) 2.530 0.768 1.768
assign (resid 29 and name HN) (resid 29 and name HA1) 2.266 0.616 1.616
assign (resid 29 and name HN) (resid 28 and name HA) 2.912 1.017 2.017
assign (resid 29 and name HN) (resid 28 and name HB1) 2.903 1.011 2.011
assign (resid 29 and name HN) (resid 30 and name HG2) 3.033 1.104 2.104
assign (resid 28 and name HN) (resid 30 and name HN) 3.289 1.298 2.298
assign (resid 30 and name HN) (resid 30 and name HA) 2.673 0.857 1.857
assign (resid 30 and name HN) (resid 29 and name HA1) 2.903 1.011 2.011
assign (resid 30 and name HN) (resid 31 and name HA1) 3.382 1.372 2.372
assign (resid 30 and name HN) (resid 30 and name HE2) 3.535 1.499 2.499
    or (resid   30 and name   HN) (resid   30 and name  HE1)
assign (resid 30 and name HN) (resid 25 and name HB1) 3.501 1.471 2.471
assign (resid 30 and name HN) (resid 25 and name HB2) 3.467 1.442 2.442
assign (resid 30 and name HN) (resid 30 and name HB2) 2.660 0.849 1.849
assign (resid 30 and name HN) (resid 30 and name HG2) 2.678 0.860 1.86
assign (resid 30 and name HN) (resid 31 and name HN) 2.090 0.524 1.524
assign (resid 31 and name HN) (resid 32 and name HN) 2.725 0.891 1.891
assign (resid 31 and name HN) (resid 28 and name HN) 3.387 1.377 2.377
assign (resid 29 and name HN) (resid 31 and name HN) 2.788 0.933 1.933
assign (resid 31 and name HN) (resid 31 and name HA1) 2.393 0.687 1.687
assign (resid 31 and name HN) (resid 25 and name HB1) 3.099 1.152 2.152
assign (resid 31 and name HN) (resid 25 and name HB2) 2.761 0.915 1.915
assign (resid 31 and name HN) (resid 30 and name HB2) 2.673 0.857 1.857
assign (resid 31 and name HN) (resid 30 and name HG2) 2.960 1.052 2.052
assign (resid 32 and name HN) (resid 33 and name HA) 3.465 1.441 2.441
assign (resid 32 and name HN) (resid 32 and name HA) 2.203 0.582 1.582
assign (resid 32 and name HN) (resid 31 and name HA1) 2.234 0.599 1.599
assign (resid 32 and name HN) (resid 25 and name HB2) 3.362 1.356 2.356
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    or (resid   92 and name   HE) (resid   92 and name  HD1)
assign (resid 10 and name HN) (resid 9 and name HD22) 3.367 1.361 2.361
assign (resid 73 and name HD22) (resid 16 and name HA) 3.181 1.214 2.214
assign (resid 9 and name HD22) (resid 9 and name HA) 3.222 1.245 2.245
assign (resid 9 and name HD22) (resid 7 and name HA) 3.467 1.442 2.442
assign (resid 9 and name HD21) (resid 9 and name HB2) 2.851 0.976 1.976
assign (resid 9 and name HD21) (resid 9 and name HD22) 1.775 0.378 1.378
assign (resid 73 and name HD21) (resid 16 and name HA) 3.088 1.144 2.144
assign (resid 9 and name HD21) (resid 9 and name HA) 3.359 1.354 2.354
assign (resid 9 and name HD22) (resid 9 and name HB2) 2.945 1.041 2.041
assign (resid 9 and name HD22) (resid 9 and name HB1) 2.894 1.005 2.005
assign (resid 73 and name HD21) (resid 15 and name HG2) 3.357 1.352 2.352
    or (resid   73 and name HD21) (resid   15 and name  HG1)
assign (resid 9 and name HD21) (resid 41 and name HG1) 3.480 1.453 2.453
assign (resid 9 and name HD21) (resid 10 and name HD22) 3.475 1.449 2.449
    or (resid    9 and name HD21) (resid   10 and name HD21)
    or (resid    9 and name HD21) (resid   10 and name HD23)
assign (resid 16 and name HD21) (resid 16 and name HB2) 3.052 1.118 2.118
assign (resid 16 and name HD21) (resid 16 and name HB1) 2.839 0.967 1.967
assign (resid 16 and name HD22) (resid 19 and name HB2) 3.462 1.439 2.439
assign (resid 16 and name HD21) (resid 16 and name HD22) 2.167 0.563 1.563
assign (resid 16 and name HD21) (resid 16 and name HA) 3.277 1.289 2.289
assign (resid 16 and name HD22) (resid 16 and name HB1) 3.196 1.226 2.226
assign (resid 16 and name HD22) (resid 16 and name HB2) 3.147 1.188 2.188
assign (resid 16 and name HD21) (resid 19 and name HB1) 3.398 1.385 2.385
assign (resid 16 and name HD21) (resid 19 and name HB2) 3.496 1.467 2.467
assign (resid 73 and name HD21) (resid 20 and name HD12) 3.429 1.411 2.411
    or (resid   73 and name HD21) (resid   20 and name HD11)
    or (resid   73 and name HD21) (resid   20 and name HD13)
assign (resid 16 and name HD21) (resid 19 and name HD22) 3.177 1.212 2.212
    or (resid   16 and name HD21) (resid   19 and name HD21)
    or (resid   16 and name HD21) (resid   19 and name HD23)
assign (resid 73 and name HD22) (resid 20 and name HD12) 3.488 1.460 2.46
    or (resid   73 and name HD22) (resid   20 and name HD11)
    or (resid   73 and name HD22) (resid   20 and name HD13)
assign (resid 9 and name HD21) (resid 23 and name HB1) 3.455 1.432 2.432
assign (resid 73 and name HD22) (resid 73 and name HB2) 3.510 1.478 2.478
    or (resid   73 and name HD22) (resid   73 and name  HB1)
assign (resid 11 and name HE22) (resid 11 and name HB1) 3.436 1.417 2.417
assign (resid 11 and name HE22) (resid 11 and name HB2) 3.396 1.384 2.384
assign (resid 11 and name HE22) (resid 14 and name HD22) 3.395 1.383 2.383
    or (resid   11 and name HE22) (resid   14 and name HD21)
    or (resid   11 and name HE22) (resid   14 and name HD23)
assign (resid 11 and name HE21) (resid 70 and name HN) 3.459 1.436 2.436
assign (resid 11 and name HE22) (resid 45 and name HE22) 3.430 1.412 2.412
assign (resid 11 and name HE21) (resid 45 and name HE22) 3.520 1.487 2.487
assign (resid 11 and name HE22) (resid 11 and name HE21) 2.365 0.671 1.671
assign (resid 11 and name HE21) (resid 66 and name HN) 3.524 1.490 2.49
assign (resid 11 and name HE21) (resid 11 and name HA) 3.362 1.356 2.356
assign (resid 11 and name HE22) (resid 11 and name HA) 3.444 1.423 2.423
assign (resid 11 and name HE21) (resid 10 and name HB1) 3.282 1.293 2.293
assign (resid 45 and name HE22) (resid 10 and name HN) 3.459 1.436 2.436
assign (resid 45 and name HE22) (resid 11 and name HN) 3.495 1.466 2.466
assign (resid 45 and name HE21) (resid 45 and name HE22) 2.130 0.545 1.545
assign (resid 14 and name HN) (resid 45 and name HE21) 3.298 1.305 2.305
assign (resid 45 and name HE21) (resid 11 and name HE21) 3.512 1.480 2.48
assign (resid 59 and name HE21) (resid 59 and name HE22) 2.117 0.538 1.538
assign (resid 59 and name HE21) (resid 55 and name HA) 3.480 1.453 2.453
assign (resid 59 and name HE21) (resid 55 and name HB1) 3.540 1.504 2.504
assign (resid 59 and name HE21) (resid 59 and name HG1) 2.912 1.017 2.017
assign (resid 59 and name HE21) (resid 59 and name HB2) 3.461 1.437 2.437
assign (resid 9 and name HD21) (resid 13 and name HG12) 3.450 1.428 2.428
assign (resid 59 and name HE22) (resid 52 and name HB1) 3.332 1.333 2.333
assign (resid 59 and name HE22) (resid 59 and name HG2) 2.992 1.074 2.074
assign (resid 54 and name HN) (resid 55 and name HA) 3.546 1.509 2.509
assign (resid 90 and name HN) (resid 90 and name HG1) 3.538 1.502 2.502
assign (resid 96 and name HN) (resid 95 and name HB2) 3.026 1.099 2.099
    or (resid   96 and name   HN) (resid   95 and name  HB1)
assign (resid 41 and name HN) (resid 40 and name HB2) 2.719 0.887 1.887
assign (resid 88 and name HN) (resid 87 and name HG1) 2.802 0.942 1.942
assign (resid 56 and name HN) (resid 58 and name HN) 3.557 1.518 2.518
assign (resid 79 and name HN) (resid 77 and name HN) 3.569 1.528 2.528
assign (resid 79 and name HN) (resid 75 and name HA) 3.328 1.329 2.329
assign (resid 30 and name HN) (resid 28 and name HA) 3.572 1.531 2.531
assign (resid 48 and name HN) (resid 67 and name HG11) 3.319 1.322 2.322
assign (resid 21 and name HN) (resid 20 and name HB2) 2.450 0.720 1.72
assign (resid 25 and name HN) (resid 24 and name HA) 3.132 1.178 2.178
assign (resid 25 and name HN) (resid 30 and name HG1) 3.088 1.144 2.144
assign (resid 58 and name HN) (resid 60 and name HG1) 3.119 1.168 2.168
assign (resid 86 and name HN) (resid 87 and name HA) 3.201 1.230 2.23
assign (resid 86 and name HN) (resid 83 and name HA) 3.260 1.275 2.275
assign (resid 71 and name HN) (resid 68 and name HA) 3.382 1.372 2.372
assign (resid 71 and name HN) (resid 70 and name HA) 3.290 1.299 2.299
assign (resid 71 and name HN) (resid 67 and name HA) 3.298 1.305 2.305
assign (resid 71 and name HN) (resid 71 and name HA) 2.949 1.044 2.044
assign (resid 74 and name HN) (resid 77 and name HN) 3.569 1.528 2.528
assign (resid 108 and name HN) (resid 100 and name HD1) 3.574 1.533 2.533
assign (resid 4 and name HN) (resid 7 and name HN) 2.370 0.674 1.674
assign (resid 7 and name HN) (resid 7 and name HB2) 2.716 0.885 1.885
    or (resid    7 and name   HN) (resid    7 and name  HB1)
assign (resid 16 and name HD22) (resid 16 and name HN) 3.510 1.478 2.478
assign (resid 16 and name HN) (resid 19 and name HB2) 2.889 1.002 2.002
assign (resid 94 and name HN) (resid 93 and name HA) 2.912 1.017 2.017
assign (resid 39 and name HN) (resid 37 and name HA1) 3.403 1.390 2.39
assign (resid 13 and name HN) (resid 13 and name HD12) 2.699 0.874 1.874
    or (resid   13 and name   HN) (resid   13 and name HD11)
    or (resid   13 and name   HN) (resid   13 and name HD13)
assign (resid 69 and name HN) (resid 71 and name HN) 3.264 1.279 2.279
assign (resid 102 and name HN) (resid 98 and name HA) 3.184 1.217 2.217
assign (resid 12 and name HN) (resid 11 and name HB2) 2.636 0.834 1.834
assign (resid 37 and name HN) (resid 38 and name HN) 2.903 1.011 2.011
assign (resid 63 and name HN) (resid 61 and name HA) 3.026 1.099 2.099
assign (resid 10 and name HN) (resid 11 and name HB1) 3.462 1.439 2.439
assign (resid 6 and name HN) (resid 7 and name HA) 3.031 1.102 2.102
assign (resid 6 and name HN) (resid 5 and name HB1) 3.166 1.203 2.203
assign (resid 5 and name HN) (resid 5 and name HA) 2.736 0.899 1.899
assign (resid 61 and name HN) (resid 63 and name HN) 2.707 0.880 1.88
assign (resid 61 and name HN) (resid 59 and name HN) 3.270 1.283 2.283
assign (resid 99 and name HN) (resid 98 and name HB2) 2.839 0.967 1.967
assign (resid 99 and name HN) (resid 98 and name HB1) 2.705 0.878 1.878
assign (resid 77 and name HN) (resid 76 and name HA) 2.774 0.924 1.924
assign (resid 22 and name HN) (resid 21 and name HA) 2.613 0.820 1.82
assign (resid 29 and name HN) (resid 29 and name HA2) 2.293 0.631 1.631
assign (resid 84 and name HN) (resid 81 and name HA) 2.961 1.052 2.052
assign (resid 31 and name HN) (resid 31 and name HA2) 2.327 0.650 1.65
assign (resid 23 and name HE1) (resid 23 and name HD1) 2.263 0.615 1.615
assign (resid 5 and name HD1) (resid 5 and name HE1) 2.253 0.609 1.609
assign (resid 69 and name HD1) (resid 69 and name HE1) 2.574 0.795 1.795
assign (resid 95 and name HD1) (resid 95 and name HE1) 2.633 0.832 1.832
assign (resid 5 and name HD1) (resid 5 and name HB2) 3.271 1.284 2.284
assign (resid 69 and name HD1) (resid 69 and name HB2) 3.231 1.253 2.253
assign (resid 69 and name HD1) (resid 14 and name HD22) 3.529 1.494 2.494
    or (resid   69 and name  HD1) (resid   14 and name HD21)
    or (resid   69 and name  HD1) (resid   14 and name HD23)
assign (resid 95 and name HE1) (resid 95 and name HB2) 3.529 1.494 2.494
    or (resid   95 and name  HE1) (resid   95 and name  HB1)
assign (resid 95 and name HD1) (resid 95 and name HA) 3.488 1.460 2.46
assign  (resid    13 and name   HA)
        (resid    23 and name  HB1)      3.383 1.373 2.373
assign ((resid    11 and name  HG2) or 
        (resid    11 and name  HG1)    )
       ((resid    65 and name HG21) or 
        (resid    65 and name HG22) or 
        (resid    65 and name HG23)    ) 3.384 1.374 2.374
assign ((resid    13 and name HD12) or 
        (resid    13 and name HD11) or 
        (resid    13 and name HD13)    )
        (resid    23 and name  HB1)      3.306 1.312 2.312
assign ((resid    19 and name HD12) or 
        (resid    19 and name HD11) or 
        (resid    19 and name HD13)    )
        (resid    12 and name  HB1)      2.913 1.018 2.018
assign ((resid    46 and name  HG2) or 
        (resid    46 and name  HG1)    )
        (resid    52 and name   HA)      3.300 1.307 2.307
assign ((resid    65 and name HG21) or 
        (resid    65 and name HG22) or 
        (resid    65 and name HG23)    )
        (resid    11 and name   HA)      2.899 1.009 2.009
assign ((resid    71 and name HG22) or 
        (resid    71 and name HG21) or 
        (resid    71 and name HG23)    )
       ((resid   106 and name HD12) or 
        (resid   106 and name HD11) or 
        (resid   106 and name HD13)    ) 2.266 0.616 1.616
assign ((resid    71 and name HG22) or 
        (resid    71 and name HG21) or 
        (resid    71 and name HG23)    )
       ((resid   104 and name HG22) or 
        (resid   104 and name HG21) or 
        (resid   104 and name HG23)    ) 2.462 0.727 1.727
assign ((resid    71 and name HD12) or 
        (resid    71 and name HD11) or 
        (resid    71 and name HD13)    )
       ((resid    95 and name  HB2) or 
        (resid    95 and name  HB1)    ) 3.002 1.082 2.082
assign ((resid    72 and name  HB2) or 
        (resid    72 and name  HB1)    )
       ((resid   104 and name HD12) or 
        (resid   104 and name HD11) or 
        (resid   104 and name HD13)    ) 3.718 1.659 2.659
assign ((resid    99 and name  HB2) or 
        (resid    99 and name  HB1) or 
        (resid    99 and name  HB3)    )
       ((resid   104 and name HG22) or 
        (resid   104 and name HG21) or 
        (resid   104 and name HG23)    ) 2.564 0.789 1.789
assign  (resid   104 and name HG12)
       ((resid    72 and name  HD2) or 
        (resid    72 and name  HD1)    ) 3.183 1.216 2.216
assign (resid   104 and name HG11)
       (resid    72 and name  HG2)      3.318 1.321 2.321
assign  (resid    72 and name   HA)
       ((resid   104 and name HG22) or 
        (resid   104 and name HG21) or 
        (resid   104 and name HG23)    ) 2.764 0.917 1.917
assign ((resid   104 and name HD12) or 
        (resid   104 and name HD11) or 
        (resid   104 and name HD13)    )
        (resid    99 and name   HA)      2.660 0.849 1.849
assign ((resid    20 and name HD22) or 
        (resid    20 and name HD21) or 
        (resid    20 and name HD23)    )
       ((resid    13 and name HG22) or 
        (resid    13 and name HG21) or 
        (resid    13 and name HG23)    ) 2.354 0.665 1.665
assign  (resid    13 and name   HA)
       ((resid    19 and name HD12) or 
        (resid    19 and name HD11) or 
        (resid    19 and name HD13)    ) 2.718 0.887 1.887
assign (resid    71 and name   HA)
       (resid    78 and name  HB2)      3.416 1.400 2.400
assign ((resid   104 and name HD12) or 
        (resid   104 and name HD11) or 
        (resid   104 and name HD13)    )
       ((resid    71 and name HG22) or 
        (resid    71 and name HG21) or 
        (resid    71 and name HG23)    ) 3.047 1.114 2.114
assign ((resid    72 and name  HB2) or 
        (resid    72 and name  HB1)    )
       ((resid   104 and name HG22) or 
        (resid   104 and name HG21) or 
        (resid   104 and name HG23)    ) 2.595 0.808 1.808
assign (resid    49 and name  HG1)
       (resid    85 and name  HB1)      3.292 1.301 2.301
assign (resid     4 and name   HN)
       (resid     9 and name   HN)      3.283 1.293 2.293
assign (resid     6 and name   HN)
       (resid    23 and name  HB1)      2.982 1.067 2.067
assign (resid     7 and name   HN)
       (resid    23 and name  HB1)      3.209 1.236 2.236
assign  (resid    12 and name   HN)
       ((resid    19 and name HD12) or 
        (resid    19 and name HD11) or 
        (resid    19 and name HD13)    ) 3.542 1.506 2.506
assign (resid    23 and name   HN)
       (resid     5 and name   HN)      3.367 1.360 2.360
assign (resid    30 and name   HN)
       (resid    25 and name  HB1)      3.540 1.504 2.504
assign (resid    31 and name   HN)
       (resid    25 and name  HB1)      3.133 1.178 2.178
assign (resid    52 and name   HN)
       (resid    47 and name   HA)      3.112 1.162 2.162
assign (resid    52 and name   HN)
       (resid    46 and name   HA)      3.552 1.514 2.514
assign (resid    60 and name   HN)
       (resid    55 and name  HB1)      3.106 1.158 2.158
assign (resid    71 and name   HN)
       (resid    78 and name  HB2)      3.478 1.451 2.451
assign (resid    75 and name   HN)
       (resid    70 and name   HA)      3.214 1.239 2.239
assign (resid   104 and name   HN)
       (resid    99 and name   HA)      3.232 1.254 2.254
assign  (resid    41 and name   HN)
       ((resid    27 and name HG22) or 
        (resid    27 and name HG21) or 
        (resid    27 and name HG23)    ) 3.364 1.358 2.358
assign  (resid    69 and name  HD1)
       ((resid    14 and name HD22) or 
        (resid    14 and name HD21) or 
        (resid    14 and name HD23)    ) 3.472 1.447 2.447
assign (resid    99 and name   HN)
       (resid   104 and name HG2#)      3.879 3.879 1.600
assign (resid    19 and name  HD#)
       (resid    13 and name   HA)      2.710 2.710 1.600
assign (resid    20 and name  HD#)
       (resid    13 and name HD1#)      2.556 2.556 1.600
assign (resid    20 and name  HD#)
       (resid    13 and name HG2#)      2.347 2.347 1.600
assign (resid    13 and name   HA)
       (resid    19 and name  HD#)      2.967 2.967 1.600
assign (resid    13 and name HG2#)
       (resid    20 and name  HD#)      2.707 2.707 1.600
assign (resid    70 and name  HD#)
       (resid    20 and name  HD#)      1.886 1.886 1.600
assign (resid    81 and name  HD#)
       (resid    28 and name  HD#)      2.594 2.594 1.600
assign (resid    33 and name  HB#)
       (resid    38 and name  HB#)      3.323 3.323 1.600
assign (resid    63 and name  HB#)
       (resid    47 and name  HB#)      2.478 2.478 1.600
assign (resid    67 and name HD1#)
       (resid    47 and name  HB#)      2.889 2.889 1.600
assign (resid    47 and name  HB#)
       (resid    63 and name  HB#)      2.465 2.465 1.600
assign (resid    14 and name  HD#)
       (resid    65 and name   HA)      3.110 3.110 1.600
assign (resid    10 and name  HD#)
       (resid    65 and name HG2#)      3.050 3.050 1.600
assign (resid    47 and name  HB#)
       (resid    67 and name HD1#)      2.881 2.881 1.600
assign (resid   104 and name HD1#)
       (resid    68 and name  HB#)      2.797 2.797 1.600
assign (resid    14 and name  HD#)
       (resid    69 and name  HD#)      3.304 3.304 1.600
assign (resid    99 and name  HB#)
       (resid    71 and name HD1#)      2.428 2.428 1.600
assign (resid   106 and name HG2#)
       (resid    71 and name HD1#)      3.014 3.014 1.600
assign (resid    99 and name  HB#)
       (resid    71 and name HG2#)      2.509 2.509 1.600
assign (resid   104 and name HG2#)
       (resid    71 and name HG2#)      2.501 2.501 1.600
assign (resid   106 and name HD1#)
       (resid    71 and name HG2#)      2.361 2.361 1.600
assign (resid   106 and name HG2#)
       (resid    71 and name HG2#)      3.084 3.084 1.600
assign (resid   104 and name HG2#)
       (resid    72 and name   HA)      2.755 2.755 1.600
assign (resid   104 and name HG2#)
       (resid    72 and name  HB#)      2.588 2.588 1.600
assign (resid    20 and name  HD#)
       (resid    74 and name  HG#)      3.108 3.108 1.600
assign (resid    71 and name   HA)
       (resid    78 and name  HB#)      3.406 3.406 1.600
assign (resid    28 and name  HD#)
       (resid    81 and name  HD#)      2.701 2.701 1.600
assign (resid    49 and name  HG#)
       (resid    85 and name  HB#)      3.282 3.282 1.600
assign (resid    71 and name HD1#)
       (resid    95 and name  HB#)      2.993 2.993 1.600
assign (resid    71 and name HD1#)
       (resid    99 and name  HB#)      2.680 2.680 1.600
assign (resid    71 and name HG2#)
       (resid    99 and name  HB#)      2.559 2.559 1.600
assign (resid    72 and name  HB#)
       (resid   104 and name HD1#)      3.707 3.707 1.600
assign (resid    71 and name HG2#)
       (resid   104 and name HG2#)      2.455 2.455 1.600
assign (resid    72 and name   HA)
       (resid   104 and name HG2#)      2.867 2.867 1.600
assign (resid    72 and name  HB#)
       (resid   104 and name HG2#)      3.429 3.429 1.600
assign (resid    99 and name  HB#)
       (resid   104 and name HG2#)      2.557 2.557 1.600
assign (resid    71 and name HG2#)
       (resid   106 and name HD1#)      2.259 2.259 1.600
assign (resid    69 and name  HD#)
       (resid    14 and name  HD#)      3.169 3.169 1.600
assign (resid    69 and name  HD#)
       (resid    20 and name  HD#)      3.163 3.163 1.600
assign (resid    23 and name  HE#)
       (resid    40 and name  HD#)      2.718 2.718 1.600
assign (resid    23 and name  HE#)
       (resid    44 and name  HD#)      2.678 2.678 1.600
! ambiguous distance restraints
assign (resid 17 and name HB1) (resid 17 and name HA) 2.923 1.025 2.025
    or (resid   38 and name  HB1) (resid   38 and name   HA)
assign (resid 17 and name HG2) (resid 17 and name HB2) 2.202 0.582 1.582
    or (resid   17 and name  HG2) (resid   17 and name  HD1)
assign (resid 12 and name HB2) (resid 12 and name HA) 2.639 0.835 1.835
    or (resid   12 and name  HB1) (resid   12 and name   HA)
    or (resid   53 and name  HB2) (resid   53 and name   HA)
assign (resid 38 and name HA) (resid 41 and name HN) 3.212 1.238 2.238
    or (resid   42 and name   HN) (resid   38 and name   HA)
assign (resid 45 and name HB2) (resid 66 and name HB1) 3.192 1.223 2.223
    or (resid   45 and name  HB1) (resid   66 and name  HB1)
    or (resid   45 and name  HB2) (resid   66 and name  HB2)
    or (resid   45 and name  HB1) (resid   66 and name  HB2)
assign (resid 18 and name HN) (resid 21 and name HB1) 3.034 1.105 2.105
    or (resid   53 and name  HB1) (resid   64 and name   HN)
    or (resid   80 and name  HB1) (resid   82 and name   HN)
assign (resid 4 and name HD2) (resid 4 and name HG2) 2.349 0.662 1.662
    or (resid    4 and name  HD2) (resid    4 and name  HG1)
    or (resid    4 and name  HD1) (resid    4 and name  HG2)
    or (resid    4 and name  HD1) (resid    4 and name  HG1)
    or (resid   30 and name  HD2) (resid   30 and name  HG2)
    or (resid   30 and name  HD1) (resid   30 and name  HG2)
assign (resid 39 and name HG1) (resid 39 and name HA) 2.457 0.725 1.725
    or (resid   76 and name  HG1) (resid   76 and name   HA)
assign (resid 102 and name HA) (resid 101 and name HA) 3.006 1.084 2.084
    or (resid  102 and name   HA) (resid  103 and name  HA2)
assign (resid 30 and name HG1) (resid 24 and name HA) 2.932 1.031 2.031
    or (resid  102 and name  HG1) (resid  102 and name   HA)
assign (resid 30 and name HG1) (resid 30 and name HB1) 2.300 0.635 1.635
    or (resid  102 and name  HG1) (resid  102 and name  HB2)
assign (resid 7 and name HE2) (resid 7 and name HD2) 1.953 0.458 1.458
    or (resid    7 and name  HE2) (resid    7 and name  HD1)
    or (resid    7 and name  HE1) (resid    7 and name  HD2)
    or (resid    7 and name  HE1) (resid    7 and name  HD1)
    or (resid   54 and name  HE2) (resid   54 and name  HD2)
    or (resid   54 and name  HE2) (resid   54 and name  HD1)
    or (resid   54 and name  HE1) (resid   54 and name  HD2)
    or (resid   54 and name  HE1) (resid   54 and name  HD1)
assign (resid 32 and name HE2) (resid 32 and name HG2) 2.123 0.541 1.541
    or (resid   32 and name  HE1) (resid   32 and name  HG2)
    or (resid   32 and name  HE2) (resid   32 and name  HG1)
    or (resid   32 and name  HE1) (resid   32 and name  HG1)
    or (resid   38 and name  HE2) (resid   38 and name  HG2)
    or (resid   38 and name  HE1) (resid   38 and name  HG2)
    or (resid   79 and name  HE2) (resid   79 and name  HG2)
    or (resid   79 and name  HE1) (resid   79 and name  HG2)
assign (resid 8 and name HG22) (resid 7 and name HG2) 2.661 0.850 1.85
    or (resid    8 and name HG22) (resid    7 and name  HG1)
    or (resid    8 and name HG21) (resid    7 and name  HG2)
    or (resid    8 and name HG21) (resid    7 and name  HG1)
    or (resid    8 and name HG23) (resid    7 and name  HG2)
    or (resid    8 and name HG23) (resid    7 and name  HG1)
    or (resid    8 and name HG22) (resid    8 and name HG11)
    or (resid    8 and name HG21) (resid    8 and name HG11)
    or (resid    8 and name HG23) (resid    8 and name HG11)
assign (resid 9 and name HN) (resid 8 and name HB) 3.119 1.168 2.168
    or (resid  106 and name   HN) (resid  106 and name   HB)
assign (resid 8 and name HD12) (resid 8 and name HG12) 2.666 0.853 1.853
    or (resid    8 and name HD11) (resid    8 and name HG12)
    or (resid    8 and name HD13) (resid    8 and name HG12)
    or (resid    8 and name HG22) (resid    8 and name HG12)
    or (resid    8 and name HG21) (resid    8 and name HG12)
    or (resid    8 and name HG23) (resid    8 and name HG12)
assign (resid 10 and name HA) (resid 10 and name HB1) 2.858 0.980 1.98
    or (resid   14 and name   HA) (resid   14 and name  HB1)
assign (resid 10 and name HB1) (resid 44 and name HB2) 3.588 1.545 2.545
    or (resid   10 and name  HB1) (resid   48 and name  HB2)
assign (resid 10 and name HD12) (resid 40 and name HB1) 2.989 1.072 2.072
    or (resid   10 and name HD11) (resid   40 and name  HB1)
    or (resid   10 and name HD13) (resid   40 and name  HB1)
    or (resid   10 and name HD12) (resid   45 and name  HG2)
    or (resid   10 and name HD12) (resid   45 and name  HG1)
    or (resid   10 and name HD11) (resid   45 and name  HG2)
    or (resid   10 and name HD11) (resid   45 and name  HG1)
    or (resid   10 and name HD13) (resid   45 and name  HG2)
    or (resid   10 and name HD13) (resid   45 and name  HG1)
assign (resid 11 and name HG2) (resid 69 and name HB2) 3.406 1.392 2.392
    or (resid   11 and name  HG1) (resid   69 and name  HB2)
    or (resid   41 and name  HB2) (resid   41 and name  HE2)
    or (resid   41 and name  HB2) (resid   41 and name  HE1)
    or (resid   41 and name  HB1) (resid   41 and name  HE2)
    or (resid   41 and name  HB1) (resid   41 and name  HE1)
assign (resid 12 and name HB1) (resid 4 and name HE2) 3.167 1.203 2.203
    or (resid   12 and name  HB1) (resid    4 and name  HE1)
    or (resid    9 and name  HB1) (resid   12 and name  HB1)
assign (resid 16 and name HN) (resid 13 and name HA) 2.994 1.076 2.076
    or (resid   19 and name   HN) (resid   13 and name   HA)
assign (resid 70 and name HN) (resid 14 and name HD12) 3.491 1.463 2.463
    or (resid   70 and name   HN) (resid   14 and name HD11)
    or (resid   70 and name   HN) (resid   14 and name HD13)
    or (resid   40 and name HD22) (resid    8 and name   HN)
    or (resid   40 and name HD21) (resid    8 and name   HN)
    or (resid   40 and name HD23) (resid    8 and name   HN)
assign (resid 18 and name HA) (resid 21 and name HG2) 2.800 0.940 1.94
    or (resid   18 and name   HA) (resid   21 and name  HB1)
assign (resid 70 and name HD22) (resid 77 and name HB) 3.101 1.154 2.154
    or (resid   70 and name HD21) (resid   77 and name   HB)
    or (resid   70 and name HD23) (resid   77 and name   HB)
    or (resid   70 and name HD22) (resid   70 and name   HG)
    or (resid   70 and name HD21) (resid   70 and name   HG)
    or (resid   70 and name HD23) (resid   70 and name   HG)
assign (resid 25 and name HA) (resid 30 and name HB1) 2.765 0.917 1.917
    or (resid   75 and name   HA) (resid   77 and name HG11)
assign (resid 7 and name HG2) (resid 7 and name HE2) 2.607 0.815 1.815
    or (resid    7 and name  HG2) (resid    7 and name  HE1)
    or (resid    7 and name  HG1) (resid    7 and name  HE2)
    or (resid    7 and name  HG1) (resid    7 and name  HE1)
    or (resid   32 and name  HE2) (resid   32 and name  HG2)
    or (resid   32 and name  HE1) (resid   32 and name  HG2)
    or (resid   32 and name  HE2) (resid   32 and name  HG1)
    or (resid   32 and name  HE1) (resid   32 and name  HG1)
    or (resid   38 and name  HE2) (resid   38 and name  HG2)
    or (resid   38 and name  HE1) (resid   38 and name  HG2)
assign (resid 80 and name HG2) (resid 77 and name HA) 3.240 1.260 2.26
    or (resid   64 and name  HG2) (resid   62 and name  HA1)
    or (resid   64 and name  HG2) (resid   62 and name  HA2)
assign (resid 53 and name HG2) (resid 102 and name HE2) 3.153 1.193 2.193
    or (resid   53 and name  HG1) (resid  102 and name  HE2)
    or (resid   64 and name  HG2) (resid  102 and name  HE2)
assign (resid 60 and name HG1) (resid 62 and name HN) 3.101 1.154 2.154
    or (resid   64 and name  HG1) (resid   62 and name   HN)
assign (resid 32 and name HG2) (resid 25 and name HB2) 2.897 1.007 2.007
    or (resid   32 and name  HG1) (resid   25 and name  HB2)
assign (resid 80 and name HN) (resid 80 and name HG1) 2.961 1.052 2.052
    or (resid   40 and name   HN) (resid   39 and name  HG1)
assign (resid 57 and name HG1) (resid 57 and name HA) 2.629 0.830 1.83
    or (resid   57 and name  HG1) (resid   58 and name   HA)
assign (resid 21 and name HB2) (resid 21 and name HN) 2.957 1.049 2.049
    or (resid   76 and name   HN) (resid   76 and name  HB2)
assign (resid 57 and name HB2) (resid 57 and name HA) 2.639 0.835 1.835
    or (resid   96 and name  HB2) (resid   96 and name   HA)
    or (resid   96 and name  HB1) (resid   96 and name   HA)
assign (resid 47 and name HN) (resid 46 and name HB1) 3.390 1.379 2.379
    or (resid   55 and name   HN) (resid   60 and name  HB2)
assign (resid 39 and name HB1) (resid 39 and name HA) 2.611 0.818 1.818
    or (resid   80 and name  HB2) (resid   80 and name   HA)
assign (resid 15 and name HB1) (resid 14 and name HB2) 3.564 1.524 2.524
    or (resid   21 and name  HB2) (resid   20 and name HD22)
    or (resid   21 and name  HB2) (resid   20 and name HD21)
    or (resid   21 and name  HB2) (resid   20 and name HD23)
assign (resid 58 and name HB2) (resid 59 and name HG1) 2.800 0.940 1.94
    or (resid   58 and name  HB1) (resid   59 and name  HG1)
    or (resid   58 and name  HB3) (resid   59 and name  HG1)
    or (resid   83 and name  HB2) (resid   87 and name  HB1)
    or (resid   83 and name  HB1) (resid   87 and name  HB1)
    or (resid   83 and name  HB3) (resid   87 and name  HB1)
    or (resid   58 and name  HB2) (resid   57 and name  HG1)
    or (resid   58 and name  HB1) (resid   57 and name  HG1)
    or (resid   58 and name  HB3) (resid   57 and name  HG1)
assign (resid 61 and name HA) (resid 60 and name HG1) 3.020 1.095 2.095
    or (resid   61 and name   HA) (resid   64 and name  HG1)
assign (resid 17 and name HG2) (resid 18 and name HA) 2.996 1.077 2.077
    or (resid   93 and name  HG1) (resid   93 and name   HA)
assign (resid 68 and name HA) (resid 67 and name HB) 3.173 1.208 2.208
    or (resid   68 and name   HA) (resid  102 and name  HG2)
assign (resid 70 and name HD22) (resid 81 and name HB1) 2.897 1.007 2.007
    or (resid   70 and name HD21) (resid   81 and name  HB1)
    or (resid   70 and name HD23) (resid   81 and name  HB1)
    or (resid   70 and name HD22) (resid   81 and name   HG)
    or (resid   70 and name HD21) (resid   81 and name   HG)
    or (resid   70 and name HD23) (resid   81 and name   HG)
assign (resid 71 and name HD12) (resid 67 and name HG12) 3.076 1.135 2.135
    or (resid   71 and name HD11) (resid   67 and name HG12)
    or (resid   71 and name HD13) (resid   67 and name HG12)
    or (resid   71 and name HD12) (resid  106 and name HD12)
    or (resid   71 and name HD12) (resid  106 and name HD11)
    or (resid   71 and name HD12) (resid  106 and name HD13)
    or (resid   71 and name HD11) (resid  106 and name HD12)
    or (resid   71 and name HD11) (resid  106 and name HD11)
    or (resid   71 and name HD11) (resid  106 and name HD13)
    or (resid   71 and name HD13) (resid  106 and name HD12)
    or (resid   71 and name HD13) (resid  106 and name HD11)
    or (resid   71 and name HD13) (resid  106 and name HD13)
assign (resid 30 and name HD2) (resid 25 and name HA) 3.038 1.107 2.107
    or (resid   30 and name  HD1) (resid   25 and name   HA)
    or (resid   72 and name  HD2) (resid  103 and name  HA2)
    or (resid   72 and name  HD1) (resid  103 and name  HA2)
    or (resid  102 and name  HD2) (resid  101 and name   HA)
    or (resid  102 and name  HD1) (resid  101 and name   HA)
assign (resid 4 and name HD2) (resid 22 and name HB2) 3.125 1.172 2.172
    or (resid    4 and name  HD1) (resid   22 and name  HB2)
assign (resid 76 and name HA) (resid 75 and name HG) 2.858 0.980 1.98
    or (resid   76 and name   HA) (resid   79 and name  HD2)
    or (resid   76 and name   HA) (resid   79 and name  HD1)
assign (resid 12 and name HG2) (resid 4 and name HN) 3.133 1.178 2.178
    or (resid   12 and name  HG1) (resid    4 and name   HN)
    or (resid   12 and name  HG2) (resid    6 and name   HN)
    or (resid   12 and name  HG1) (resid    6 and name   HN)
    or (resid   82 and name   HN) (resid   80 and name  HG2)
assign (resid 75 and name HA) (resid 70 and name HG) 2.875 0.992 1.992
    or (resid   75 and name   HA) (resid   77 and name   HB)
assign (resid 99 and name HB2) (resid 104 and name HG22) 2.262 0.614 1.614
    or (resid   99 and name  HB2) (resid  104 and name HG21)
    or (resid   99 and name  HB2) (resid  104 and name HG23)
    or (resid   99 and name  HB1) (resid  104 and name HG22)
    or (resid   99 and name  HB1) (resid  104 and name HG21)
    or (resid   99 and name  HB1) (resid  104 and name HG23)
    or (resid   99 and name  HB3) (resid  104 and name HG22)
    or (resid   99 and name  HB3) (resid  104 and name HG21)
    or (resid   99 and name  HB3) (resid  104 and name HG23)
    or (resid   99 and name  HB2) (resid  106 and name HD12)
    or (resid   99 and name  HB2) (resid  106 and name HD11)
    or (resid   99 and name  HB2) (resid  106 and name HD13)
    or (resid   99 and name  HB1) (resid  106 and name HD12)
    or (resid   99 and name  HB1) (resid  106 and name HD11)
    or (resid   99 and name  HB1) (resid  106 and name HD13)
    or (resid   99 and name  HB3) (resid  106 and name HD12)
    or (resid   99 and name  HB3) (resid  106 and name HD11)
    or (resid   99 and name  HB3) (resid  106 and name HD13)
assign (resid 100 and name HB2) (resid 100 and name HG2) 2.563 0.788 1.788
    or (resid  100 and name  HB2) (resid  100 and name  HG1)
    or (resid  100 and name  HB1) (resid  100 and name  HG2)
    or (resid  100 and name  HB1) (resid  100 and name  HG1)
assign (resid 38 and name HB1) (resid 41 and name HN) 3.465 1.440 2.44
    or (resid   38 and name  HB1) (resid   42 and name   HN)
    or (resid   17 and name  HB1) (resid   20 and name   HN)
assign (resid 102 and name HB1) (resid 102 and name HE2) 3.199 1.228 2.228
    or (resid  102 and name  HB1) (resid  102 and name  HE1)
assign (resid 104 and name HG22) (resid 104 and name HG11) 2.354 0.665 1.665
    or (resid  104 and name HG21) (resid  104 and name HG11)
    or (resid  104 and name HG23) (resid  104 and name HG11)
    or (resid  104 and name   HB) (resid  104 and name HG22)
    or (resid  104 and name   HB) (resid  104 and name HG21)
    or (resid  104 and name   HB) (resid  104 and name HG23)
assign (resid 79 and name HB2) (resid 77 and name HA) 2.830 0.961 1.961
    or (resid   79 and name  HB1) (resid   77 and name   HA)
assign (resid 100 and name HB2) (resid 100 and name HA) 2.796 0.938 1.938
    or (resid  102 and name   HA) (resid  102 and name  HB2)
assign (resid 87 and name HG2) (resid 88 and name HB2) 3.392 1.380 2.38
    or (resid   87 and name  HG2) (resid   88 and name  HB1)
    or (resid   87 and name  HG1) (resid   88 and name  HB2)
    or (resid   87 and name  HG1) (resid   88 and name  HB1)
assign (resid 3 and name HN) (resid 9 and name HB1) 3.428 1.410 2.41
    or (resid   10 and name   HN) (resid    9 and name  HB1)
assign (resid 63 and name HN) (resid 44 and name HB1) 3.480 1.453 2.453
    or (resid   10 and name   HN) (resid   11 and name  HB2)
    or (resid   10 and name   HN) (resid   44 and name  HB1)
assign (resid 5 and name HN) (resid 9 and name HN) 3.266 1.280 2.28
    or (resid   70 and name   HN) (resid   74 and name   HN)
    or (resid    4 and name   HN) (resid    9 and name   HN)
assign (resid 4 and name HN) (resid 9 and name HN) 3.392 1.381 2.381
    or (resid    5 and name   HN) (resid    9 and name   HN)
    or (resid    6 and name   HN) (resid    9 and name   HN)
assign (resid 4 and name HN) (resid 9 and name HA) 3.204 1.232 2.232
    or (resid    5 and name   HN) (resid    9 and name   HA)
assign (resid 4 and name HN) (resid 2 and name HA) 3.453 1.431 2.431
    or (resid    5 and name   HN) (resid   22 and name   HA)
    or (resid    6 and name   HN) (resid    2 and name   HA)
assign (resid 4 and name HN) (resid 6 and name HB2) 2.943 1.040 2.04
    or (resid    4 and name   HN) (resid    3 and name  HB2)
assign (resid 5 and name HN) (resid 22 and name HA) 3.456 1.433 2.433
    or (resid    6 and name   HN) (resid    2 and name   HA)
    or (resid   70 and name   HN) (resid   65 and name   HB)
assign (resid 5 and name HN) (resid 22 and name HB2) 3.493 1.464 2.464
    or (resid    5 and name   HN) (resid   22 and name  HB1)
assign (resid 5 and name HN) (resid 5 and name HB1) 2.997 1.078 2.078
    or (resid    6 and name   HN) (resid    5 and name  HB1)
assign (resid 5 and name HN) (resid 5 and name HD1) 3.359 1.354 2.354
    or (resid    5 and name   HN) (resid    5 and name  HD2)
    or (resid    6 and name   HN) (resid    5 and name  HD1)
    or (resid    6 and name   HN) (resid    5 and name  HD2)
assign (resid 6 and name HN) (resid 4 and name HB2) 3.256 1.272 2.272
    or (resid    6 and name   HN) (resid    4 and name  HB1)
assign (resid 6 and name HN) (resid 9 and name HN) 3.271 1.284 2.284
    or (resid    5 and name   HN) (resid    9 and name   HN)
assign (resid 12 and name HN) (resid 10 and name HB1) 3.304 1.310 2.31
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assign (resid 12 and name HN) (resid 13 and name HG22) 3.503 1.473 2.473
    or (resid   12 and name   HN) (resid   13 and name HG21)
    or (resid   12 and name   HN) (resid   13 and name HG23)
    or (resid   12 and name   HN) (resid   19 and name HD12)
    or (resid   12 and name   HN) (resid   19 and name HD11)
    or (resid   12 and name   HN) (resid   19 and name HD13)
assign (resid 13 and name HN) (resid 10 and name HA) 2.719 0.887 1.887
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assign (resid 13 and name HN) (resid 9 and name HB1) 3.480 1.453 2.453
    or (resid   13 and name   HN) (resid   23 and name  HB2)
assign (resid 13 and name HN) (resid 10 and name HB1) 3.279 1.290 2.29
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assign (resid 13 and name HN) (resid 10 and name HB2) 3.361 1.355 2.355
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assign (resid 15 and name HN) (resid 12 and name HB2) 3.533 1.498 2.498
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assign (resid 15 and name HN) (resid 20 and name HD12) 3.453 1.431 2.431
    or (resid   15 and name   HN) (resid   20 and name HD11)
    or (resid   15 and name   HN) (resid   20 and name HD13)
    or (resid   15 and name   HN) (resid   70 and name HD12)
    or (resid   15 and name   HN) (resid   70 and name HD11)
    or (resid   15 and name   HN) (resid   70 and name HD13)
assign (resid 15 and name HN) (resid 14 and name HD12) 3.241 1.260 2.26
    or (resid   15 and name   HN) (resid   14 and name HD11)
    or (resid   15 and name   HN) (resid   14 and name HD13)
    or (resid   15 and name   HN) (resid   14 and name HD22)
    or (resid   15 and name   HN) (resid   14 and name HD21)
    or (resid   15 and name   HN) (resid   14 and name HD23)
assign (resid 16 and name HN) (resid 12 and name HA) 2.898 1.008 2.008
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assign (resid 16 and name HN) (resid 13 and name HB) 3.054 1.119 2.119
    or (resid   16 and name   HN) (resid   20 and name  HB2)
assign (resid 16 and name HN) (resid 17 and name HN) 3.116 1.165 2.165
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assign (resid 18 and name HN) (resid 21 and name HG2) 3.459 1.436 2.436
    or (resid   18 and name   HN) (resid   21 and name  HB1)
assign (resid 19 and name HN) (resid 21 and name HG2) 3.371 1.364 2.364
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assign (resid 20 and name HN) (resid 21 and name HG2) 3.362 1.356 2.356
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assign (resid 21 and name HN) (resid 17 and name HG2) 3.163 1.201 2.201
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assign (resid 22 and name HN) (resid 19 and name HB2) 3.405 1.391 2.391
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assign (resid 22 and name HN) (resid 23 and name HN) 2.645 0.840 1.84
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assign (resid 23 and name HN) (resid 22 and name HB2) 3.218 1.243 2.243
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assign (resid 23 and name HN) (resid 13 and name HG22) 3.461 1.437 2.437
    or (resid   23 and name   HN) (resid   13 and name HG21)
    or (resid   23 and name   HN) (resid   13 and name HG23)
    or (resid   23 and name   HN) (resid   19 and name HD12)
    or (resid   23 and name   HN) (resid   19 and name HD11)
    or (resid   23 and name   HN) (resid   19 and name HD13)
assign (resid 26 and name HN) (resid 30 and name HN) 3.366 1.359 2.359
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assign (resid 27 and name HN) (resid 24 and name HG2) 3.445 1.424 2.424
    or (resid   27 and name   HN) (resid   24 and name  HG1)
    or (resid   27 and name   HN) (resid   41 and name  HD1)
assign (resid 28 and name HN) (resid 27 and name HN) 2.549 0.780 1.78
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assign (resid 28 and name HN) (resid 26 and name HB2) 3.500 1.470 2.47
    or (resid   85 and name   HN) (resid   87 and name  HD1)
assign (resid 30 and name HN) (resid 28 and name HB1) 2.542 0.775 1.775
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assign (resid 79 and name HN) (resid 70 and name HD22) 3.464 1.440 2.44
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    or (resid   79 and name   HN) (resid   70 and name HD23)
    or (resid   79 and name   HN) (resid   77 and name HG22)
    or (resid   79 and name   HN) (resid   77 and name HG21)
    or (resid   79 and name   HN) (resid   77 and name HG23)
assign (resid 32 and name HN) (resid 5 and name HB2) 3.465 1.441 2.441
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assign (resid 41 and name HN) (resid 41 and name HE2) 3.495 1.466 2.466
    or (resid   41 and name   HN) (resid   41 and name  HE1)
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assign (resid 33 and name HN) (resid 34 and name HG21) 3.219 1.243 2.243
    or (resid   33 and name   HN) (resid   34 and name HG22)
    or (resid   33 and name   HN) (resid   34 and name HG23)
    or (resid   33 and name   HN) (resid   32 and name  HG2)
    or (resid   33 and name   HN) (resid   32 and name  HG1)
assign (resid 34 and name HN) (resid 35 and name HG2) 3.483 1.456 2.456
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assign (resid 92 and name HN) (resid 87 and name HA) 3.309 1.314 2.314
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assign (resid 38 and name HN) (resid 35 and name HB1) 3.501 1.471 2.471
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assign (resid 38 and name HN) (resid 36 and name HB1) 3.445 1.424 2.424
    or (resid   38 and name   HN) (resid   39 and name  HG2)
    or (resid   38 and name   HN) (resid   41 and name  HB2)
    or (resid   38 and name   HN) (resid   41 and name  HB1)
assign (resid 38 and name HN) (resid 38 and name HD1) 3.056 1.120 2.12
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    or (resid   92 and name   HN) (resid   93 and name  HB2)
    or (resid   92 and name   HN) (resid   93 and name  HB1)
assign (resid 39 and name HN) (resid 38 and name HD2) 3.387 1.377 2.377
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assign (resid 98 and name HN) (resid 95 and name HA) 2.774 0.924 1.924
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assign (resid 33 and name HN) (resid 29 and name HA1) 3.447 1.426 2.426
    or (resid   41 and name   HN) (resid   39 and name   HA)
assign (resid 42 and name HN) (resid 41 and name HD2) 3.164 1.201 2.201
    or (resid   42 and name   HN) (resid   41 and name  HG1)
assign (resid 43 and name HN) (resid 40 and name HA) 2.761 0.915 1.915
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assign (resid 43 and name HN) (resid 39 and name HG2) 3.116 1.165 2.165
    or (resid   43 and name   HN) (resid   41 and name  HB2)
    or (resid   43 and name   HN) (resid   41 and name  HB1)
    or (resid   59 and name   HN) (resid   60 and name  HG2)
    or (resid   66 and name   HN) (resid   64 and name  HG2)
assign (resid 26 and name HN) (resid 30 and name HG1) 3.533 1.498 2.498
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assign (resid 66 and name HN) (resid 67 and name HB) 3.161 1.199 2.199
    or (resid   43 and name   HN) (resid   40 and name   HG)
assign (resid 26 and name HN) (resid 28 and name HB1) 3.126 1.172 2.172
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assign (resid 45 and name HN) (resid 45 and name HG2) 2.660 0.849 1.849
    or (resid   45 and name   HN) (resid   45 and name  HG1)
    or (resid   97 and name   HN) (resid   96 and name  HB2)
    or (resid   97 and name   HN) (resid   96 and name  HB1)
assign (resid 45 and name HN) (resid 48 and name HB1) 3.387 1.377 2.377
    or (resid   97 and name   HN) (resid   93 and name  HD2)
    or (resid   97 and name   HN) (resid   93 and name  HD1)
assign (resid 45 and name HN) (resid 10 and name HB1) 3.538 1.502 2.502
    or (resid   45 and name   HN) (resid   10 and name   HG)
assign (resid 97 and name HN) (resid 93 and name HG2) 3.508 1.477 2.477
    or (resid   97 and name   HN) (resid   94 and name  HD2)
assign (resid 97 and name HN) (resid 93 and name HG2) 3.500 1.470 2.47
    or (resid   97 and name   HN) (resid   94 and name  HD2)
    or (resid   97 and name   HN) (resid   94 and name  HG2)
    or (resid   97 and name   HN) (resid   94 and name  HG1)
assign (resid 47 and name HN) (resid 44 and name HA) 3.248 1.266 2.266
    or (resid   47 and name   HN) (resid   47 and name   HA)
assign (resid 47 and name HN) (resid 46 and name HG2) 3.162 1.200 2.2
    or (resid   47 and name   HN) (resid   46 and name  HG1)
    or (resid   47 and name   HN) (resid   46 and name  HB1)
assign (resid 47 and name HN) (resid 48 and name HB2) 3.528 1.493 2.493
    or (resid   47 and name   HN) (resid   48 and name  HB1)
assign (resid 48 and name HN) (resid 44 and name HN) 3.435 1.416 2.416
    or (resid   48 and name   HN) (resid   52 and name   HN)
assign (resid 49 and name HN) (resid 46 and name HG2) 3.347 1.344 2.344
    or (resid   49 and name   HN) (resid   46 and name  HG1)
    or (resid   49 and name   HN) (resid   46 and name  HB1)
    or (resid   49 and name   HN) (resid   81 and name  HB1)
assign (resid 53 and name HN) (resid 46 and name HG2) 3.232 1.254 2.254
    or (resid   53 and name   HN) (resid   46 and name  HG1)
    or (resid   53 and name   HN) (resid   54 and name  HB2)
    or (resid   53 and name   HN) (resid   54 and name  HB1)
    or (resid   53 and name   HN) (resid   60 and name  HB2)
assign (resid 55 and name HN) (resid 53 and name HG2) 3.217 1.242 2.242
    or (resid   55 and name   HN) (resid   53 and name  HG1)
    or (resid   55 and name   HN) (resid   53 and name  HB1)
    or (resid   55 and name   HN) (resid   60 and name  HG2)
assign (resid 55 and name HN) (resid 60 and name HB2) 2.835 0.965 1.965
    or (resid   55 and name   HN) (resid   54 and name  HB2)
    or (resid   55 and name   HN) (resid   54 and name  HB1)
assign (resid 60 and name HN) (resid 61 and name HB2) 3.338 1.337 2.337
    or (resid   60 and name   HN) (resid   61 and name  HB1)
    or (resid   78 and name   HN) (resid   79 and name  HB1)
assign (resid 60 and name HN) (resid 61 and name HB2) 3.306 1.311 2.311
    or (resid   60 and name   HN) (resid   61 and name  HB1)
    or (resid   78 and name   HN) (resid   77 and name HG11)
    or (resid   78 and name   HN) (resid   79 and name  HB2)
    or (resid   78 and name   HN) (resid   79 and name  HB1)
assign (resid 78 and name HN) (resid 70 and name HD12) 3.412 1.397 2.397
    or (resid   78 and name   HN) (resid   70 and name HD11)
    or (resid   78 and name   HN) (resid   70 and name HD13)
    or (resid   78 and name   HN) (resid   77 and name HD12)
    or (resid   78 and name   HN) (resid   77 and name HD11)
    or (resid   78 and name   HN) (resid   77 and name HD13)
assign (resid 59 and name HN) (resid 57 and name HG2) 2.971 1.059 2.059
    or (resid   59 and name   HN) (resid   60 and name  HG2)
assign (resid 70 and name HN) (resid 67 and name HN) 3.380 1.371 2.371
    or (resid   70 and name   HN) (resid   68 and name   HN)
assign (resid 62 and name HN) (resid 60 and name HA) 2.847 0.973 1.973
    or (resid   62 and name   HN) (resid   61 and name   HA)
assign (resid 62 and name HN) (resid 58 and name HA) 2.863 0.984 1.984
    or (resid   62 and name   HN) (resid   59 and name   HA)
assign (resid 63 and name HN) (resid 59 and name HB2) 3.453 1.431 2.431
    or (resid   63 and name   HN) (resid   60 and name  HB2)
    or (resid   63 and name   HN) (resid   60 and name  HB1)
assign (resid 64 and name HN) (resid 67 and name HB) 3.441 1.421 2.421
    or (resid   64 and name   HN) (resid  102 and name  HG2)
assign (resid 65 and name HN) (resid 61 and name HA) 3.274 1.286 2.286
    or (resid   65 and name   HN) (resid   66 and name  HB1)
assign (resid 65 and name HN) (resid 63 and name HA) 3.265 1.279 2.279
    or (resid   65 and name   HN) (resid   66 and name   HA)
assign (resid 67 and name HN) (resid 66 and name HB2) 3.124 1.171 2.171
    or (resid   67 and name   HN) (resid   66 and name  HB1)
assign (resid 67 and name HN) (resid 63 and name HA) 3.331 1.332 2.332
    or (resid   67 and name   HN) (resid   66 and name   HA)
assign (resid 68 and name HN) (resid 66 and name HB2) 3.477 1.450 2.45
    or (resid   68 and name   HN) (resid   66 and name  HB1)
assign (resid 68 and name HN) (resid 48 and name HB2) 3.510 1.478 2.478
    or (resid   68 and name   HN) (resid  102 and name  HG1)
assign (resid 69 and name HN) (resid 65 and name HA) 2.945 1.041 2.041
    or (resid   69 and name   HN) (resid   68 and name   HA)
assign (resid 69 and name HN) (resid 14 and name HB1) 3.526 1.492 2.492
    or (resid   69 and name   HN) (resid  104 and name HG11)
assign (resid 69 and name HN) (resid 14 and name HB2) 3.419 1.403 2.403
    or (resid   69 and name   HN) (resid   71 and name   HB)
assign (resid 5 and name HN) (resid 22 and name HB2) 3.206 1.233 2.233
    or (resid   61 and name   HN) (resid   62 and name  HA1)
    or (resid   61 and name   HN) (resid   62 and name  HA2)
assign (resid 71 and name HN) (resid 67 and name HN) 3.225 1.248 2.248
    or (resid   68 and name   HN) (resid   71 and name   HN)
assign (resid 71 and name HN) (resid 68 and name HA) 3.280 1.291 2.291
    or (resid   86 and name   HN) (resid   83 and name   HA)
assign (resid 72 and name HN) (resid 69 and name HA) 2.598 0.810 1.81
    or (resid   72 and name   HN) (resid   72 and name   HA)
assign (resid 73 and name HN) (resid 72 and name HA) 2.868 0.987 1.987
    or (resid   73 and name   HN) (resid   69 and name   HA)
assign (resid 99 and name HN) (resid 104 and name HG22) 3.473 1.448 2.448
    or (resid   99 and name   HN) (resid  104 and name HG21)
    or (resid   99 and name   HN) (resid  104 and name HG23)
    or (resid   99 and name   HN) (resid  104 and name HG12)
assign (resid 79 and name HN) (resid 75 and name HD22) 3.179 1.213 2.213
    or (resid   79 and name   HN) (resid   75 and name HD21)
    or (resid   79 and name   HN) (resid   75 and name HD23)
    or (resid   79 and name   HN) (resid   77 and name HG12)
assign (resid 81 and name HN) (resid 49 and name HB1) 3.508 1.477 2.477
    or (resid   81 and name   HN) (resid   77 and name   HB)
assign (resid 28 and name HN) (resid 26 and name HB1) 3.507 1.476 2.476
    or (resid   85 and name   HN) (resid   82 and name   HB)
assign (resid 86 and name HN) (resid 87 and name HG2) 3.334 1.333 2.333
    or (resid   86 and name   HN) (resid   87 and name  HB2)
assign (resid 93 and name HN) (resid 93 and name HG2) 2.868 0.987 1.987
    or (resid   93 and name   HN) (resid   94 and name  HD2)
assign (resid 94 and name HN) (resid 96 and name HN) 3.361 1.355 2.355
    or (resid   94 and name   HN) (resid   97 and name   HN)
assign (resid 96 and name HN) (resid 99 and name HN) 3.522 1.489 2.489
    or (resid   96 and name   HN) (resid   93 and name   HN)
assign (resid 99 and name HN) (resid 102 and name HN) 3.519 1.486 2.486
    or (resid   99 and name   HN) (resid  104 and name   HN)
assign (resid 99 and name HN) (resid 104 and name HG22) 3.048 1.115 2.115
    or (resid   99 and name   HN) (resid  104 and name HG21)
    or (resid   99 and name   HN) (resid  104 and name HG23)
    or (resid   99 and name   HN) (resid  104 and name HG12)
    or (resid   99 and name   HN) (resid  106 and name HD12)
    or (resid   99 and name   HN) (resid  106 and name HD11)
    or (resid   99 and name   HN) (resid  106 and name HD13)
assign (resid 99 and name HN) (resid 67 and name HG22) 3.483 1.456 2.456
    or (resid   99 and name   HN) (resid   67 and name HG21)
    or (resid   99 and name   HN) (resid   67 and name HG23)
    or (resid   99 and name   HN) (resid   71 and name HG22)
    or (resid   99 and name   HN) (resid   71 and name HG21)
    or (resid   99 and name   HN) (resid   71 and name HG23)
assign (resid 100 and name HN) (resid 102 and name HN) 3.500 1.470 2.47
    or (resid  100 and name   HN) (resid  104 and name   HN)
assign (resid 100 and name HN) (resid 104 and name HG12) 3.107 1.158 2.158
    or (resid  100 and name   HN) (resid  106 and name HD12)
    or (resid  100 and name   HN) (resid  106 and name HD11)
    or (resid  100 and name   HN) (resid  106 and name HD13)
    or (resid  100 and name   HN) (resid  106 and name HG12)
assign (resid 101 and name HN) (resid 104 and name HG12) 3.524 1.490 2.49
    or (resid  101 and name   HN) (resid  106 and name HG12)
assign (resid 101 and name HN) (resid 104 and name HG22) 3.520 1.487 2.487
    or (resid  101 and name   HN) (resid  104 and name HG21)
    or (resid  101 and name   HN) (resid  104 and name HG23)
    or (resid  101 and name   HN) (resid  104 and name HG12)
    or (resid  101 and name   HN) (resid  106 and name HG12)
assign (resid 18 and name HE) (resid 17 and name HE2) 3.505 1.474 2.474
    or (resid   18 and name   HE) (resid   17 and name  HE1)
assign (resid 9 and name HD22) (resid 12 and name HG2) 3.531 1.496 2.496
    or (resid    9 and name HD22) (resid   12 and name  HG1)
    or (resid    9 and name HD22) (resid   41 and name  HB2)
    or (resid    9 and name HD22) (resid   41 and name  HB1)
assign (resid 9 and name HD21) (resid 41 and name HG1) 3.505 1.474 2.474
    or (resid   59 and name HE21) (resid   46 and name  HB2)
assign (resid 9 and name HD21) (resid 41 and name HG1) 3.500 1.470 2.47
    or (resid   73 and name HD21) (resid   17 and name  HB2)
assign (resid 16 and name HD22) (resid 16 and name HN) 3.522 1.489 2.489
    or (resid   16 and name HD22) (resid   19 and name   HN)
assign (resid 16 and name HD21) (resid 19 and name HA) 3.470 1.445 2.445
    or (resid   16 and name HD21) (resid   22 and name  HB1)
assign (resid 9 and name HD21) (resid 41 and name HD1) 3.376 1.368 2.368
    or (resid   73 and name HD21) (resid   20 and name  HB2)
assign (resid 9 and name HD21) (resid 33 and name HB1) 3.478 1.452 2.452
    or (resid   73 and name HD21) (resid   18 and name  HD1)
assign (resid 11 and name HE22) (resid 10 and name HN) 3.458 1.435 2.435
    or (resid   11 and name HE22) (resid   70 and name   HN)
assign (resid 45 and name HE21) (resid 45 and name HA) 3.531 1.496 2.496
    or (resid   45 and name HE21) (resid   66 and name   HA)
assign (resid 68 and name HN) (resid 67 and name HG11) 3.401 1.388 2.388
    or (resid   68 and name   HN) (resid   70 and name  HB2)
assign (resid 4 and name HN) (resid 9 and name HN) 3.312 1.317 2.317
    or (resid    6 and name   HN) (resid    9 and name   HN)
assign (resid 5 and name HN) (resid 7 and name HN) 2.598 0.810 1.81
    or (resid    8 and name   HN) (resid    7 and name   HN)
assign (resid 19 and name HN) (resid 20 and name HB2) 2.755 0.911 1.911
    or (resid   19 and name   HN) (resid   20 and name  HB1)
assign (resid 14 and name HN) (resid 13 and name HG12) 3.038 1.107 2.107
    or (resid   14 and name   HN) (resid   20 and name HD12)
    or (resid   14 and name   HN) (resid   20 and name HD11)
    or (resid   14 and name   HN) (resid   20 and name HD13)
assign (resid 3 and name HN) (resid 7 and name HG2) 3.076 1.136 2.136
    or (resid    3 and name   HN) (resid    7 and name  HG1)
    or (resid    3 and name   HN) (resid    8 and name HG11)
assign (resid 61 and name HN) (resid 57 and name HA) 2.564 0.789 1.789
    or (resid   61 and name   HN) (resid   58 and name   HA)
    or (resid   61 and name   HN) (resid   59 and name   HA)

! hydrogen bond distance restraints

assign (residue 15 and name HN) (residue 11 and name O)  1.80  0.00  0.50
assign (residue 15 and name  N) (residue 11 and name O)  2.80  0.00  0.40
assign (residue 22 and name HN) (residue 18 and name O)  1.80  0.00  0.50
assign (residue 22 and name  N) (residue 18 and name O)  2.80  0.00  0.40
assign (residue 23 and name HN) (residue 19 and name O)  1.80  0.00  0.50
assign (residue 23 and name  N) (residue 19 and name O)  2.80  0.00  0.40
assign (residue 24 and name HN) (residue 20 and name O)  1.80  0.00  0.50
assign (residue 24 and name  N) (residue 20 and name O)  2.80  0.00  0.40
assign (residue 27 and name HN) (residue 23 and name O)  1.80  0.00  0.50
assign (residue 27 and name  N) (residue 23 and name O)  2.80  0.00  0.40
assign (residue 39 and name HN) (residue 35 and name O)  1.80  0.00  0.50
assign (residue 39 and name  N) (residue 35 and name O)  2.80  0.00  0.40
assign (residue 40 and name HN) (residue 36 and name O)  1.80  0.00  0.50
assign (residue 40 and name  N) (residue 36 and name O)  2.80  0.00  0.40
assign (residue 41 and name HN) (residue 37 and name O)  1.80  0.00  0.50
assign (residue 41 and name  N) (residue 37 and name O)  2.80  0.00  0.40
assign (residue 42 and name HN) (residue 38 and name O)  1.80  0.00  0.50
assign (residue 42 and name  N) (residue 38 and name O)  2.80  0.00  0.40
assign (residue 43 and name HN) (residue 39 and name O)  1.80  0.00  0.50
assign (residue 43 and name  N) (residue 39 and name O)  2.80  0.00  0.40
assign (residue 44 and name HN) (residue 40 and name O)  1.80  0.00  0.50
assign (residue 44 and name  N) (residue 40 and name O)  2.80  0.00  0.40
assign (residue 45 and name HN) (residue 41 and name O)  1.80  0.00  0.50
assign (residue 45 and name  N) (residue 41 and name O)  2.80  0.00  0.40
assign (residue 46 and name HN) (residue 42 and name O)  1.80  0.00  0.50
assign (residue 46 and name  N) (residue 42 and name O)  2.80  0.00  0.40
assign (residue 47 and name HN) (residue 43 and name O)  1.80  0.00  0.50
assign (residue 47 and name  N) (residue 43 and name O)  2.80  0.00  0.40
assign (residue 48 and name HN) (residue 44 and name O)  1.80  0.00  0.50
assign (residue 48 and name  N) (residue 44 and name O)  2.80  0.00  0.40
assign (residue 61 and name HN) (residue 57 and name O)  1.80  0.00  0.50
assign (residue 61 and name  N) (residue 57 and name O)  2.80  0.00  0.40
assign (residue 62 and name HN) (residue 58 and name O)  1.80  0.00  0.50
assign (residue 62 and name  N) (residue 58 and name O)  2.80  0.00  0.40
assign (residue 64 and name HN) (residue 60 and name O)  1.80  0.00  0.50
assign (residue 64 and name  N) (residue 60 and name O)  2.80  0.00  0.40
assign (residue 65 and name HN) (residue 61 and name O)  1.80  0.00  0.50
assign (residue 65 and name  N) (residue 61 and name O)  2.80  0.00  0.30
assign (residue 66 and name HN) (residue 62 and name O)  1.80  0.00  0.50
assign (residue 66 and name  N) (residue 62 and name O)  2.80  0.00  0.40
assign (residue 67 and name HN) (residue 63 and name O)  1.80  0.00  0.50
assign (residue 67 and name  N) (residue 63 and name O)  2.80  0.00  0.40
assign (residue 68 and name HN) (residue 64 and name O)  1.80  0.00  0.50
assign (residue 68 and name  N) (residue 64 and name O)  2.80  0.00  0.40
assign (residue 69 and name HN) (residue 65 and name O)  1.80  0.00  0.50
assign (residue 69 and name  N) (residue 65 and name O)  2.80  0.00  0.40
assign (residue 70 and name HN) (residue 66 and name O)  1.80  0.00  0.50
assign (residue 70 and name  N) (residue 66 and name O)  2.80  0.00  0.40
assign (residue 71 and name HN) (residue 67 and name O)  1.80  0.00  0.50
assign (residue 71 and name  N) (residue 67 and name O)  2.80  0.00  0.40
assign (residue 72 and name HN) (residue 68 and name O)  1.80  0.00  0.50
assign (residue 72 and name  N) (residue 68 and name O)  2.80  0.00  0.40
assign (residue 73 and name HN) (residue 69 and name O)  1.80  0.00  0.50
assign (residue 73 and name  N) (residue 69 and name O)  2.80  0.00  0.40
assign (residue 79 and name HN) (residue 75 and name O)  1.80  0.00  0.50
assign (residue 79 and name  N) (residue 75 and name O)  2.80  0.00  0.40
assign (residue 80 and name HN) (residue 76 and name O)  1.80  0.00  0.50
assign (residue 80 and name  N) (residue 76 and name O)  2.80  0.00  0.40
assign (residue 81 and name HN) (residue 77 and name O)  1.80  0.00  0.50
assign (residue 81 and name  N) (residue 77 and name O)  2.80  0.00  0.40
assign (residue 82 and name  N) (residue 78 and name O)  2.80  0.00  0.40
assign (residue 83 and name HN) (residue 79 and name O)  1.80  0.00  0.50
assign (residue 83 and name  N) (residue 79 and name O)  2.80  0.00  0.40
assign (residue 84 and name HN) (residue 80 and name O)  1.80  0.00  0.50
assign (residue 84 and name  N) (residue 80 and name O)  2.80  0.00  0.40
assign (residue 85 and name HN) (residue 81 and name O)  1.80  0.00  0.50
assign (residue 85 and name  N) (residue 81 and name O)  2.80  0.00  0.40
assign (residue 95 and name HN) (residue 91 and name O)  1.80  0.00  0.50
assign (residue 95 and name  N) (residue 91 and name O)  2.80  0.00  0.40
assign (residue 96 and name HN) (residue 92 and name O)  1.80  0.00  0.50
assign (residue 96 and name  N) (residue 92 and name O)  2.80  0.00  0.40
assign (residue 97 and name HN) (residue 93 and name O)  1.80  0.00  0.50
assign (residue 97 and name  N) (residue 93 and name O)  2.80  0.00  0.40
assign (residue 98 and name HN) (residue 94 and name O)  1.80  0.00  0.50
assign (residue 98 and name  N) (residue 94 and name O)  2.80  0.00  0.40
assign (residue 99 and name HN) (residue 95 and name O)  1.80  0.00  0.50
assign (residue 99 and name  N) (residue 95 and name O)  2.80  0.00  0.40
assign (residue 100 and name HN) (residue 96 and name O)  1.80  0.00  0.50
assign (residue 100 and name  N) (residue 96 and name O)  2.80  0.00  0.40
assign (residue 101 and name HN) (residue 97 and name O)  1.80  0.00  0.50
assign (residue 101 and name  N) (residue 97 and name O)  2.80  0.00  0.40

! torsion angle restraints
assign (resid   7 and name  C) (resid   8 and name  N) 
       (resid   8 and name CA) (resid   8 and name  C) 1.0   -80.00   100.00 2
assign (resid   9 and name  C) (resid  10 and name  N) 
       (resid  10 and name CA) (resid  10 and name  C) 1.0   -86.00    40.00 2
assign (resid  10 and name  C) (resid  11 and name  N) 
       (resid  11 and name CA) (resid  11 and name  C) 1.0   -59.40    30.92 2
assign (resid  11 and name  C) (resid  12 and name  N) 
       (resid  12 and name CA) (resid  12 and name  C) 1.0   -64.27    15.00 2
assign (resid  12 and name  C) (resid  13 and name  N) 
       (resid  13 and name CA) (resid  13 and name  C) 1.0   -68.00    37.38 2
assign (resid  13 and name  C) (resid  14 and name  N) 
       (resid  14 and name CA) (resid  14 and name  C) 1.0   -69.28    25.56 2
assign (resid  14 and name  C) (resid  15 and name  N) 
       (resid  15 and name CA) (resid  15 and name  C) 1.0   -87.54    45.18 2
assign (resid  15 and name  C) (resid  16 and name  N) 
       (resid  16 and name CA) (resid  16 and name  C) 1.0  -105.75    60.96 2
assign (resid  16 and name  C) (resid  17 and name  N) 
       (resid  17 and name CA) (resid  17 and name  C) 1.0   -56.44    15.00 2
assign (resid  17 and name  C) (resid  18 and name  N) 
       (resid  18 and name CA) (resid  18 and name  C) 1.0   -63.94    15.00 2
assign (resid  18 and name  C) (resid  19 and name  N) 
       (resid  19 and name CA) (resid  19 and name  C) 1.0   -65.79    15.00 2
assign (resid  19 and name  C) (resid  20 and name  N) 
       (resid  20 and name CA) (resid  20 and name  C) 1.0   -60.72    15.00 2
assign (resid  20 and name  C) (resid  21 and name  N) 
       (resid  21 and name CA) (resid  21 and name  C) 1.0   -60.30    15.00 2
assign (resid  21 and name  C) (resid  22 and name  N) 
       (resid  22 and name CA) (resid  22 and name  C) 1.0   -66.99    24.44 2
assign (resid  22 and name  C) (resid  23 and name  N) 
       (resid  23 and name CA) (resid  23 and name  C) 1.0   -78.02    53.22 2
assign (resid  23 and name  C) (resid  24 and name  N) 
       (resid  24 and name CA) (resid  24 and name  C) 1.0   -59.81    15.00 2
assign (resid  24 and name  C) (resid  25 and name  N) 
       (resid  25 and name CA) (resid  25 and name  C) 1.0   -64.42    15.00 2
assign (resid  25 and name  C) (resid  26 and name  N) 
       (resid  26 and name CA) (resid  26 and name  C) 1.0   -64.42    15.00 2
assign (resid  26 and name  C) (resid  27 and name  N) 
       (resid  27 and name CA) (resid  27 and name  C) 1.0   -64.39    15.00 2
assign (resid  27 and name  C) (resid  28 and name  N) 
       (resid  28 and name CA) (resid  28 and name  C) 1.0   -78.28    22.92 2
assign (resid  28 and name  C) (resid  29 and name  N) 
       (resid  29 and name CA) (resid  29 and name  C) 1.0    81.13    43.00 2
assign (resid  31 and name  C) (resid  32 and name  N) 
       (resid  32 and name CA) (resid  32 and name  C) 1.0   -95.15    78.10 2
assign (resid  32 and name  C) (resid  33 and name  N) 
       (resid  33 and name CA) (resid  33 and name  C) 1.0  -125.74    66.72 2
assign (resid  33 and name  C) (resid  34 and name  N) 
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assign (resid  34 and name  C) (resid  35 and name  N) 
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assign (resid  35 and name  C) (resid  36 and name  N) 
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assign (resid  36 and name  C) (resid  37 and name  N) 
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assign (resid  37 and name  C) (resid  38 and name  N) 
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assign (resid  38 and name  C) (resid  39 and name  N) 
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assign (resid  39 and name  C) (resid  40 and name  N) 
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assign (resid  40 and name  C) (resid  41 and name  N) 
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assign (resid  41 and name  C) (resid  42 and name  N) 
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assign (resid  42 and name  C) (resid  43 and name  N) 
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assign (resid  43 and name  C) (resid  44 and name  N) 
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assign (resid  44 and name  C) (resid  45 and name  N) 
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assign (resid  45 and name  C) (resid  46 and name  N) 
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assign (resid  46 and name  C) (resid  47 and name  N) 
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assign (resid  47 and name  C) (resid  48 and name  N) 
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assign (resid  52 and name  C) (resid  53 and name  N) 
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assign (resid  53 and name  C) (resid  54 and name  N) 
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assign (resid  55 and name  C) (resid  56 and name  N) 
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assign (resid  56 and name  C) (resid  57 and name  N) 
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assign (resid  57 and name  C) (resid  58 and name  N) 
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assign (resid  58 and name  C) (resid  59 and name  N) 
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assign (resid  59 and name  C) (resid  60 and name  N) 
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assign (resid  60 and name  C) (resid  61 and name  N) 
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assign (resid  61 and name  C) (resid  62 and name  N) 
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assign (resid  62 and name  C) (resid  63 and name  N) 
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assign (resid  63 and name  C) (resid  64 and name  N) 
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assign (resid  64 and name  C) (resid  65 and name  N) 
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assign (resid  65 and name  C) (resid  66 and name  N) 
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assign (resid  66 and name  C) (resid  67 and name  N) 
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assign (resid  67 and name  C) (resid  68 and name  N) 
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assign (resid  68 and name  C) (resid  69 and name  N) 
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assign (resid  69 and name  C) (resid  70 and name  N) 
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assign (resid  70 and name  C) (resid  71 and name  N) 
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assign (resid  71 and name  C) (resid  72 and name  N) 
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assign (resid  72 and name  C) (resid  73 and name  N) 
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assign (resid  74 and name  C) (resid  75 and name  N) 
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assign (resid  75 and name  C) (resid  76 and name  N) 
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assign (resid  76 and name  C) (resid  77 and name  N) 
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assign (resid  77 and name  C) (resid  78 and name  N) 
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assign (resid  78 and name  C) (resid  79 and name  N) 
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assign (resid  79 and name  C) (resid  80 and name  N) 
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assign (resid  80 and name  C) (resid  81 and name  N) 
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assign (resid  81 and name  C) (resid  82 and name  N) 
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assign (resid  82 and name  C) (resid  83 and name  N) 
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assign (resid  83 and name  C) (resid  84 and name  N) 
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assign (resid  84 and name  C) (resid  85 and name  N) 
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assign (resid  86 and name  C) (resid  87 and name  N) 
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assign (resid  87 and name  C) (resid  88 and name  N) 
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assign (resid  89 and name  C) (resid  90 and name  N) 
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assign (resid  91 and name  C) (resid  92 and name  N) 
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assign (resid  92 and name  C) (resid  93 and name  N) 
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assign (resid  93 and name  C) (resid  94 and name  N) 
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assign (resid  94 and name  C) (resid  95 and name  N) 
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assign (resid  95 and name  C) (resid  96 and name  N) 
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assign (resid  96 and name  C) (resid  97 and name  N) 
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assign (resid  97 and name  C) (resid  98 and name  N) 
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assign (resid  98 and name  C) (resid  99 and name  N) 
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assign (resid  99 and name  C) (resid 100 and name  N) 
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assign (resid 100 and name  C) (resid 101 and name  N) 
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assign (resid 101 and name  C) (resid 102 and name  N) 
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assign (resid 102 and name  C) (resid 103 and name  N) 
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assign (resid 103 and name  C) (resid 104 and name  N) 
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assign (resid 104 and name  C) (resid 105 and name  N) 
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assign (resid 105 and name  C) (resid 106 and name  N) 
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assign (resid 106 and name  C) (resid 107 and name  N) 
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assign (resid   8 and name  N) (resid   8 and name CA) 
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assign (resid  10 and name  N) (resid  10 and name CA) 
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assign (resid  11 and name  N) (resid  11 and name CA) 
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assign (resid  12 and name  N) (resid  12 and name CA) 
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assign (resid  13 and name  N) (resid  13 and name CA) 
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assign (resid  14 and name  N) (resid  14 and name CA) 
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assign (resid  15 and name  N) (resid  15 and name CA) 
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assign (resid  16 and name  N) (resid  16 and name CA) 
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assign (resid  17 and name  N) (resid  17 and name CA) 
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assign (resid  18 and name  N) (resid  18 and name CA) 
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assign (resid  19 and name  N) (resid  19 and name CA) 
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assign (resid  20 and name  N) (resid  20 and name CA) 
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assign (resid  21 and name  N) (resid  21 and name CA) 
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assign (resid  22 and name  N) (resid  22 and name CA) 
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assign (resid  23 and name  N) (resid  23 and name CA) 
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assign (resid  24 and name  N) (resid  24 and name CA) 
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assign (resid  25 and name  N) (resid  25 and name CA) 
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assign (resid  26 and name  N) (resid  26 and name CA) 
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assign (resid  27 and name  N) (resid  27 and name CA) 
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assign (resid  28 and name  N) (resid  28 and name CA) 
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assign (resid  29 and name  N) (resid  29 and name CA) 
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assign (resid  32 and name  N) (resid  32 and name CA) 
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assign (resid  33 and name  N) (resid  33 and name CA) 
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assign (resid  34 and name  N) (resid  34 and name CA) 
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assign (resid  35 and name  N) (resid  35 and name CA) 
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assign (resid  36 and name  N) (resid  36 and name CA) 
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assign (resid  37 and name  N) (resid  37 and name CA) 
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assign (resid  38 and name  N) (resid  38 and name CA) 
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assign (resid  39 and name  N) (resid  39 and name CA) 
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assign (resid  40 and name  N) (resid  40 and name CA) 
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assign (resid  41 and name  N) (resid  41 and name CA) 
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assign (resid  42 and name  N) (resid  42 and name CA) 
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assign (resid  43 and name  N) (resid  43 and name CA) 
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assign (resid  44 and name  N) (resid  44 and name CA) 
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assign (resid  45 and name  N) (resid  45 and name CA) 
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assign (resid  46 and name  N) (resid  46 and name CA) 
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assign (resid  47 and name  N) (resid  47 and name CA) 
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assign (resid  48 and name  N) (resid  48 and name CA) 
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assign (resid  53 and name  N) (resid  53 and name CA) 
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assign (resid  54 and name  N) (resid  54 and name CA) 
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assign (resid  56 and name  N) (resid  56 and name CA) 
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assign (resid  57 and name  N) (resid  57 and name CA) 
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assign (resid  58 and name  N) (resid  58 and name CA) 
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assign (resid  59 and name  N) (resid  59 and name CA) 
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assign (resid  60 and name  N) (resid  60 and name CA) 
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assign (resid  61 and name  N) (resid  61 and name CA) 
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assign (resid  62 and name  N) (resid  62 and name CA) 
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assign (resid  63 and name  N) (resid  63 and name CA) 
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assign (resid  64 and name  N) (resid  64 and name CA) 
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assign (resid  65 and name  N) (resid  65 and name CA) 
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assign (resid  66 and name  N) (resid  66 and name CA) 
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assign (resid  67 and name  N) (resid  67 and name CA) 
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assign (resid  68 and name  N) (resid  68 and name CA) 
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assign (resid  69 and name  N) (resid  69 and name CA) 
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assign (resid  70 and name  N) (resid  70 and name CA) 
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assign (resid  71 and name  N) (resid  71 and name CA) 
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assign (resid  72 and name  N) (resid  72 and name CA) 
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assign (resid  73 and name  N) (resid  73 and name CA) 
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assign (resid  75 and name  N) (resid  75 and name CA) 
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assign (resid  76 and name  N) (resid  76 and name CA) 
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assign (resid  77 and name  N) (resid  77 and name CA) 
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assign (resid  78 and name  N) (resid  78 and name CA) 
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assign (resid  79 and name  N) (resid  79 and name CA) 
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assign (resid  80 and name  N) (resid  80 and name CA) 
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assign (resid  81 and name  N) (resid  81 and name CA) 
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assign (resid  82 and name  N) (resid  82 and name CA) 
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assign (resid  83 and name  N) (resid  83 and name CA) 
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assign (resid  84 and name  N) (resid  84 and name CA) 
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assign (resid  85 and name  N) (resid  85 and name CA) 
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assign (resid  86 and name  N) (resid  86 and name CA) 
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assign (resid  87 and name  N) (resid  87 and name CA) 
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assign (resid  88 and name  N) (resid  88 and name CA) 
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assign (resid  90 and name  N) (resid  90 and name CA) 
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assign (resid  92 and name  N) (resid  92 and name CA) 
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assign (resid  93 and name  N) (resid  93 and name CA) 
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assign (resid  94 and name  N) (resid  94 and name CA) 
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assign (resid  95 and name  N) (resid  95 and name CA) 
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assign (resid  96 and name  N) (resid  96 and name CA) 
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assign (resid  97 and name  N) (resid  97 and name CA) 
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assign (resid  98 and name  N) (resid  98 and name CA) 
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assign (resid  99 and name  N) (resid  99 and name CA) 
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assign (resid 100 and name  N) (resid 100 and name CA) 
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assign (resid 101 and name  N) (resid 101 and name CA) 
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assign (resid 102 and name  N) (resid 102 and name CA) 
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assign (resid 103 and name  N) (resid 103 and name CA) 
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assign (resid 104 and name  N) (resid 104 and name CA) 
       (resid 104 and name  C) (resid 105 and name  N) 1.0   133.05    37.26 2
assign (resid 105 and name  N) (resid 105 and name CA) 
       (resid 105 and name  C) (resid 106 and name  N) 1.0   130.43    29.74 2
assign (resid 106 and name  N) (resid 106 and name CA) 
       (resid 106 and name  C) (resid 107 and name  N) 1.0   136.48    46.32 2
assign (resid 107 and name  N) (resid 107 and name CA) 
       (resid 107 and name  C) (resid 108 and name  N) 1.0   137.66    29.96 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   TYR   1           HA       TYR   1 -21.566  -3.599   4.077
    2    HD1  TYR   1           2HD      TYR   1 -21.113  -2.852   8.116
    3    HD2  TYR   1           1HD      TYR   1 -24.161  -2.286   5.203
    4    HE1  TYR   1           2HE      TYR   1 -22.788  -3.633   9.730
    5    HE2  TYR   1           1HE      TYR   1 -25.851  -3.060   6.818
    6    HH   TYR   1           HH       TYR   1 -25.132  -3.446  10.138
    7    H1   TYR   1           1HT      TYR   1 -20.986  -4.658   6.118
    8    H2   TYR   1           2HT      TYR   1 -19.564  -3.774   6.248
    9    H3   TYR   1           3HT      TYR   1 -19.741  -4.897   5.013
   10    HB2  TYR   1           1HB      TYR   1 -20.721  -1.490   6.098
   11    HB3  TYR   1           2HB      TYR   1 -21.963  -1.339   4.876
   12    H    THR   2           H        THR   2 -18.704  -1.808   5.384
   13    HA   THR   2           HA       THR   2 -18.098  -1.019   2.670
   14    HB   THR   2           HB       THR   2 -16.522   0.520   3.770
   15    HG1  THR   2           1HG      THR   2 -17.375   0.345   6.314
   16   HG21  THR   2          3HG2      THR   2 -19.294   0.590   4.967
   17   HG22  THR   2          1HG2      THR   2 -18.836   1.241   3.393
   18   HG23  THR   2          2HG2      THR   2 -18.187   1.961   4.863
   19    H    ASP   3           H        ASP   3 -17.675  -3.719   3.389
   20    HA   ASP   3           HA       ASP   3 -15.161  -4.444   4.454
   21    HB2  ASP   3           1HB      ASP   3 -16.891  -6.093   2.608
   22    HB3  ASP   3           2HB      ASP   3 -15.686  -6.686   3.740
   23    H    LYS   4           H        LYS   4 -15.967  -3.310   1.403
   24    HA   LYS   4           HA       LYS   4 -13.374  -3.701   0.315
   25    HB2  LYS   4           1HB      LYS   4 -15.710  -5.225  -0.880
   26    HB3  LYS   4           2HB      LYS   4 -14.356  -4.728  -1.883
   27    HG2  LYS   4           1HG      LYS   4 -12.834  -6.033  -0.414
   28    HG3  LYS   4           2HG      LYS   4 -14.232  -6.566   0.515
   29    HD2  LYS   4           1HD      LYS   4 -15.097  -7.787  -1.350
   30    HD3  LYS   4           2HD      LYS   4 -13.932  -7.050  -2.448
   31    HE2  LYS   4           1HE      LYS   4 -13.241  -9.329  -1.931
   32    HE3  LYS   4           2HE      LYS   4 -12.101  -8.181  -1.245
   33    HZ1  LYS   4           3HZ      LYS   4 -14.184  -9.716   0.211
   34    HZ2  LYS   4           1HZ      LYS   4 -13.238  -8.522   0.937
   35    HZ3  LYS   4           2HZ      LYS   4 -12.529  -9.905   0.315
   36    H    TYR   5           H        TYR   5 -13.005  -2.370  -1.471
   37    HA   TYR   5           HA       TYR   5 -12.876  -0.355  -2.213
   38    HD1  TYR   5           1HD      TYR   5 -15.516  -2.961  -3.871
   39    HD2  TYR   5           2HD      TYR   5 -16.952   0.958  -3.074
   40    HE1  TYR   5           1HE      TYR   5 -17.822  -3.780  -4.020
   41    HE2  TYR   5           2HE      TYR   5 -19.263   0.142  -3.210
   42    HH   TYR   5           HH       TYR   5 -20.055  -3.091  -3.137
   43    HB2  TYR   5           1HB      TYR   5 -14.720   0.623  -3.605
   44    HB3  TYR   5           2HB      TYR   5 -14.090  -0.837  -4.217
   45    H    ASP   6           H        ASP   6 -15.764  -0.333  -0.357
   46    HA   ASP   6           HA       ASP   6 -16.128   2.434  -0.248
   47    HB2  ASP   6           1HB      ASP   6 -16.951   0.246   1.612
   48    HB3  ASP   6           2HB      ASP   6 -17.283   1.927   1.979
   49    H    LYS   7           H        LYS   7 -14.474   0.330   2.162
   50    HA   LYS   7           HA       LYS   7 -13.168   2.645   3.073
   51    HB2  LYS   7           1HB      LYS   7 -15.251   3.351   3.940
   52    HB3  LYS   7           2HB      LYS   7 -15.502   1.820   4.756
   53    HG2  LYS   7           1HG      LYS   7 -13.603   2.324   6.245
   54    HG3  LYS   7           2HG      LYS   7 -13.450   3.899   5.461
   55    HD2  LYS   7           1HD      LYS   7 -15.628   4.534   6.173
   56    HD3  LYS   7           2HD      LYS   7 -15.953   2.912   6.786
   57    HE2  LYS   7           1HE      LYS   7 -14.259   3.184   8.482
   58    HE3  LYS   7           2HE      LYS   7 -13.816   4.752   7.800
   59    HZ1  LYS   7           3HZ      LYS   7 -15.936   5.615   8.366
   60    HZ2  LYS   7           1HZ      LYS   7 -15.278   4.937   9.758
   61    HZ3  LYS   7           2HZ      LYS   7 -16.485   4.112   8.943
   62    H    ILE   8           H        ILE   8 -14.358  -0.109   5.089
   63    HA   ILE   8           HA       ILE   8 -11.774  -0.075   6.381
   64    HB   ILE   8           HB       ILE   8 -12.711  -1.830   7.861
   65   HG12  ILE   8          1HG1      ILE   8 -15.277  -1.389   6.332
   66   HG13  ILE   8          2HG1      ILE   8 -14.248  -2.794   6.122
   67   HG21  ILE   8          1HG2      ILE   8 -14.413   0.639   7.519
   68   HG22  ILE   8          2HG2      ILE   8 -12.921   0.516   8.450
   69   HG23  ILE   8          3HG2      ILE   8 -14.355  -0.378   8.959
   70   HD11  ILE   8          3HD1      ILE   8 -15.685  -1.968   8.643
   71   HD12  ILE   8          1HD1      ILE   8 -14.622  -3.371   8.491
   72   HD13  ILE   8          2HD1      ILE   8 -16.118  -3.295   7.563
   73    H    ASN   9           H        ASN   9 -11.572  -0.808   3.807
   74    HA   ASN   9           HA       ASN   9 -10.667  -3.561   4.078
   75    HB2  ASN   9           1HB      ASN   9 -10.944  -3.827   1.702
   76    HB3  ASN   9           2HB      ASN   9 -12.472  -3.260   2.347
   77   HD21  ASN   9          1HD2      ASN   9  -9.711  -2.557   0.623
   78   HD22  ASN   9          2HD2      ASN   9 -10.203  -1.215  -0.267
   79    H    LEU  10           H        LEU  10  -8.545  -3.723   4.083
   80    HA   LEU  10           HA       LEU  10  -6.980  -1.870   2.488
   81    HG   LEU  10           HG       LEU  10  -7.906  -1.030   5.127
   82    HB2  LEU  10           1HB      LEU  10  -6.105  -3.003   5.181
   83    HB3  LEU  10           2HB      LEU  10  -5.247  -1.917   4.140
   84   HD11  LEU  10          1HD1      LEU  10  -6.764   0.022   7.035
   85   HD12  LEU  10          2HD1      LEU  10  -5.293  -0.863   6.609
   86   HD13  LEU  10          3HD1      LEU  10  -6.733  -1.737   7.125
   87   HD21  LEU  10          3HD2      LEU  10  -6.811   0.230   3.389
   88   HD22  LEU  10          1HD2      LEU  10  -5.356   0.347   4.395
   89   HD23  LEU  10          2HD2      LEU  10  -6.855   1.145   4.909
   90    H    GLN  11           H        GLN  11  -6.805  -4.807   4.404
   91    HA   GLN  11           HA       GLN  11  -4.944  -6.049   2.610
   92    HB2  GLN  11           1HB      GLN  11  -4.976  -6.288   5.138
   93    HB3  GLN  11           2HB      GLN  11  -6.407  -7.287   4.926
   94    HG2  GLN  11           1HG      GLN  11  -4.782  -8.882   5.068
   95    HG3  GLN  11           2HG      GLN  11  -4.866  -8.650   3.328
   96   HE21  GLN  11          1HE2      GLN  11  -3.318  -5.941   3.633
   97   HE22  GLN  11          2HE2      GLN  11  -1.730  -6.525   3.912
   98    H    GLU  12           H        GLU  12  -8.413  -5.990   2.965
   99    HA   GLU  12           HA       GLU  12  -8.674  -8.615   1.780
  100    HB2  GLU  12           1HB      GLU  12 -11.209  -7.901   1.738
  101    HB3  GLU  12           2HB      GLU  12 -10.463  -8.498   3.191
  102    HG2  GLU  12           1HG      GLU  12 -10.816  -5.592   2.526
  103    HG3  GLU  12           2HG      GLU  12 -11.968  -6.527   3.474
  104    H    ILE  13           H        ILE  13  -8.143  -5.713   0.789
  105    HA   ILE  13           HA       ILE  13  -9.150  -6.346  -1.842
  106    HB   ILE  13           HB       ILE  13  -8.480  -3.781  -0.522
  107   HG12  ILE  13          1HG1      ILE  13 -10.775  -4.511  -0.426
  108   HG13  ILE  13          2HG1      ILE  13 -10.649  -3.117  -1.482
  109   HG21  ILE  13          1HG2      ILE  13  -7.171  -3.740  -2.533
  110   HG22  ILE  13          2HG2      ILE  13  -8.554  -2.652  -2.662
  111   HG23  ILE  13          3HG2      ILE  13  -8.581  -4.218  -3.472
  112   HD11  ILE  13          3HD1      ILE  13 -11.095  -5.986  -2.241
  113   HD12  ILE  13          1HD1      ILE  13 -10.671  -4.712  -3.400
  114   HD13  ILE  13          2HD1      ILE  13 -12.160  -4.595  -2.465
  115    H    LEU  14           H        LEU  14  -6.284  -5.198  -0.065
  116    HA   LEU  14           HA       LEU  14  -4.383  -5.150  -2.020
  117    HG   LEU  14           HG       LEU  14  -1.980  -6.243  -0.592
  118    HB2  LEU  14           1HB      LEU  14  -4.185  -4.419   0.329
  119    HB3  LEU  14           2HB      LEU  14  -4.043  -6.105   0.788
  120   HD11  LEU  14          1HD1      LEU  14  -2.318  -3.253  -0.723
  121   HD12  LEU  14          2HD1      LEU  14  -2.368  -4.376  -2.088
  122   HD13  LEU  14          3HD1      LEU  14  -0.872  -4.147  -1.182
  123   HD21  LEU  14          3HD2      LEU  14  -0.614  -5.064   1.049
  124   HD22  LEU  14          1HD2      LEU  14  -1.908  -5.968   1.831
  125   HD23  LEU  14          2HD2      LEU  14  -2.065  -4.236   1.621
  126    H    GLU  15           H        GLU  15  -5.863  -7.806  -0.533
  127    HA   GLU  15           HA       GLU  15  -4.110  -9.878  -0.843
  128    HB2  GLU  15           1HB      GLU  15  -5.847 -10.043   0.534
  129    HB3  GLU  15           2HB      GLU  15  -7.090  -9.623  -0.649
  130    HG2  GLU  15           1HG      GLU  15  -6.601 -11.857  -1.735
  131    HG3  GLU  15           2HG      GLU  15  -5.569 -12.222  -0.350
  132    H    ASN  16           H        ASN  16  -6.003  -8.308  -3.371
  133    HA   ASN  16           HA       ASN  16  -4.676 -10.000  -5.353
  134    HB2  ASN  16           1HB      ASN  16  -7.689  -9.809  -5.185
  135    HB3  ASN  16           2HB      ASN  16  -6.831 -10.372  -6.603
  136   HD21  ASN  16          1HD2      ASN  16  -8.029 -11.157  -3.489
  137   HD22  ASN  16          2HD2      ASN  16  -7.594 -12.819  -3.516
  138    H    LYS  17           H        LYS  17  -4.074  -8.705  -7.046
  139    HA   LYS  17           HA       LYS  17  -4.691  -5.975  -7.059
  140    HB2  LYS  17           1HB      LYS  17  -3.670  -5.668  -9.207
  141    HB3  LYS  17           2HB      LYS  17  -2.689  -6.736  -8.234
  142    HG2  LYS  17           1HG      LYS  17  -4.582  -7.794 -10.302
  143    HG3  LYS  17           2HG      LYS  17  -2.974  -7.207 -10.742
  144    HD2  LYS  17           1HD      LYS  17  -2.090  -8.833  -9.016
  145    HD3  LYS  17           2HD      LYS  17  -3.721  -9.502  -8.954
  146    HE2  LYS  17           1HE      LYS  17  -2.393 -10.803 -10.483
  147    HE3  LYS  17           2HE      LYS  17  -3.618  -9.890 -11.359
  148    HZ1  LYS  17           3HZ      LYS  17  -1.482  -9.817 -12.477
  149    HZ2  LYS  17           1HZ      LYS  17  -0.747  -9.075 -11.160
  150    HZ3  LYS  17           2HZ      LYS  17  -1.934  -8.271 -12.004
  151    H    ARG  18           H        ARG  18  -6.531  -8.446  -8.331
  152    HA   ARG  18           HA       ARG  18  -8.117  -6.708  -9.937
  153    HE   ARG  18           HE       ARG  18  -7.779 -12.200  -7.687
  154    HB2  ARG  18           1HB      ARG  18  -9.847  -8.626  -9.935
  155    HB3  ARG  18           2HB      ARG  18  -8.284  -8.909 -10.673
  156    HG2  ARG  18           1HG      ARG  18  -8.768  -9.811  -7.857
  157    HG3  ARG  18           2HG      ARG  18  -9.407 -10.754  -9.201
  158    HD2  ARG  18           1HD      ARG  18  -7.029 -10.815 -10.132
  159    HD3  ARG  18           2HD      ARG  18  -6.483 -10.123  -8.605
  160   HH11  ARG  18          1HH1      ARG  18  -5.647 -12.153 -10.558
  161   HH12  ARG  18          2HH1      ARG  18  -4.984 -13.674 -10.204
  162   HH21  ARG  18          1HH2      ARG  18  -6.888 -14.268  -7.298
  163   HH22  ARG  18          2HH2      ARG  18  -5.709 -14.925  -8.337
  164    H    LEU  19           H        LEU  19  -8.190  -7.722  -6.629
  165    HA   LEU  19           HA       LEU  19 -10.636  -6.395  -6.059
  166    HG   LEU  19           HG       LEU  19  -9.623  -9.276  -5.227
  167    HB2  LEU  19           1HB      LEU  19  -8.420  -7.367  -4.255
  168    HB3  LEU  19           2HB      LEU  19  -9.931  -6.692  -3.699
  169   HD11  LEU  19          1HD1      LEU  19  -8.789  -9.344  -2.915
  170   HD12  LEU  19          2HD1      LEU  19 -10.242 -10.323  -3.121
  171   HD13  LEU  19          3HD1      LEU  19 -10.338  -8.758  -2.333
  172   HD21  LEU  19          3HD2      LEU  19 -11.750  -8.190  -5.738
  173   HD22  LEU  19          1HD2      LEU  19 -12.067  -7.975  -4.016
  174   HD23  LEU  19          2HD2      LEU  19 -12.004  -9.595  -4.708
  175    H    LEU  20           H        LEU  20  -7.257  -5.600  -6.292
  176    HA   LEU  20           HA       LEU  20  -7.319  -3.123  -4.924
  177    HG   LEU  20           HG       LEU  20  -4.840  -2.962  -4.405
  178    HB2  LEU  20           1HB      LEU  20  -5.531  -4.205  -7.061
  179    HB3  LEU  20           2HB      LEU  20  -5.489  -2.503  -6.703
  180   HD11  LEU  20          1HD1      LEU  20  -4.897  -5.855  -5.227
  181   HD12  LEU  20          2HD1      LEU  20  -5.736  -5.086  -3.890
  182   HD13  LEU  20          3HD1      LEU  20  -3.972  -5.236  -3.889
  183   HD21  LEU  20          3HD2      LEU  20  -3.175  -2.555  -6.005
  184   HD22  LEU  20          1HD2      LEU  20  -3.143  -4.262  -6.462
  185   HD23  LEU  20          2HD2      LEU  20  -2.631  -3.774  -4.842
  186    H    GLU  21           H        GLU  21  -7.809  -4.027  -8.252
  187    HA   GLU  21           HA       GLU  21  -8.531  -1.593  -9.296
  188    HB2  GLU  21           1HB      GLU  21  -9.354  -4.392  -9.904
  189    HB3  GLU  21           2HB      GLU  21 -10.023  -3.057 -10.811
  190    HG2  GLU  21           1HG      GLU  21  -7.090  -3.698 -10.537
  191    HG3  GLU  21           2HG      GLU  21  -8.083  -4.126 -11.926
  192    H    SER  22           H        SER  22 -10.422  -3.779  -7.283
  193    HA   SER  22           HA       SER  22 -12.852  -2.409  -7.477
  194    HG   SER  22           HG       SER  22 -13.473  -4.713  -7.293
  195    HB2  SER  22           1HB      SER  22 -11.801  -4.013  -5.143
  196    HB3  SER  22           2HB      SER  22 -13.487  -3.555  -5.382
  197    H    TYR  23           H        TYR  23 -10.221  -1.849  -4.984
  198    HA   TYR  23           HA       TYR  23 -11.784   0.586  -4.289
  199    HD1  TYR  23           2HD      TYR  23  -8.199  -0.835  -4.212
  200    HD2  TYR  23           1HD      TYR  23  -9.298   0.348  -0.293
  201    HE1  TYR  23           2HE      TYR  23  -5.846  -1.022  -3.485
  202    HE2  TYR  23           1HE      TYR  23  -6.980   0.192   0.459
  203    HH   TYR  23           HH       TYR  23  -4.382  -0.248  -1.757
  204    HB2  TYR  23           1HB      TYR  23 -10.714   0.856  -2.227
  205    HB3  TYR  23           2HB      TYR  23 -11.014  -0.837  -2.156
  206    H    MET  24           H        MET  24 -10.031   0.090  -6.555
  207    HA   MET  24           HA       MET  24  -7.704   1.602  -6.287
  208    HB2  MET  24           1HB      MET  24  -8.319  -0.144  -8.045
  209    HB3  MET  24           2HB      MET  24  -9.009   1.205  -8.946
  210    HG2  MET  24           1HG      MET  24  -6.709   0.692  -9.637
  211    HG3  MET  24           2HG      MET  24  -6.847   2.318  -8.964
  212    HE1  MET  24           3HE      MET  24  -4.123   2.250  -8.832
  213    HE2  MET  24           1HE      MET  24  -3.241   1.022  -7.928
  214    HE3  MET  24           2HE      MET  24  -4.114   0.579  -9.395
  215    H    ASP  25           H        ASP  25 -10.930   2.579  -6.826
  216    HA   ASP  25           HA       ASP  25 -10.274   5.138  -7.845
  217    HB2  ASP  25           1HB      ASP  25 -12.573   4.213  -7.937
  218    HB3  ASP  25           2HB      ASP  25 -12.702   4.410  -6.198
  219    H    CYS  26           H        CYS  26 -10.306   3.762  -4.689
  220    HA   CYS  26           HA       CYS  26 -10.156   6.171  -3.223
  221    HB2  CYS  26           1HB      CYS  26  -8.934   3.502  -2.382
  222    HB3  CYS  26           2HB      CYS  26  -9.372   4.866  -1.376
  223    H    VAL  27           H        VAL  27  -7.839   3.851  -4.486
  224    HA   VAL  27           HA       VAL  27  -5.615   5.384  -3.510
  225    HB   VAL  27           HB       VAL  27  -5.617   2.916  -5.256
  226   HG11  VAL  27          1HG1      VAL  27  -3.340   4.230  -3.763
  227   HG12  VAL  27          2HG1      VAL  27  -3.256   2.691  -4.622
  228   HG13  VAL  27          3HG1      VAL  27  -3.537   4.188  -5.513
  229   HG21  VAL  27          3HG2      VAL  27  -5.185   3.255  -2.292
  230   HG22  VAL  27          1HG2      VAL  27  -5.014   1.746  -3.187
  231   HG23  VAL  27          2HG2      VAL  27  -6.592   2.525  -3.063
  232    H    LEU  28           H        LEU  28  -6.796   4.580  -6.873
  233    HA   LEU  28           HA       LEU  28  -4.827   6.559  -7.721
  234    HG   LEU  28           HG       LEU  28  -4.865   6.299 -10.646
  235    HB2  LEU  28           1HB      LEU  28  -4.598   4.183  -8.511
  236    HB3  LEU  28           2HB      LEU  28  -6.046   4.447  -9.461
  237   HD11  LEU  28          1HD1      LEU  28  -2.485   5.275  -9.109
  238   HD12  LEU  28          2HD1      LEU  28  -3.220   6.874  -8.965
  239   HD13  LEU  28          3HD1      LEU  28  -2.419   6.401 -10.465
  240   HD21  LEU  28          3HD2      LEU  28  -4.972   4.136 -11.685
  241   HD22  LEU  28          1HD2      LEU  28  -3.581   3.573 -10.742
  242   HD23  LEU  28          2HD2      LEU  28  -3.377   4.837 -11.953
  243    H    GLY  29           H        GLY  29  -8.166   5.732  -7.887
  244    HA2  GLY  29           1HA      GLY  29  -9.830   7.365  -8.381
  245    HA3  GLY  29           2HA      GLY  29  -8.626   8.261  -9.316
  246    H    LYS  30           H        LYS  30 -10.768   5.628  -9.273
  247    HA   LYS  30           HA       LYS  30 -10.612   5.290 -12.164
  248    HB2  LYS  30           1HB      LYS  30 -10.095   3.000 -10.272
  249    HB3  LYS  30           2HB      LYS  30 -10.586   2.771 -11.939
  250    HG2  LYS  30           1HG      LYS  30  -8.492   4.004 -12.595
  251    HG3  LYS  30           2HG      LYS  30  -8.022   3.932 -10.891
  252    HD2  LYS  30           1HD      LYS  30  -8.141   1.515 -10.906
  253    HD3  LYS  30           2HD      LYS  30  -8.742   1.527 -12.558
  254    HE2  LYS  30           1HE      LYS  30  -6.022   2.502 -11.692
  255    HE3  LYS  30           2HE      LYS  30  -6.356   0.930 -12.396
  256    HZ1  LYS  30           3HZ      LYS  30  -5.566   2.499 -14.084
  257    HZ2  LYS  30           1HZ      LYS  30  -6.860   3.524 -13.747
  258    HZ3  LYS  30           2HZ      LYS  30  -7.159   2.025 -14.392
  259    H    GLY  31           H        GLY  31 -11.976   3.403  -9.471
  260    HA2  GLY  31           1HA      GLY  31 -14.500   3.368 -11.023
  261    HA3  GLY  31           2HA      GLY  31 -14.009   2.100  -9.924
  262    H    LYS  32           H        LYS  32 -14.651   2.222  -7.821
  263    HA   LYS  32           HA       LYS  32 -16.033   4.628  -6.971
  264    HB2  LYS  32           1HB      LYS  32 -17.893   3.254  -6.009
  265    HB3  LYS  32           2HB      LYS  32 -17.848   3.272  -7.760
  266    HG2  LYS  32           1HG      LYS  32 -16.760   1.047  -7.708
  267    HG3  LYS  32           2HG      LYS  32 -16.943   1.039  -5.952
  268    HD2  LYS  32           1HD      LYS  32 -19.374   1.224  -6.205
  269    HD3  LYS  32           2HD      LYS  32 -19.197   1.243  -7.958
  270    HE2  LYS  32           1HE      LYS  32 -18.169  -1.002  -7.847
  271    HE3  LYS  32           2HE      LYS  32 -18.440  -1.015  -6.107
  272    HZ1  LYS  32           3HZ      LYS  32 -20.197  -2.209  -7.223
  273    HZ2  LYS  32           1HZ      LYS  32 -20.511  -0.896  -8.218
  274    HZ3  LYS  32           2HZ      LYS  32 -20.850  -0.798  -6.570
  275    H    CYS  33           H        CYS  33 -16.265   4.859  -4.756
  276    HA   CYS  33           HA       CYS  33 -15.023   3.523  -2.632
  277    HB2  CYS  33           1HB      CYS  33 -13.239   5.303  -4.270
  278    HB3  CYS  33           2HB      CYS  33 -13.110   5.267  -2.521
  279    H    THR  34           H        THR  34 -14.637   4.867  -0.826
  280    HA   THR  34           HA       THR  34 -16.618   6.979  -0.870
  281    HB   THR  34           HB       THR  34 -15.683   5.327   1.495
  282    HG1  THR  34           1HG      THR  34 -18.034   4.495   0.749
  283   HG21  THR  34          3HG2      THR  34 -16.913   7.415   1.894
  284   HG22  THR  34          1HG2      THR  34 -17.840   5.968   2.374
  285   HG23  THR  34          2HG2      THR  34 -18.188   6.777   0.832
  286    HA   PRO  35           HA       PRO  35 -13.338  10.019  -0.263
  287    HB2  PRO  35           1HB      PRO  35 -14.628  11.502   1.762
  288    HB3  PRO  35           2HB      PRO  35 -14.738  11.786   0.021
  289    HG2  PRO  35           1HG      PRO  35 -16.555  10.212   1.811
  290    HG3  PRO  35           2HG      PRO  35 -16.984  11.312   0.478
  291    HD2  PRO  35           1HD      PRO  35 -17.131   8.729   0.131
  292    HD3  PRO  35           2HD      PRO  35 -16.357   9.720  -1.127
  293    H    GLU  36           H        GLU  36 -14.866   9.220   2.849
  294    HA   GLU  36           HA       GLU  36 -12.676   9.652   4.525
  295    HB2  GLU  36           1HB      GLU  36 -14.956   9.414   5.313
  296    HB3  GLU  36           2HB      GLU  36 -14.996   7.752   4.764
  297    HG2  GLU  36           1HG      GLU  36 -13.390   7.122   6.434
  298    HG3  GLU  36           2HG      GLU  36 -13.221   8.799   6.952
  299    H    GLY  37           H        GLY  37 -13.724   6.810   2.786
  300    HA2  GLY  37           1HA      GLY  37 -11.857   4.968   3.793
  301    HA3  GLY  37           2HA      GLY  37 -12.706   4.844   2.259
  302    H    LYS  38           H        LYS  38 -11.796   7.219   1.076
  303    HA   LYS  38           HA       LYS  38  -9.388   6.289  -0.036
  304    HB2  LYS  38           1HB      LYS  38 -10.420   9.120  -0.233
  305    HB3  LYS  38           2HB      LYS  38  -9.266   8.341  -1.301
  306    HG2  LYS  38           1HG      LYS  38 -11.272   6.705  -1.735
  307    HG3  LYS  38           2HG      LYS  38 -12.209   8.042  -1.115
  308    HD2  LYS  38           1HD      LYS  38 -10.316   8.237  -3.480
  309    HD3  LYS  38           2HD      LYS  38 -12.057   8.081  -3.598
  310    HE2  LYS  38           1HE      LYS  38 -11.590  10.368  -3.970
  311    HE3  LYS  38           2HE      LYS  38 -12.172  10.292  -2.313
  312    HZ1  LYS  38           3HZ      LYS  38 -10.226  11.731  -2.676
  313    HZ2  LYS  38           1HZ      LYS  38  -9.277  10.407  -3.053
  314    HZ3  LYS  38           2HZ      LYS  38  -9.936  10.580  -1.508
  315    H    GLU  39           H        GLU  39 -10.023   8.446   2.636
  316    HA   GLU  39           HA       GLU  39  -7.466   9.730   2.556
  317    HB2  GLU  39           1HB      GLU  39  -9.555   9.554   4.714
  318    HB3  GLU  39           2HB      GLU  39  -8.118  10.558   4.807
  319    HG2  GLU  39           1HG      GLU  39  -8.892  11.830   2.875
  320    HG3  GLU  39           2HG      GLU  39 -10.324  10.801   2.787
  321    H    LEU  40           H        LEU  40  -8.998   7.190   4.404
  322    HA   LEU  40           HA       LEU  40  -6.792   6.781   6.083
  323    HG   LEU  40           HG       LEU  40  -9.607   4.816   4.445
  324    HB2  LEU  40           1HB      LEU  40  -7.941   4.884   6.921
  325    HB3  LEU  40           2HB      LEU  40  -9.103   6.147   6.671
  326   HD11  LEU  40          1HD1      LEU  40  -9.345   2.398   4.657
  327   HD12  LEU  40          2HD1      LEU  40  -8.510   2.604   6.188
  328   HD13  LEU  40          3HD1      LEU  40  -7.774   3.188   4.702
  329   HD21  LEU  40          3HD2      LEU  40 -11.220   5.199   6.207
  330   HD22  LEU  40          1HD2      LEU  40 -10.500   3.907   7.174
  331   HD23  LEU  40          2HD2      LEU  40 -11.300   3.523   5.655
  332    H    LYS  41           H        LYS  41  -7.798   5.318   3.082
  333    HA   LYS  41           HA       LYS  41  -5.766   3.339   3.032
  334    HB2  LYS  41           1HB      LYS  41  -7.550   4.431   0.865
  335    HB3  LYS  41           2HB      LYS  41  -6.399   3.108   0.649
  336    HG2  LYS  41           1HG      LYS  41  -7.559   1.675   1.838
  337    HG3  LYS  41           2HG      LYS  41  -8.345   2.846   2.861
  338    HD2  LYS  41           1HD      LYS  41  -9.670   3.610   0.916
  339    HD3  LYS  41           2HD      LYS  41  -8.972   2.296  -0.031
  340    HE2  LYS  41           1HE      LYS  41  -9.906   0.675   1.555
  341    HE3  LYS  41           2HE      LYS  41 -10.513   1.999   2.529
  342    HZ1  LYS  41           3HZ      LYS  41 -11.377   1.661  -0.278
  343    HZ2  LYS  41           1HZ      LYS  41 -12.104   2.557   0.926
  344    HZ3  LYS  41           2HZ      LYS  41 -12.139   0.871   0.982
  345    H    ASP  42           H        ASP  42  -6.024   6.598   1.630
  346    HA   ASP  42           HA       ASP  42  -3.738   6.466   0.032
  347    HB2  ASP  42           1HB      ASP  42  -5.312   8.301  -0.215
  348    HB3  ASP  42           2HB      ASP  42  -4.945   8.873   1.407
  349    H    HIS  43           H        HIS  43  -4.074   7.646   3.332
  350    HA   HIS  43           HA       HIS  43  -1.341   8.304   3.731
  351    HD1  HIS  43           1HD      HIS  43  -5.117   9.436   5.930
  352    HD2  HIS  43           2HD      HIS  43  -1.321  10.782   4.888
  353    HE1  HIS  43           1HE      HIS  43  -5.299  11.905   5.785
  354    HE2  HIS  43           2HE      HIS  43  -3.057  12.676   4.948
  355    HB2  HIS  43           1HB      HIS  43  -3.487   7.587   5.727
  356    HB3  HIS  43           2HB      HIS  43  -1.870   8.077   6.201
  357    H    LEU  44           H        LEU  44  -3.126   5.365   4.222
  358    HA   LEU  44           HA       LEU  44  -1.059   4.072   5.677
  359    HG   LEU  44           HG       LEU  44  -1.764   1.651   6.253
  360    HB2  LEU  44           1HB      LEU  44  -3.383   3.707   6.102
  361    HB3  LEU  44           2HB      LEU  44  -3.631   3.136   4.477
  362   HD11  LEU  44          1HD1      LEU  44  -3.703   0.391   7.078
  363   HD12  LEU  44          2HD1      LEU  44  -4.780   1.526   6.259
  364   HD13  LEU  44          3HD1      LEU  44  -3.766   2.073   7.596
  365   HD21  LEU  44          3HD2      LEU  44  -3.638   0.979   3.979
  366   HD22  LEU  44          1HD2      LEU  44  -2.818  -0.236   4.973
  367   HD23  LEU  44          2HD2      LEU  44  -1.891   0.906   4.019
  368    H    GLN  45           H        GLN  45  -2.423   3.501   2.395
  369    HA   GLN  45           HA       GLN  45  -0.448   1.622   1.739
  370    HB2  GLN  45           1HB      GLN  45  -2.125   3.331  -0.125
  371    HB3  GLN  45           2HB      GLN  45  -1.188   1.934  -0.621
  372    HG2  GLN  45           1HG      GLN  45  -3.576   1.905   1.249
  373    HG3  GLN  45           2HG      GLN  45  -3.570   1.378  -0.427
  374   HE21  GLN  45          1HE2      GLN  45  -4.407  -0.239   1.837
  375   HE22  GLN  45          2HE2      GLN  45  -3.340  -1.564   1.959
  376    H    GLU  46           H        GLU  46  -0.407   5.077   1.717
  377    HA   GLU  46           HA       GLU  46   1.958   5.592   0.263
  378    HB2  GLU  46           1HB      GLU  46   0.588   7.338   0.909
  379    HB3  GLU  46           2HB      GLU  46   0.648   6.934   2.624
  380    HG2  GLU  46           1HG      GLU  46   3.020   7.528   2.591
  381    HG3  GLU  46           2HG      GLU  46   2.851   8.114   0.919
  382    H    ALA  47           H        ALA  47   1.369   4.831   3.653
  383    HA   ALA  47           HA       ALA  47   4.013   5.005   4.625
  384    HB1  ALA  47           3HB      ALA  47   3.158   3.807   6.560
  385    HB2  ALA  47           1HB      ALA  47   1.684   3.419   5.676
  386    HB3  ALA  47           2HB      ALA  47   2.056   5.107   6.077
  387    H    LEU  48           H        LEU  48   2.345   2.653   2.874
  388    HA   LEU  48           HA       LEU  48   3.674   0.295   3.568
  389    HG   LEU  48           HG       LEU  48   2.547  -1.702   2.064
  390    HB2  LEU  48           1HB      LEU  48   1.600   0.532   2.190
  391    HB3  LEU  48           2HB      LEU  48   2.586   1.083   0.861
  392   HD11  LEU  48          1HD1      LEU  48   1.597  -0.703  -0.603
  393   HD12  LEU  48          2HD1      LEU  48   0.575  -0.990   0.791
  394   HD13  LEU  48          3HD1      LEU  48   1.431  -2.343   0.046
  395   HD21  LEU  48          3HD2      LEU  48   4.784  -1.175   1.128
  396   HD22  LEU  48          1HD2      LEU  48   4.025  -0.729  -0.397
  397   HD23  LEU  48          2HD2      LEU  48   3.944  -2.396   0.177
  398    H    GLU  49           H        GLU  49   4.418   2.740   1.021
  399    HA   GLU  49           HA       GLU  49   6.914   1.280   0.787
  400    HB2  GLU  49           1HB      GLU  49   5.709   0.993  -1.263
  401    HB3  GLU  49           2HB      GLU  49   5.458   2.717  -1.432
  402    HG2  GLU  49           1HG      GLU  49   7.171   1.642  -2.972
  403    HG3  GLU  49           2HG      GLU  49   7.686   3.084  -2.107
  404    H    THR  50           H        THR  50   6.668   4.429  -0.672
  405    HA   THR  50           HA       THR  50   9.086   5.024   0.905
  406    HB   THR  50           HB       THR  50   8.285   6.465  -1.628
  407    HG1  THR  50           1HG      THR  50   9.373   3.832  -1.355
  408   HG21  THR  50          3HG2      THR  50  10.165   7.380  -0.322
  409   HG22  THR  50          1HG2      THR  50  10.722   6.743  -1.869
  410   HG23  THR  50          2HG2      THR  50  10.974   5.814  -0.393
  411    H    GLY  51           H        GLY  51   6.167   5.484   1.505
  412    HA2  GLY  51           1HA      GLY  51   5.903   8.351   1.477
  413    HA3  GLY  51           2HA      GLY  51   4.745   7.164   2.070
  414    H    CYS  52           H        CYS  52   4.620   6.820   4.200
  415    HA   CYS  52           HA       CYS  52   6.834   7.646   5.852
  416    HB2  CYS  52           1HB      CYS  52   5.573   9.694   5.612
  417    HB3  CYS  52           2HB      CYS  52   4.096   8.876   6.100
  418    H    GLU  53           H        GLU  53   7.081   5.577   6.477
  419    HA   GLU  53           HA       GLU  53   5.035   3.818   7.372
  420    HB2  GLU  53           1HB      GLU  53   7.000   2.494   8.242
  421    HB3  GLU  53           2HB      GLU  53   7.067   2.883   6.529
  422    HG2  GLU  53           1HG      GLU  53   8.627   4.700   6.985
  423    HG3  GLU  53           2HG      GLU  53   8.531   4.367   8.709
  424    H    LYS  54           H        LYS  54   7.195   6.003   9.020
  425    HA   LYS  54           HA       LYS  54   6.271   5.123  11.622
  426    HB2  LYS  54           1HB      LYS  54   8.002   6.882  12.428
  427    HB3  LYS  54           2HB      LYS  54   8.549   5.365  11.757
  428    HG2  LYS  54           1HG      LYS  54   9.932   7.116  10.923
  429    HG3  LYS  54           2HG      LYS  54   8.955   6.529   9.589
  430    HD2  LYS  54           1HD      LYS  54   9.073   8.903   9.449
  431    HD3  LYS  54           2HD      LYS  54   7.439   8.493   9.962
  432    HE2  LYS  54           1HE      LYS  54   8.006   9.049  12.264
  433    HE3  LYS  54           2HE      LYS  54   9.678   9.364  11.795
  434    HZ1  LYS  54           3HZ      LYS  54   7.294  10.911  10.922
  435    HZ2  LYS  54           1HZ      LYS  54   8.875  11.163  10.380
  436    HZ3  LYS  54           2HZ      LYS  54   8.471  11.404  12.003
  437    H    CYS  55           H        CYS  55   4.574   6.736   9.781
  438    HA   CYS  55           HA       CYS  55   4.300   9.251  11.019
  439    HB2  CYS  55           1HB      CYS  55   2.977   7.869   8.873
  440    HB3  CYS  55           2HB      CYS  55   1.931   8.980   9.736
  441    H    THR  56           H        THR  56   1.198   7.634  10.777
  442    HA   THR  56           HA       THR  56   0.829   8.295  13.567
  443    HB   THR  56           HB       THR  56  -1.596   7.931  12.979
  444    HG1  THR  56           1HG      THR  56  -1.533   8.098  10.392
  445   HG21  THR  56          3HG2      THR  56  -0.570  10.185  12.854
  446   HG22  THR  56          1HG2      THR  56  -1.811   9.968  11.616
  447   HG23  THR  56          2HG2      THR  56  -0.106   9.862  11.187
  448    H    GLU  57           H        GLU  57  -0.944   6.592  14.541
  449    HA   GLU  57           HA       GLU  57   0.494   4.144  14.662
  450    HB2  GLU  57           1HB      GLU  57  -1.191   3.385  16.266
  451    HB3  GLU  57           2HB      GLU  57  -0.705   5.015  16.664
  452    HG2  GLU  57           1HG      GLU  57  -3.239   4.348  15.162
  453    HG3  GLU  57           2HG      GLU  57  -3.153   4.493  16.909
  454    H    ALA  58           H        ALA  58  -2.372   5.345  13.149
  455    HA   ALA  58           HA       ALA  58  -3.401   2.948  12.093
  456    HB1  ALA  58           3HB      ALA  58  -4.682   5.039  12.172
  457    HB2  ALA  58           1HB      ALA  58  -3.594   5.748  10.979
  458    HB3  ALA  58           2HB      ALA  58  -4.623   4.389  10.532
  459    H    GLN  59           H        GLN  59  -1.198   5.367  10.751
  460    HA   GLN  59           HA       GLN  59  -0.777   3.988   8.345
  461    HB2  GLN  59           1HB      GLN  59   0.756   6.158   9.707
  462    HB3  GLN  59           2HB      GLN  59   1.324   5.438   8.208
  463    HG2  GLN  59           1HG      GLN  59  -0.640   6.149   7.044
  464    HG3  GLN  59           2HG      GLN  59  -1.388   6.691   8.545
  465   HE21  GLN  59          1HE2      GLN  59   1.173   7.343   6.248
  466   HE22  GLN  59          2HE2      GLN  59   1.372   8.996   6.671
  467    H    GLU  60           H        GLU  60   1.150   4.010  11.355
  468    HA   GLU  60           HA       GLU  60   3.051   2.340  10.192
  469    HB2  GLU  60           1HB      GLU  60   4.059   1.941  12.377
  470    HB3  GLU  60           2HB      GLU  60   3.636   3.623  12.189
  471    HG2  GLU  60           1HG      GLU  60   2.913   3.364  14.311
  472    HG3  GLU  60           2HG      GLU  60   1.470   2.735  13.515
  473    H    LYS  61           H        LYS  61   0.309   1.301  12.247
  474    HA   LYS  61           HA       LYS  61   0.674  -1.495  12.129
  475    HB2  LYS  61           1HB      LYS  61  -1.888   0.137  12.126
  476    HB3  LYS  61           2HB      LYS  61  -1.860  -1.597  12.303
  477    HG2  LYS  61           1HG      LYS  61  -0.294   0.016  14.252
  478    HG3  LYS  61           2HG      LYS  61  -2.050   0.069  14.366
  479    HD2  LYS  61           1HD      LYS  61  -1.185  -1.657  15.852
  480    HD3  LYS  61           2HD      LYS  61  -2.083  -2.404  14.540
  481    HE2  LYS  61           1HE      LYS  61  -0.067  -3.642  15.008
  482    HE3  LYS  61           2HE      LYS  61   0.044  -2.913  13.411
  483    HZ1  LYS  61           3HZ      LYS  61   2.071  -2.500  14.352
  484    HZ2  LYS  61           1HZ      LYS  61   1.470  -2.087  15.889
  485    HZ3  LYS  61           2HZ      LYS  61   1.283  -1.053  14.587
  486    H    GLY  62           H        GLY  62  -0.598   0.749   9.936
  487    HA2  GLY  62           1HA      GLY  62  -1.951  -1.128   8.233
  488    HA3  GLY  62           2HA      GLY  62  -1.762   0.629   7.966
  489    H    ALA  63           H        ALA  63   0.989   0.769   8.141
  490    HA   ALA  63           HA       ALA  63   1.870   0.131   5.602
  491    HB1  ALA  63           3HB      ALA  63   4.118   0.576   6.462
  492    HB2  ALA  63           1HB      ALA  63   2.968   1.775   7.065
  493    HB3  ALA  63           2HB      ALA  63   3.510   0.470   8.116
  494    H    GLU  64           H        GLU  64   2.503  -1.434   8.685
  495    HA   GLU  64           HA       GLU  64   4.033  -3.615   7.935
  496    HB2  GLU  64           1HB      GLU  64   1.764  -3.918   9.881
  497    HB3  GLU  64           2HB      GLU  64   3.311  -4.743   9.868
  498    HG2  GLU  64           1HG      GLU  64   4.311  -2.377  10.318
  499    HG3  GLU  64           2HG      GLU  64   2.668  -1.958  10.599
  500    H    THR  65           H        THR  65   0.557  -3.374   8.001
  501    HA   THR  65           HA       THR  65  -0.054  -6.047   7.125
  502    HB   THR  65           HB       THR  65  -1.756  -3.543   7.070
  503    HG1  THR  65           1HG      THR  65  -0.944  -3.817   9.198
  504   HG21  THR  65          3HG2      THR  65  -2.473  -6.473   7.345
  505   HG22  THR  65          1HG2      THR  65  -2.722  -5.495   5.900
  506   HG23  THR  65          2HG2      THR  65  -3.618  -5.132   7.376
  507    H    SER  66           H        SER  66  -0.047  -2.961   5.402
  508    HA   SER  66           HA       SER  66  -0.756  -4.235   3.038
  509    HG   SER  66           HG       SER  66  -1.411  -1.321   4.484
  510    HB2  SER  66           1HB      SER  66   0.366  -1.487   3.449
  511    HB3  SER  66           2HB      SER  66  -0.538  -2.074   2.040
  512    H    ILE  67           H        ILE  67   2.368  -3.339   4.347
  513    HA   ILE  67           HA       ILE  67   3.949  -3.837   2.088
  514    HB   ILE  67           HB       ILE  67   4.537  -4.109   5.066
  515   HG12  ILE  67          1HG1      ILE  67   5.403  -1.990   3.088
  516   HG13  ILE  67          2HG1      ILE  67   4.026  -1.844   4.173
  517   HG21  ILE  67          1HG2      ILE  67   6.541  -4.214   2.815
  518   HG22  ILE  67          2HG2      ILE  67   6.085  -5.559   3.857
  519   HG23  ILE  67          3HG2      ILE  67   6.925  -4.162   4.534
  520   HD11  ILE  67          3HD1      ILE  67   5.914  -0.624   5.031
  521   HD12  ILE  67          1HD1      ILE  67   6.919  -2.084   4.973
  522   HD13  ILE  67          2HD1      ILE  67   5.541  -1.993   6.086
  523    H    ASP  68           H        ASP  68   2.555  -5.894   4.532
  524    HA   ASP  68           HA       ASP  68   3.907  -8.271   3.913
  525    HB2  ASP  68           1HB      ASP  68   2.634  -7.920   6.004
  526    HB3  ASP  68           2HB      ASP  68   1.136  -7.974   5.090
  527    H    TYR  69           H        TYR  69   0.546  -7.325   2.857
  528    HA   TYR  69           HA       TYR  69   0.648  -9.746   1.307
  529    HD1  TYR  69           1HD      TYR  69  -1.624  -9.624  -1.286
  530    HD2  TYR  69           2HD      TYR  69  -2.116 -10.734   2.777
  531    HE1  TYR  69           1HE      TYR  69  -2.491 -11.810  -1.984
  532    HE2  TYR  69           2HE      TYR  69  -2.992 -12.914   2.085
  533    HH   TYR  69           HH       TYR  69  -3.982 -13.955   0.235
  534    HB2  TYR  69           1HB      TYR  69  -1.690  -8.516   2.203
  535    HB3  TYR  69           2HB      TYR  69  -1.596  -7.982   0.529
  536    H    LEU  70           H        LEU  70   1.345  -6.448   0.513
  537    HA   LEU  70           HA       LEU  70   1.053  -6.693  -2.308
  538    HG   LEU  70           HG       LEU  70   2.989  -4.911  -3.229
  539    HB2  LEU  70           1HB      LEU  70   1.163  -4.569  -0.921
  540    HB3  LEU  70           2HB      LEU  70   2.881  -4.872  -0.769
  541   HD11  LEU  70          1HD1      LEU  70   0.234  -3.713  -2.980
  542   HD12  LEU  70          2HD1      LEU  70   0.659  -5.234  -3.768
  543   HD13  LEU  70          3HD1      LEU  70   1.205  -3.700  -4.448
  544   HD21  LEU  70          3HD2      LEU  70   2.182  -2.355  -1.872
  545   HD22  LEU  70          1HD2      LEU  70   2.953  -2.444  -3.450
  546   HD23  LEU  70          2HD2      LEU  70   3.811  -3.018  -2.020
  547    H    ILE  71           H        ILE  71   3.891  -6.963  -0.176
  548    HA   ILE  71           HA       ILE  71   5.584  -7.487  -2.413
  549    HB   ILE  71           HB       ILE  71   6.107  -7.997   0.536
  550   HG12  ILE  71          1HG1      ILE  71   6.845  -5.636  -1.213
  551   HG13  ILE  71          2HG1      ILE  71   5.594  -5.645   0.017
  552   HG21  ILE  71          1HG2      ILE  71   7.629  -9.274  -0.901
  553   HG22  ILE  71          2HG2      ILE  71   8.484  -7.974  -0.072
  554   HG23  ILE  71          3HG2      ILE  71   8.052  -7.799  -1.774
  555   HD11  ILE  71          3HD1      ILE  71   7.280  -6.027   1.742
  556   HD12  ILE  71          1HD1      ILE  71   7.608  -4.554   0.817
  557   HD13  ILE  71          2HD1      ILE  71   8.539  -6.021   0.499
  558    H    LYS  72           H        LYS  72   3.650  -9.466  -0.329
  559    HA   LYS  72           HA       LYS  72   5.037 -11.881  -1.130
  560    HB2  LYS  72           1HB      LYS  72   2.706 -11.484   0.708
  561    HB3  LYS  72           2HB      LYS  72   3.592 -12.993   0.465
  562    HG2  LYS  72           1HG      LYS  72   5.624 -12.014   1.343
  563    HG3  LYS  72           2HG      LYS  72   4.782 -10.452   1.191
  564    HD2  LYS  72           1HD      LYS  72   4.999 -11.417   3.582
  565    HD3  LYS  72           2HD      LYS  72   3.425 -10.827   3.059
  566    HE2  LYS  72           1HE      LYS  72   2.854 -13.197   2.482
  567    HE3  LYS  72           2HE      LYS  72   4.373 -13.670   3.246
  568    HZ1  LYS  72           3HZ      LYS  72   2.237 -12.134   4.605
  569    HZ2  LYS  72           1HZ      LYS  72   3.629 -12.753   5.305
  570    HZ3  LYS  72           2HZ      LYS  72   2.440 -13.810   4.748
  571    H    ASN  73           H        ASN  73   2.513 -10.099  -2.400
  572    HA   ASN  73           HA       ASN  73   1.856 -12.436  -4.044
  573    HB2  ASN  73           1HB      ASN  73  -0.012 -12.110  -2.362
  574    HB3  ASN  73           2HB      ASN  73  -0.321 -10.551  -3.123
  575   HD21  ASN  73          1HD2      ASN  73  -2.439 -11.048  -4.041
  576   HD22  ASN  73          2HD2      ASN  73  -2.584 -12.215  -5.249
  577    H    GLU  74           H        GLU  74   1.441  -8.939  -3.685
  578    HA   GLU  74           HA       GLU  74   1.112  -8.938  -6.600
  579    HB2  GLU  74           1HB      GLU  74  -0.013  -6.834  -4.756
  580    HB3  GLU  74           2HB      GLU  74  -0.261  -6.930  -6.493
  581    HG2  GLU  74           1HG      GLU  74  -1.212  -8.944  -4.452
  582    HG3  GLU  74           2HG      GLU  74  -2.204  -7.737  -5.249
  583    H    LEU  75           H        LEU  75   3.198  -8.980  -6.793
  584    HA   LEU  75           HA       LEU  75   5.023  -7.002  -5.897
  585    HG   LEU  75           HG       LEU  75   7.217  -7.366  -8.125
  586    HB2  LEU  75           1HB      LEU  75   5.677  -9.296  -6.384
  587    HB3  LEU  75           2HB      LEU  75   5.374  -9.027  -8.087
  588   HD11  LEU  75          1HD1      LEU  75   8.769  -7.257  -6.234
  589   HD12  LEU  75          2HD1      LEU  75   7.681  -8.269  -5.283
  590   HD13  LEU  75          3HD1      LEU  75   7.169  -6.660  -5.797
  591   HD21  LEU  75          3HD2      LEU  75   7.629  -9.673  -8.756
  592   HD22  LEU  75          1HD2      LEU  75   7.958 -10.094  -7.075
  593   HD23  LEU  75          2HD2      LEU  75   9.033  -8.993  -7.934
  594    H    GLU  76           H        GLU  76   3.187  -7.251  -8.937
  595    HA   GLU  76           HA       GLU  76   4.882  -5.319 -10.233
  596    HB2  GLU  76           1HB      GLU  76   3.370  -5.345 -12.122
  597    HB3  GLU  76           2HB      GLU  76   3.587  -6.997 -11.600
  598    HG2  GLU  76           1HG      GLU  76   1.191  -5.305 -10.892
  599    HG3  GLU  76           2HG      GLU  76   1.261  -6.367 -12.292
  600    H    ILE  77           H        ILE  77   1.987  -5.334  -8.417
  601    HA   ILE  77           HA       ILE  77   1.202  -2.665  -8.843
  602    HB   ILE  77           HB       ILE  77   0.837  -4.364  -6.372
  603   HG12  ILE  77          1HG1      ILE  77  -0.111  -5.327  -8.470
  604   HG13  ILE  77          2HG1      ILE  77  -1.335  -4.968  -7.246
  605   HG21  ILE  77          1HG2      ILE  77  -0.625  -1.860  -7.226
  606   HG22  ILE  77          2HG2      ILE  77   0.534  -1.982  -5.905
  607   HG23  ILE  77          3HG2      ILE  77  -1.001  -2.836  -5.805
  608   HD11  ILE  77          3HD1      ILE  77  -0.704  -3.266  -9.657
  609   HD12  ILE  77          1HD1      ILE  77  -1.961  -2.975  -8.452
  610   HD13  ILE  77          2HD1      ILE  77  -2.063  -4.385  -9.507
  611    H    TRP  78           H        TRP  78   3.339  -4.182  -6.487
  612    HA   TRP  78           HA       TRP  78   4.028  -1.956  -4.962
  613    HD1  TRP  78           HD       TRP  78   5.867  -1.931  -2.739
  614    HE1  TRP  78           1HE      TRP  78   8.310  -1.218  -2.431
  615    HE3  TRP  78           3HE      TRP  78   7.941  -4.436  -6.685
  616    HZ2  TRP  78           2HZ      TRP  78  10.804  -1.687  -3.674
  617    HZ3  TRP  78           3HZ      TRP  78  10.369  -4.255  -7.049
  618    HH2  TRP  78           HH       TRP  78  11.769  -2.910  -5.573
  619    HB2  TRP  78           1HB      TRP  78   4.834  -4.099  -4.232
  620    HB3  TRP  78           2HB      TRP  78   5.684  -4.368  -5.754
  621    H    LYS  79           H        LYS  79   5.387  -3.090  -7.941
  622    HA   LYS  79           HA       LYS  79   7.435  -1.202  -8.181
  623    HB2  LYS  79           1HB      LYS  79   5.941  -2.652 -10.342
  624    HB3  LYS  79           2HB      LYS  79   7.519  -1.873 -10.530
  625    HG2  LYS  79           1HG      LYS  79   8.455  -3.418  -8.862
  626    HG3  LYS  79           2HG      LYS  79   6.880  -4.191  -8.708
  627    HD2  LYS  79           1HD      LYS  79   8.168  -5.555 -10.126
  628    HD3  LYS  79           2HD      LYS  79   7.018  -4.699 -11.150
  629    HE2  LYS  79           1HE      LYS  79   8.796  -3.057 -11.692
  630    HE3  LYS  79           2HE      LYS  79   9.925  -4.019 -10.745
  631    HZ1  LYS  79           3HZ      LYS  79   9.413  -5.903 -12.251
  632    HZ2  LYS  79           1HZ      LYS  79  10.139  -4.593 -13.042
  633    HZ3  LYS  79           2HZ      LYS  79   8.491  -4.848 -13.182
  634    H    GLU  80           H        GLU  80   4.043  -1.048  -9.069
  635    HA   GLU  80           HA       GLU  80   4.222   1.370 -10.525
  636    HB2  GLU  80           1HB      GLU  80   1.870   0.195  -9.045
  637    HB3  GLU  80           2HB      GLU  80   1.786   1.584 -10.116
  638    HG2  GLU  80           1HG      GLU  80   2.637   0.120 -11.952
  639    HG3  GLU  80           2HG      GLU  80   2.501  -1.245 -10.845
  640    H    LEU  81           H        LEU  81   3.651   0.686  -7.100
  641    HA   LEU  81           HA       LEU  81   3.296   3.405  -6.333
  642    HG   LEU  81           HG       LEU  81   2.271   1.324  -3.388
  643    HB2  LEU  81           1HB      LEU  81   4.191   1.017  -4.683
  644    HB3  LEU  81           2HB      LEU  81   4.109   2.625  -4.049
  645   HD11  LEU  81          1HD1      LEU  81   1.441   3.525  -5.298
  646   HD12  LEU  81          2HD1      LEU  81   1.916   3.722  -3.608
  647   HD13  LEU  81          3HD1      LEU  81   0.425   2.868  -4.013
  648   HD21  LEU  81          3HD2      LEU  81   1.490   1.123  -6.287
  649   HD22  LEU  81          1HD2      LEU  81   0.472   0.632  -4.935
  650   HD23  LEU  81          2HD2      LEU  81   1.997  -0.199  -5.239
  651    H    THR  82           H        THR  82   6.044   1.290  -6.417
  652    HA   THR  82           HA       THR  82   8.104   3.021  -5.614
  653    HB   THR  82           HB       THR  82   8.333   1.115  -7.962
  654    HG1  THR  82           1HG      THR  82   8.199   0.569  -5.169
  655   HG21  THR  82          3HG2      THR  82  10.310   1.957  -5.832
  656   HG22  THR  82          1HG2      THR  82  10.294   2.521  -7.507
  657   HG23  THR  82          2HG2      THR  82  10.628   0.821  -7.149
  658    H    ALA  83           H        ALA  83   6.848   2.575  -8.915
  659    HA   ALA  83           HA       ALA  83   8.394   4.578 -10.077
  660    HB1  ALA  83           3HB      ALA  83   5.711   3.551 -10.985
  661    HB2  ALA  83           1HB      ALA  83   6.864   4.445 -11.974
  662    HB3  ALA  83           2HB      ALA  83   7.275   2.838 -11.372
  663    H    HIS  84           H        HIS  84   5.554   4.809  -8.183
  664    HA   HIS  84           HA       HIS  84   4.808   7.454  -9.079
  665    HD1  HIS  84           1HD      HIS  84   1.430   7.738  -8.896
  666    HD2  HIS  84           2HD      HIS  84   3.308   8.258  -5.218
  667    HE1  HIS  84           1HE      HIS  84   0.162   9.548  -7.734
  668    HE2  HIS  84           2HE      HIS  84   1.469  10.005  -5.645
  669    HB2  HIS  84           1HB      HIS  84   3.071   5.850  -8.327
  670    HB3  HIS  84           2HB      HIS  84   3.785   5.839  -6.725
  671    H    PHE  85           H        PHE  85   6.429   6.055  -6.247
  672    HA   PHE  85           HA       PHE  85   6.727   8.737  -5.130
  673    HD1  PHE  85           2HD      PHE  85   5.472   9.041  -3.024
  674    HD2  PHE  85           1HD      PHE  85   5.686   4.815  -3.395
  675    HE1  PHE  85           2HE      PHE  85   3.210   8.845  -2.056
  676    HE2  PHE  85           1HE      PHE  85   3.436   4.607  -2.423
  677    HZ   PHE  85           HZ       PHE  85   2.195   6.625  -1.753
  678    HB2  PHE  85           1HB      PHE  85   7.522   6.071  -3.945
  679    HB3  PHE  85           2HB      PHE  85   7.715   7.634  -3.167
  680    H    ASP  86           H        ASP  86   8.978   5.996  -5.645
  681    HA   ASP  86           HA       ASP  86  11.010   7.952  -6.360
  682    HB2  ASP  86           1HB      ASP  86  11.414   7.238  -3.996
  683    HB3  ASP  86           2HB      ASP  86  11.496   5.565  -4.539
  684    HA   PRO  87           HA       PRO  87  10.467   4.690  -9.464
  685    HB2  PRO  87           1HB      PRO  87  10.859   6.236 -11.634
  686    HB3  PRO  87           2HB      PRO  87   9.344   6.217 -10.701
  687    HG2  PRO  87           1HG      PRO  87  11.620   8.165 -10.504
  688    HG3  PRO  87           2HG      PRO  87   9.884   8.515 -10.675
  689    HD2  PRO  87           1HD      PRO  87  11.178   8.559  -8.320
  690    HD3  PRO  87           2HD      PRO  87   9.480   8.050  -8.454
  691    H    ASP  88           H        ASP  88  13.044   6.447  -8.406
  692    HA   ASP  88           HA       ASP  88  15.030   5.575 -10.314
  693    HB2  ASP  88           1HB      ASP  88  15.287   6.890  -7.602
  694    HB3  ASP  88           2HB      ASP  88  16.654   6.483  -8.627
  695    H    GLY  89           H        GLY  89  13.546   4.407  -7.448
  696    HA2  GLY  89           1HA      GLY  89  13.686   2.333  -6.471
  697    HA3  GLY  89           2HA      GLY  89  14.890   1.879  -7.679
  698    H    LYS  90           H        LYS  90  14.993   4.681  -5.614
  699    HA   LYS  90           HA       LYS  90  17.670   4.063  -4.831
  700    HB2  LYS  90           1HB      LYS  90  17.047   6.364  -5.297
  701    HB3  LYS  90           2HB      LYS  90  15.810   6.307  -4.055
  702    HG2  LYS  90           1HG      LYS  90  17.786   7.532  -3.301
  703    HG3  LYS  90           2HG      LYS  90  17.504   6.092  -2.325
  704    HD2  LYS  90           1HD      LYS  90  19.851   6.236  -2.781
  705    HD3  LYS  90           2HD      LYS  90  19.192   4.894  -3.685
  706    HE2  LYS  90           1HE      LYS  90  20.734   6.166  -5.075
  707    HE3  LYS  90           2HE      LYS  90  19.097   6.254  -5.724
  708    HZ1  LYS  90           3HZ      LYS  90  18.937   8.484  -4.584
  709    HZ2  LYS  90           1HZ      LYS  90  20.100   8.412  -5.797
  710    HZ3  LYS  90           2HZ      LYS  90  20.567   8.333  -4.210
  711    H    TRP  91           H        TRP  91  14.588   4.366  -3.167
  712    HA   TRP  91           HA       TRP  91  15.820   3.618  -0.692
  713    HD1  TRP  91           HD       TRP  91  13.251   6.722  -2.286
  714    HE1  TRP  91           1HE      TRP  91  14.467   8.844  -1.564
  715    HE3  TRP  91           3HE      TRP  91  15.817   4.836   1.713
  716    HZ2  TRP  91           2HZ      TRP  91  16.298   9.635   0.452
  717    HZ3  TRP  91           3HZ      TRP  91  17.282   6.344   2.984
  718    HH2  TRP  91           HH       TRP  91  17.518   8.693   2.366
  719    HB2  TRP  91           1HB      TRP  91  12.951   4.349  -1.300
  720    HB3  TRP  91           2HB      TRP  91  13.600   4.069   0.318
  721    H    ARG  92           H        ARG  92  15.774   1.799  -2.731
  722    HA   ARG  92           HA       ARG  92  14.014  -0.389  -2.333
  723    HE   ARG  92           HE       ARG  92  19.493   0.735  -4.142
  724    HB2  ARG  92           1HB      ARG  92  15.843  -1.718  -3.399
  725    HB3  ARG  92           2HB      ARG  92  15.386  -0.290  -4.318
  726    HG2  ARG  92           1HG      ARG  92  17.313   0.909  -3.463
  727    HG3  ARG  92           2HG      ARG  92  17.752  -0.474  -2.467
  728    HD2  ARG  92           1HD      ARG  92  18.172  -1.792  -4.397
  729    HD3  ARG  92           2HD      ARG  92  17.573  -0.516  -5.466
  730   HH11  ARG  92          1HH1      ARG  92  19.528  -2.480  -5.657
  731   HH12  ARG  92          2HH1      ARG  92  21.137  -2.360  -6.212
  732   HH21  ARG  92          1HH2      ARG  92  21.720   0.888  -4.933
  733   HH22  ARG  92          2HH2      ARG  92  22.413  -0.411  -5.776
  734    H    LYS  93           H        LYS  93  16.861   0.778  -0.737
  735    HA   LYS  93           HA       LYS  93  17.213  -1.567   0.823
  736    HB2  LYS  93           1HB      LYS  93  19.126  -0.192   0.195
  737    HB3  LYS  93           2HB      LYS  93  18.456   1.154   1.092
  738    HG2  LYS  93           1HG      LYS  93  18.833   0.124   3.190
  739    HG3  LYS  93           2HG      LYS  93  19.055  -1.462   2.462
  740    HD2  LYS  93           1HD      LYS  93  20.944   0.851   2.048
  741    HD3  LYS  93           2HD      LYS  93  21.150  -0.362   3.306
  742    HE2  LYS  93           1HE      LYS  93  21.082  -0.897   0.320
  743    HE3  LYS  93           2HE      LYS  93  22.511  -0.872   1.346
  744    HZ1  LYS  93           3HZ      LYS  93  21.846  -3.121   0.973
  745    HZ2  LYS  93           1HZ      LYS  93  20.280  -2.883   1.540
  746    HZ3  LYS  93           2HZ      LYS  93  21.576  -2.772   2.583
  747    H    LYS  94           H        LYS  94  15.359   1.346   1.135
  748    HA   LYS  94           HA       LYS  94  14.970   0.921   3.950
  749    HB2  LYS  94           1HB      LYS  94  14.738   3.203   2.754
  750    HB3  LYS  94           2HB      LYS  94  13.189   2.610   2.171
  751    HG2  LYS  94           1HG      LYS  94  12.831   3.983   4.125
  752    HG3  LYS  94           2HG      LYS  94  12.459   2.303   4.526
  753    HD2  LYS  94           1HD      LYS  94  14.677   2.053   5.560
  754    HD3  LYS  94           2HD      LYS  94  15.065   3.718   5.140
  755    HE2  LYS  94           1HE      LYS  94  14.462   3.609   7.458
  756    HE3  LYS  94           2HE      LYS  94  13.189   4.446   6.580
  757    HZ1  LYS  94           3HZ      LYS  94  13.038   1.556   7.335
  758    HZ2  LYS  94           1HZ      LYS  94  11.792   2.524   6.715
  759    HZ3  LYS  94           2HZ      LYS  94  12.381   2.809   8.238
  760    H    TYR  95           H        TYR  95  13.414   0.216   0.926
  761    HA   TYR  95           HA       TYR  95  11.140  -1.156   1.792
  762    HD1  TYR  95           2HD      TYR  95   9.433  -2.450  -0.367
  763    HD2  TYR  95           1HD      TYR  95  13.464  -3.404  -1.295
  764    HE1  TYR  95           2HE      TYR  95   8.710  -4.576  -1.365
  765    HE2  TYR  95           1HE      TYR  95  12.753  -5.526  -2.290
  766    HH   TYR  95           HH       TYR  95   9.539  -6.190  -3.036
  767    HB2  TYR  95           1HB      TYR  95  11.221  -0.735  -0.486
  768    HB3  TYR  95           2HB      TYR  95  12.909  -1.209  -0.631
  769    H    GLU  96           H        GLU  96  14.407  -2.264   1.166
  770    HA   GLU  96           HA       GLU  96  14.371  -4.944   1.852
  771    HB2  GLU  96           1HB      GLU  96  16.220  -3.572   0.890
  772    HB3  GLU  96           2HB      GLU  96  16.459  -2.854   2.463
  773    HG2  GLU  96           1HG      GLU  96  16.974  -5.176   3.290
  774    HG3  GLU  96           2HG      GLU  96  17.017  -5.653   1.589
  775    H    ASP  97           H        ASP  97  15.129  -2.140   3.900
  776    HA   ASP  97           HA       ASP  97  15.311  -3.262   6.426
  777    HB2  ASP  97           1HB      ASP  97  15.983  -1.012   6.149
  778    HB3  ASP  97           2HB      ASP  97  14.449  -0.558   5.433
  779    H    ARG  98           H        ARG  98  12.468  -1.757   4.974
  780    HA   ARG  98           HA       ARG  98  10.649  -2.237   7.021
  781    HE   ARG  98           HE       ARG  98   8.073  -0.444   3.648
  782    HB2  ARG  98           1HB      ARG  98  10.412  -1.734   4.103
  783    HB3  ARG  98           2HB      ARG  98   8.982  -2.118   5.044
  784    HG2  ARG  98           1HG      ARG  98   9.020  -0.134   6.170
  785    HG3  ARG  98           2HG      ARG  98  10.773   0.023   6.044
  786    HD2  ARG  98           1HD      ARG  98   9.305   1.602   4.643
  787    HD3  ARG  98           2HD      ARG  98  10.680   0.822   3.870
  788   HH11  ARG  98          1HH1      ARG  98  10.412   1.696   2.128
  789   HH12  ARG  98          2HH1      ARG  98   9.967   1.279   0.520
  790   HH21  ARG  98          1HH2      ARG  98   7.552  -1.102   1.439
  791   HH22  ARG  98          2HH2      ARG  98   8.401  -0.361   0.144
  792    H    ALA  99           H        ALA  99  11.325  -4.209   4.171
  793    HA   ALA  99           HA       ALA  99   9.256  -6.048   4.823
  794    HB1  ALA  99           3HB      ALA  99  10.117  -7.343   2.927
  795    HB2  ALA  99           1HB      ALA  99   9.896  -5.639   2.523
  796    HB3  ALA  99           2HB      ALA  99  11.511  -6.262   2.858
  797    H    LYS 100           H        LYS 100  12.834  -6.303   4.917
  798    HA   LYS 100           HA       LYS 100  12.501  -8.968   5.850
  799    HB2  LYS 100           1HB      LYS 100  14.216  -8.166   4.162
  800    HB3  LYS 100           2HB      LYS 100  15.116  -7.534   5.527
  801    HG2  LYS 100           1HG      LYS 100  15.965  -9.705   4.848
  802    HG3  LYS 100           2HG      LYS 100  15.269  -9.757   6.472
  803    HD2  LYS 100           1HD      LYS 100  13.219 -10.739   5.590
  804    HD3  LYS 100           2HD      LYS 100  13.852 -10.625   3.953
  805    HE2  LYS 100           1HE      LYS 100  15.110 -12.253   6.152
  806    HE3  LYS 100           2HE      LYS 100  14.026 -12.901   4.925
  807    HZ1  LYS 100           3HZ      LYS 100  16.636 -11.578   4.369
  808    HZ2  LYS 100           1HZ      LYS 100  15.604 -12.294   3.226
  809    HZ3  LYS 100           2HZ      LYS 100  16.350 -13.237   4.390
  810    H    ALA 101           H        ALA 101  12.796  -5.962   7.455
  811    HA   ALA 101           HA       ALA 101  13.883  -7.175   9.845
  812    HB1  ALA 101           3HB      ALA 101  14.358  -4.804   9.369
  813    HB2  ALA 101           1HB      ALA 101  12.640  -4.442   9.533
  814    HB3  ALA 101           2HB      ALA 101  13.555  -5.018  10.927
  815    H    LYS 102           H        LYS 102  10.791  -6.525   8.469
  816    HA   LYS 102           HA       LYS 102   9.371  -7.039  10.948
  817    HB2  LYS 102           1HB      LYS 102   8.328  -6.736   8.128
  818    HB3  LYS 102           2HB      LYS 102   7.324  -6.868   9.562
  819    HG2  LYS 102           1HG      LYS 102   9.292  -4.656   9.003
  820    HG3  LYS 102           2HG      LYS 102   7.549  -4.574   8.751
  821    HD2  LYS 102           1HD      LYS 102   8.846  -5.102  11.436
  822    HD3  LYS 102           2HD      LYS 102   8.367  -3.508  10.868
  823    HE2  LYS 102           1HE      LYS 102   6.062  -4.282  10.645
  824    HE3  LYS 102           2HE      LYS 102   6.537  -5.871  11.225
  825    HZ1  LYS 102           3HZ      LYS 102   5.512  -4.416  12.858
  826    HZ2  LYS 102           1HZ      LYS 102   6.837  -3.381  12.832
  827    HZ3  LYS 102           2HZ      LYS 102   7.029  -4.973  13.363
  828    H    GLY 103           H        GLY 103  10.593  -8.772   8.333
  829    HA2  GLY 103           1HA      GLY 103  10.920 -11.151   8.603
  830    HA3  GLY 103           2HA      GLY 103   9.384 -11.210   9.455
  831    H    ILE 104           H        ILE 104   9.586  -9.317   6.572
  832    HA   ILE 104           HA       ILE 104   7.717 -11.082   5.288
  833    HB   ILE 104           HB       ILE 104   9.077  -8.568   4.268
  834   HG12  ILE 104          1HG1      ILE 104   7.630  -7.972   6.099
  835   HG13  ILE 104          2HG1      ILE 104   6.844  -7.521   4.584
  836   HG21  ILE 104          1HG2      ILE 104   6.757 -10.072   3.057
  837   HG22  ILE 104          2HG2      ILE 104   8.393  -9.970   2.407
  838   HG23  ILE 104          3HG2      ILE 104   7.388  -8.521   2.494
  839   HD11  ILE 104          3HD1      ILE 104   5.445  -9.520   4.721
  840   HD12  ILE 104          1HD1      ILE 104   5.241  -8.465   6.122
  841   HD13  ILE 104          2HD1      ILE 104   6.204  -9.931   6.259
  842    H    VAL 105           H        VAL 105   8.232 -12.645   3.956
  843    HA   VAL 105           HA       VAL 105  10.934 -13.287   3.576
  844    HB   VAL 105           HB       VAL 105   9.345 -15.082   3.878
  845   HG11  VAL 105          1HG1      VAL 105   7.360 -14.136   2.881
  846   HG12  VAL 105          2HG1      VAL 105   8.077 -14.270   1.273
  847   HG13  VAL 105          3HG1      VAL 105   7.693 -15.726   2.194
  848   HG21  VAL 105          3HG2      VAL 105  10.547 -15.173   1.110
  849   HG22  VAL 105          1HG2      VAL 105   9.967 -16.575   2.011
  850   HG23  VAL 105          2HG2      VAL 105  11.338 -15.645   2.615
  851    H    ILE 106           H        ILE 106  12.111 -11.992   2.426
  852    HA   ILE 106           HA       ILE 106  11.618 -11.955  -0.443
  853    HB   ILE 106           HB       ILE 106  12.534  -9.728  -0.684
  854   HG12  ILE 106          1HG1      ILE 106  13.208  -9.926   2.240
  855   HG13  ILE 106          2HG1      ILE 106  14.302  -9.841   0.906
  856   HG21  ILE 106          1HG2      ILE 106  10.596  -9.635   1.611
  857   HG22  ILE 106          2HG2      ILE 106  10.198  -9.683  -0.107
  858   HG23  ILE 106          3HG2      ILE 106  11.015  -8.273   0.568
  859   HD11  ILE 106          3HD1      ILE 106  14.231  -7.678   2.059
  860   HD12  ILE 106          1HD1      ILE 106  12.508  -7.559   1.696
  861   HD13  ILE 106          2HD1      ILE 106  13.689  -7.557   0.387
  862    HA   PRO 107           HA       PRO 107  15.619 -13.668  -0.071
  863    HB2  PRO 107           1HB      PRO 107  16.471 -13.702  -2.546
  864    HB3  PRO 107           2HB      PRO 107  14.923 -14.441  -2.034
  865    HG2  PRO 107           1HG      PRO 107  15.326 -11.808  -3.409
  866    HG3  PRO 107           2HG      PRO 107  14.191 -13.107  -3.823
  867    HD2  PRO 107           1HD      PRO 107  13.596 -10.909  -2.232
  868    HD3  PRO 107           2HD      PRO 107  12.689 -12.438  -2.247
  869    H    GLU 108           H        GLU 108  17.666 -13.205   0.354
  870    HA   GLU 108           HA       GLU 108  18.815 -10.777  -0.674
  871    HB2  GLU 108           1HB      GLU 108  19.891 -10.317   1.533
  872    HB3  GLU 108           2HB      GLU 108  18.148 -10.149   1.576
  873    HG2  GLU 108           1HG      GLU 108  17.960 -12.332   2.619
  874    HG3  GLU 108           2HG      GLU 108  19.721 -12.485   2.570
  Start of MODEL    2
    1    HA   TYR   1           HA       TYR   1 -18.835   0.615   1.828
    2    HD1  TYR   1           2HD      TYR   1 -19.057   2.545   0.732
    3    HD2  TYR   1           1HD      TYR   1 -21.202   0.074  -1.981
    4    HE1  TYR   1           2HE      TYR   1 -18.285   3.939  -1.136
    5    HE2  TYR   1           1HE      TYR   1 -20.426   1.461  -3.855
    6    HH   TYR   1           HH       TYR   1 -17.890   3.605  -3.608
    7    H1   TYR   1           1HT      TYR   1 -17.657  -1.192   1.035
    8    H2   TYR   1           2HT      TYR   1 -18.300  -0.446  -0.333
    9    H3   TYR   1           3HT      TYR   1 -18.993  -1.860   0.288
   10    HB2  TYR   1           1HB      TYR   1 -21.189  -0.503   0.273
   11    HB3  TYR   1           2HB      TYR   1 -21.242   0.913   1.325
   12    H    THR   2           H        THR   2 -18.033  -2.028   2.437
   13    HA   THR   2           HA       THR   2 -18.659  -2.469   4.854
   14    HB   THR   2           HB       THR   2 -21.061  -2.838   4.470
   15    HG1  THR   2           1HG      THR   2 -20.161  -5.454   4.860
   16   HG21  THR   2          3HG2      THR   2 -21.952  -4.705   3.103
   17   HG22  THR   2          1HG2      THR   2 -20.310  -5.057   2.558
   18   HG23  THR   2          2HG2      THR   2 -21.078  -3.527   2.125
   19    H    ASP   3           H        ASP   3 -16.475  -2.792   4.436
   20    HA   ASP   3           HA       ASP   3 -14.589  -4.104   4.466
   21    HB2  ASP   3           1HB      ASP   3 -16.439  -6.457   3.888
   22    HB3  ASP   3           2HB      ASP   3 -14.741  -6.588   4.287
   23    H    LYS   4           H        LYS   4 -15.760  -2.884   1.964
   24    HA   LYS   4           HA       LYS   4 -14.317  -4.387  -0.063
   25    HB2  LYS   4           1HB      LYS   4 -17.327  -4.165  -0.272
   26    HB3  LYS   4           2HB      LYS   4 -16.278  -4.668  -1.578
   27    HG2  LYS   4           1HG      LYS   4 -16.558  -6.129   1.034
   28    HG3  LYS   4           2HG      LYS   4 -17.482  -6.503  -0.416
   29    HD2  LYS   4           1HD      LYS   4 -15.420  -7.037  -1.602
   30    HD3  LYS   4           2HD      LYS   4 -14.474  -6.594  -0.178
   31    HE2  LYS   4           1HE      LYS   4 -14.795  -9.037  -0.387
   32    HE3  LYS   4           2HE      LYS   4 -15.475  -8.377   1.100
   33    HZ1  LYS   4           3HZ      LYS   4 -16.957  -9.970   0.023
   34    HZ2  LYS   4           1HZ      LYS   4 -17.047  -9.004  -1.353
   35    HZ3  LYS   4           2HZ      LYS   4 -17.658  -8.451   0.122
   36    H    TYR   5           H        TYR   5 -13.268  -2.672  -0.910
   37    HA   TYR   5           HA       TYR   5 -12.750  -0.757  -1.856
   38    HD1  TYR   5           1HD      TYR   5 -16.530   0.668  -3.510
   39    HD2  TYR   5           2HD      TYR   5 -15.253  -3.369  -3.890
   40    HE1  TYR   5           1HE      TYR   5 -18.819   0.001  -4.076
   41    HE2  TYR   5           2HE      TYR   5 -17.552  -4.045  -4.455
   42    HH   TYR   5           HH       TYR   5 -19.955  -1.757  -5.231
   43    HB2  TYR   5           1HB      TYR   5 -14.245   0.169  -3.674
   44    HB3  TYR   5           2HB      TYR   5 -13.607  -1.403  -3.973
   45    H    ASP   6           H        ASP   6 -14.196  -0.551   0.551
   46    HA   ASP   6           HA       ASP   6 -15.308   2.118   0.218
   47    HB2  ASP   6           1HB      ASP   6 -16.164   1.690   2.615
   48    HB3  ASP   6           2HB      ASP   6 -16.938   0.888   1.253
   49    H    LYS   7           H        LYS   7 -13.643   0.536   2.759
   50    HA   LYS   7           HA       LYS   7 -11.941   2.820   3.383
   51    HB2  LYS   7           1HB      LYS   7 -13.985   3.802   4.103
   52    HB3  LYS   7           2HB      LYS   7 -14.553   2.304   4.803
   53    HG2  LYS   7           1HG      LYS   7 -12.730   2.590   6.551
   54    HG3  LYS   7           2HG      LYS   7 -12.512   4.223   5.908
   55    HD2  LYS   7           1HD      LYS   7 -14.754   4.832   6.424
   56    HD3  LYS   7           2HD      LYS   7 -15.203   3.165   6.766
   57    HE2  LYS   7           1HE      LYS   7 -14.997   4.393   8.836
   58    HE3  LYS   7           2HE      LYS   7 -13.710   3.198   8.734
   59    HZ1  LYS   7           3HZ      LYS   7 -12.209   4.971   8.041
   60    HZ2  LYS   7           1HZ      LYS   7 -12.898   5.321   9.538
   61    HZ3  LYS   7           2HZ      LYS   7 -13.464   6.084   8.139
   62    H    ILE   8           H        ILE   8 -13.827   0.395   5.155
   63    HA   ILE   8           HA       ILE   8 -11.614  -0.445   6.854
   64    HB   ILE   8           HB       ILE   8 -13.386  -1.856   7.922
   65   HG12  ILE   8          1HG1      ILE   8 -15.278  -0.500   5.977
   66   HG13  ILE   8          2HG1      ILE   8 -14.751  -2.167   5.813
   67   HG21  ILE   8          1HG2      ILE   8 -14.691   0.009   8.845
   68   HG22  ILE   8          2HG2      ILE   8 -14.100   1.050   7.552
   69   HG23  ILE   8          3HG2      ILE   8 -12.972   0.397   8.742
   70   HD11  ILE   8          3HD1      ILE   8 -15.816  -2.680   7.951
   71   HD12  ILE   8          1HD1      ILE   8 -16.952  -2.002   6.785
   72   HD13  ILE   8          2HD1      ILE   8 -16.322  -0.997   8.092
   73    H    ASN   9           H        ASN   9 -11.084  -1.003   4.390
   74    HA   ASN   9           HA       ASN   9 -11.674  -3.851   3.931
   75    HB2  ASN   9           1HB      ASN   9 -12.287  -3.427   1.692
   76    HB3  ASN   9           2HB      ASN   9 -13.072  -2.161   2.622
   77   HD21  ASN   9          1HD2      ASN   9 -10.763  -0.363   2.924
   78   HD22  ASN   9          2HD2      ASN   9 -10.165  -0.054   1.366
   79    H    LEU  10           H        LEU  10  -9.038  -2.202   4.783
   80    HA   LEU  10           HA       LEU  10  -7.470  -1.801   2.456
   81    HG   LEU  10           HG       LEU  10  -5.869   0.274   5.132
   82    HB2  LEU  10           1HB      LEU  10  -6.310  -2.211   5.259
   83    HB3  LEU  10           2HB      LEU  10  -5.502  -1.618   3.860
   84   HD11  LEU  10          1HD1      LEU  10  -7.254   1.674   3.834
   85   HD12  LEU  10          2HD1      LEU  10  -7.969   0.264   3.054
   86   HD13  LEU  10          3HD1      LEU  10  -6.247   0.608   2.854
   87   HD21  LEU  10          3HD2      LEU  10  -7.616  -0.723   6.635
   88   HD22  LEU  10          1HD2      LEU  10  -8.821  -0.315   5.407
   89   HD23  LEU  10          2HD2      LEU  10  -7.875   0.966   6.187
   90    H    GLN  11           H        GLN  11  -7.131  -4.250   4.906
   91    HA   GLN  11           HA       GLN  11  -5.419  -5.790   3.229
   92    HB2  GLN  11           1HB      GLN  11  -5.178  -5.713   5.708
   93    HB3  GLN  11           2HB      GLN  11  -6.705  -6.571   5.840
   94    HG2  GLN  11           1HG      GLN  11  -4.823  -8.099   6.103
   95    HG3  GLN  11           2HG      GLN  11  -5.763  -8.482   4.663
   96   HE21  GLN  11          1HE2      GLN  11  -3.487  -5.840   4.884
   97   HE22  GLN  11          2HE2      GLN  11  -2.308  -6.472   3.828
   98    H    GLU  12           H        GLU  12  -8.808  -5.466   3.671
   99    HA   GLU  12           HA       GLU  12  -9.565  -8.212   3.236
  100    HB2  GLU  12           1HB      GLU  12 -11.094  -5.607   3.084
  101    HB3  GLU  12           2HB      GLU  12 -11.840  -7.158   2.785
  102    HG2  GLU  12           1HG      GLU  12 -12.306  -6.300   5.050
  103    HG3  GLU  12           2HG      GLU  12 -11.477  -7.848   5.066
  104    H    ILE  13           H        ILE  13  -8.965  -5.408   1.449
  105    HA   ILE  13           HA       ILE  13  -9.752  -6.453  -1.090
  106    HB   ILE  13           HB       ILE  13  -8.461  -3.936  -0.131
  107   HG12  ILE  13          1HG1      ILE  13 -10.841  -4.104   0.220
  108   HG13  ILE  13          2HG1      ILE  13 -10.474  -2.891  -0.998
  109   HG21  ILE  13          1HG2      ILE  13  -8.480  -3.106  -2.394
  110   HG22  ILE  13          2HG2      ILE  13  -9.036  -4.685  -2.951
  111   HG23  ILE  13          3HG2      ILE  13  -7.436  -4.523  -2.230
  112   HD11  ILE  13          3HD1      ILE  13 -12.355  -4.059  -1.780
  113   HD12  ILE  13          1HD1      ILE  13 -11.601  -5.627  -1.397
  114   HD13  ILE  13          2HD1      ILE  13 -10.932  -4.625  -2.679
  115    H    LEU  14           H        LEU  14  -6.671  -5.324   0.410
  116    HA   LEU  14           HA       LEU  14  -4.982  -5.785  -1.615
  117    HG   LEU  14           HG       LEU  14  -2.485  -6.901   0.136
  118    HB2  LEU  14           1HB      LEU  14  -4.416  -4.600   0.408
  119    HB3  LEU  14           2HB      LEU  14  -4.452  -6.093   1.316
  120   HD11  LEU  14          1HD1      LEU  14  -2.894  -5.810  -2.022
  121   HD12  LEU  14          2HD1      LEU  14  -1.282  -5.463  -1.426
  122   HD13  LEU  14          3HD1      LEU  14  -2.552  -4.241  -1.296
  123   HD21  LEU  14          3HD2      LEU  14  -0.887  -5.408   1.107
  124   HD22  LEU  14          1HD2      LEU  14  -2.282  -5.477   2.161
  125   HD23  LEU  14          2HD2      LEU  14  -2.051  -4.084   1.113
  126    H    GLU  15           H        GLU  15  -6.227  -8.264   0.501
  127    HA   GLU  15           HA       GLU  15  -4.243 -10.160  -0.196
  128    HB2  GLU  15           1HB      GLU  15  -5.521 -10.202   1.923
  129    HB3  GLU  15           2HB      GLU  15  -6.957 -10.694   1.031
  130    HG2  GLU  15           1HG      GLU  15  -5.848 -12.757   0.380
  131    HG3  GLU  15           2HG      GLU  15  -4.378 -12.245   1.207
  132    H    ASN  16           H        ASN  16  -6.743  -8.965  -2.089
  133    HA   ASN  16           HA       ASN  16  -6.548 -11.277  -3.917
  134    HB2  ASN  16           1HB      ASN  16  -9.158  -9.855  -3.306
  135    HB3  ASN  16           2HB      ASN  16  -8.937 -11.173  -4.440
  136   HD21  ASN  16          1HD2      ASN  16  -9.313 -10.246  -1.168
  137   HD22  ASN  16          2HD2      ASN  16  -9.497 -11.825  -0.504
  138    H    LYS  17           H        LYS  17  -5.847 -10.454  -5.862
  139    HA   LYS  17           HA       LYS  17  -5.755  -7.665  -6.197
  140    HB2  LYS  17           1HB      LYS  17  -4.883  -7.952  -8.487
  141    HB3  LYS  17           2HB      LYS  17  -3.988  -8.847  -7.283
  142    HG2  LYS  17           1HG      LYS  17  -6.094 -10.139  -8.971
  143    HG3  LYS  17           2HG      LYS  17  -4.452  -9.916  -9.559
  144    HD2  LYS  17           1HD      LYS  17  -3.617 -11.100  -7.518
  145    HD3  LYS  17           2HD      LYS  17  -5.289 -11.469  -7.117
  146    HE2  LYS  17           1HE      LYS  17  -5.570 -12.765  -9.076
  147    HE3  LYS  17           2HE      LYS  17  -4.017 -12.245  -9.726
  148    HZ1  LYS  17           3HZ      LYS  17  -4.436 -13.961  -7.328
  149    HZ2  LYS  17           1HZ      LYS  17  -2.941 -13.381  -7.869
  150    HZ3  LYS  17           2HZ      LYS  17  -3.839 -14.439  -8.824
  151    H    ARG  18           H        ARG  18  -8.214  -9.851  -7.248
  152    HA   ARG  18           HA       ARG  18  -9.320  -7.920  -9.055
  153    HE   ARG  18           HE       ARG  18 -11.150 -12.881  -6.337
  154    HB2  ARG  18           1HB      ARG  18 -11.385  -9.300  -9.086
  155    HB3  ARG  18           2HB      ARG  18  -9.935 -10.256  -9.344
  156    HG2  ARG  18           1HG      ARG  18 -10.047 -10.959  -6.953
  157    HG3  ARG  18           2HG      ARG  18 -11.557 -10.075  -6.827
  158    HD2  ARG  18           1HD      ARG  18 -12.636 -11.484  -8.403
  159    HD3  ARG  18           2HD      ARG  18 -11.111 -12.255  -8.848
  160   HH11  ARG  18          1HH1      ARG  18 -13.870 -13.051  -8.612
  161   HH12  ARG  18          2HH1      ARG  18 -14.668 -14.291  -7.754
  162   HH21  ARG  18          1HH2      ARG  18 -12.239 -14.546  -5.210
  163   HH22  ARG  18          2HH2      ARG  18 -13.733 -15.157  -5.749
  164    H    LEU  19           H        LEU  19  -9.681  -8.561  -5.666
  165    HA   LEU  19           HA       LEU  19 -11.712  -6.592  -5.342
  166    HG   LEU  19           HG       LEU  19 -11.526  -9.538  -4.133
  167    HB2  LEU  19           1HB      LEU  19  -9.918  -7.917  -3.311
  168    HB3  LEU  19           2HB      LEU  19 -11.201  -6.798  -2.915
  169   HD11  LEU  19          1HD1      LEU  19 -11.057  -9.554  -1.751
  170   HD12  LEU  19          2HD1      LEU  19 -12.730 -10.017  -2.053
  171   HD13  LEU  19          3HD1      LEU  19 -12.354  -8.399  -1.468
  172   HD21  LEU  19          3HD2      LEU  19 -13.953  -9.125  -3.957
  173   HD22  LEU  19          1HD2      LEU  19 -13.182  -8.037  -5.111
  174   HD23  LEU  19          2HD2      LEU  19 -13.629  -7.457  -3.506
  175    H    LEU  20           H        LEU  20  -8.274  -6.717  -5.425
  176    HA   LEU  20           HA       LEU  20  -7.657  -4.203  -4.317
  177    HG   LEU  20           HG       LEU  20  -5.301  -3.311  -5.731
  178    HB2  LEU  20           1HB      LEU  20  -6.090  -6.112  -4.972
  179    HB3  LEU  20           2HB      LEU  20  -6.200  -5.489  -6.613
  180   HD11  LEU  20          1HD1      LEU  20  -4.733  -5.031  -3.357
  181   HD12  LEU  20          2HD1      LEU  20  -5.973  -3.782  -3.384
  182   HD13  LEU  20          3HD1      LEU  20  -4.255  -3.340  -3.539
  183   HD21  LEU  20          3HD2      LEU  20  -3.018  -4.136  -5.560
  184   HD22  LEU  20          1HD2      LEU  20  -3.893  -4.941  -6.875
  185   HD23  LEU  20          2HD2      LEU  20  -3.646  -5.772  -5.330
  186    H    GLU  21           H        GLU  21  -8.327  -5.288  -7.548
  187    HA   GLU  21           HA       GLU  21  -8.356  -2.926  -8.926
  188    HB2  GLU  21           1HB      GLU  21  -9.874  -5.478  -9.187
  189    HB3  GLU  21           2HB      GLU  21 -10.144  -4.160 -10.314
  190    HG2  GLU  21           1HG      GLU  21  -7.483  -5.399  -9.731
  191    HG3  GLU  21           2HG      GLU  21  -8.475  -5.839 -11.116
  192    H    SER  22           H        SER  22 -10.809  -4.253  -6.805
  193    HA   SER  22           HA       SER  22 -12.811  -2.373  -7.414
  194    HG   SER  22           HG       SER  22 -12.932  -4.736  -7.234
  195    HB2  SER  22           1HB      SER  22 -12.412  -3.792  -4.774
  196    HB3  SER  22           2HB      SER  22 -13.913  -3.099  -5.400
  197    H    TYR  23           H        TYR  23 -10.444  -2.250  -4.575
  198    HA   TYR  23           HA       TYR  23 -11.358   0.509  -4.267
  199    HD1  TYR  23           1HD      TYR  23  -7.965  -1.215  -3.890
  200    HD2  TYR  23           2HD      TYR  23  -9.314  -0.041  -0.051
  201    HE1  TYR  23           1HE      TYR  23  -5.741  -1.699  -2.953
  202    HE2  TYR  23           2HE      TYR  23  -7.134  -0.491   0.912
  203    HH   TYR  23           HH       TYR  23  -4.396  -1.076  -1.058
  204    HB2  TYR  23           1HB      TYR  23 -10.372   0.751  -2.163
  205    HB3  TYR  23           2HB      TYR  23 -10.924  -0.862  -1.991
  206    H    MET  24           H        MET  24  -9.512  -0.699  -6.311
  207    HA   MET  24           HA       MET  24  -7.140   0.741  -6.315
  208    HB2  MET  24           1HB      MET  24  -7.865  -1.195  -7.831
  209    HB3  MET  24           2HB      MET  24  -8.636   0.023  -8.833
  210    HG2  MET  24           1HG      MET  24  -6.404  -0.632  -9.644
  211    HG3  MET  24           2HG      MET  24  -6.508   1.084  -9.242
  212    HE1  MET  24           3HE      MET  24  -3.755   0.852  -9.438
  213    HE2  MET  24           1HE      MET  24  -2.804  -0.163  -8.352
  214    HE3  MET  24           2HE      MET  24  -3.840  -0.903  -9.573
  215    H    ASP  25           H        ASP  25 -10.334   1.731  -6.838
  216    HA   ASP  25           HA       ASP  25 -10.140   4.153  -8.234
  217    HB2  ASP  25           1HB      ASP  25 -12.266   3.445  -7.574
  218    HB3  ASP  25           2HB      ASP  25 -11.797   3.374  -5.878
  219    H    CYS  26           H        CYS  26  -9.784   3.585  -4.789
  220    HA   CYS  26           HA       CYS  26  -9.084   6.289  -4.522
  221    HB2  CYS  26           1HB      CYS  26  -8.775   5.488  -2.047
  222    HB3  CYS  26           2HB      CYS  26 -10.381   5.715  -2.749
  223    H    VAL  27           H        VAL  27  -7.324   3.334  -4.796
  224    HA   VAL  27           HA       VAL  27  -4.900   4.613  -3.914
  225    HB   VAL  27           HB       VAL  27  -5.244   2.003  -5.420
  226   HG11  VAL  27          1HG1      VAL  27  -2.992   2.888  -5.679
  227   HG12  VAL  27          2HG1      VAL  27  -2.848   3.085  -3.933
  228   HG13  VAL  27          3HG1      VAL  27  -2.977   1.469  -4.634
  229   HG21  VAL  27          3HG2      VAL  27  -6.361   1.973  -3.256
  230   HG22  VAL  27          1HG2      VAL  27  -4.884   2.530  -2.469
  231   HG23  VAL  27          2HG2      VAL  27  -4.933   0.940  -3.228
  232    H    LEU  28           H        LEU  28  -6.023   3.489  -7.198
  233    HA   LEU  28           HA       LEU  28  -4.003   5.280  -8.342
  234    HG   LEU  28           HG       LEU  28  -4.639   4.534 -11.318
  235    HB2  LEU  28           1HB      LEU  28  -3.839   2.910  -8.906
  236    HB3  LEU  28           2HB      LEU  28  -5.452   2.958  -9.586
  237   HD11  LEU  28          1HD1      LEU  28  -1.938   3.976 -10.104
  238   HD12  LEU  28          2HD1      LEU  28  -2.788   5.523 -10.102
  239   HD13  LEU  28          3HD1      LEU  28  -2.232   4.825 -11.624
  240   HD21  LEU  28          3HD2      LEU  28  -3.403   2.881 -12.602
  241   HD22  LEU  28          1HD2      LEU  28  -4.743   2.124 -11.740
  242   HD23  LEU  28          2HD2      LEU  28  -3.086   1.955 -11.139
  243    H    GLY  29           H        GLY  29  -7.409   4.548  -8.372
  244    HA2  GLY  29           1HA      GLY  29  -8.936   6.430  -8.776
  245    HA3  GLY  29           2HA      GLY  29  -7.883   6.914 -10.097
  246    H    LYS  30           H        LYS  30  -9.052   3.628  -9.371
  247    HA   LYS  30           HA       LYS  30 -10.215   3.624 -12.057
  248    HB2  LYS  30           1HB      LYS  30  -9.477   1.261 -10.354
  249    HB3  LYS  30           2HB      LYS  30 -10.094   1.197 -12.001
  250    HG2  LYS  30           1HG      LYS  30  -8.057   2.525 -12.697
  251    HG3  LYS  30           2HG      LYS  30  -7.458   2.299 -11.050
  252    HD2  LYS  30           1HD      LYS  30  -6.460   0.614 -12.471
  253    HD3  LYS  30           2HD      LYS  30  -7.615  -0.167 -11.390
  254    HE2  LYS  30           1HE      LYS  30  -9.285  -0.177 -13.221
  255    HE3  LYS  30           2HE      LYS  30  -8.097   0.581 -14.276
  256    HZ1  LYS  30           3HZ      LYS  30  -6.689  -1.387 -13.987
  257    HZ2  LYS  30           1HZ      LYS  30  -8.186  -1.763 -14.660
  258    HZ3  LYS  30           2HZ      LYS  30  -7.876  -2.121 -13.043
  259    H    GLY  31           H        GLY  31 -11.167   1.815  -9.066
  260    HA2  GLY  31           1HA      GLY  31 -13.849   1.441 -10.058
  261    HA3  GLY  31           2HA      GLY  31 -13.227   0.880  -8.524
  262    H    LYS  32           H        LYS  32 -14.288   1.723  -6.766
  263    HA   LYS  32           HA       LYS  32 -14.854   4.517  -6.630
  264    HB2  LYS  32           1HB      LYS  32 -17.322   4.258  -6.272
  265    HB3  LYS  32           2HB      LYS  32 -16.755   4.048  -7.923
  266    HG2  LYS  32           1HG      LYS  32 -16.891   1.614  -7.653
  267    HG3  LYS  32           2HG      LYS  32 -17.486   1.841  -6.007
  268    HD2  LYS  32           1HD      LYS  32 -18.779   2.992  -8.426
  269    HD3  LYS  32           2HD      LYS  32 -19.251   1.416  -7.758
  270    HE2  LYS  32           1HE      LYS  32 -19.777   2.591  -5.620
  271    HE3  LYS  32           2HE      LYS  32 -19.396   4.119  -6.399
  272    HZ1  LYS  32           3HZ      LYS  32 -21.213   3.734  -7.954
  273    HZ2  LYS  32           1HZ      LYS  32 -21.765   3.704  -6.356
  274    HZ3  LYS  32           2HZ      LYS  32 -21.570   2.270  -7.211
  275    H    CYS  33           H        CYS  33 -13.754   4.609  -4.796
  276    HA   CYS  33           HA       CYS  33 -14.818   3.264  -2.378
  277    HB2  CYS  33           1HB      CYS  33 -12.407   5.107  -2.320
  278    HB3  CYS  33           2HB      CYS  33 -12.783   3.745  -1.258
  279    H    THR  34           H        THR  34 -14.717   4.917  -0.340
  280    HA   THR  34           HA       THR  34 -16.343   7.165  -1.014
  281    HB   THR  34           HB       THR  34 -16.276   7.381   1.515
  282    HG1  THR  34           1HG      THR  34 -15.478   5.522   2.583
  283   HG21  THR  34          3HG2      THR  34 -17.153   4.707   0.411
  284   HG22  THR  34          1HG2      THR  34 -18.102   6.195   0.347
  285   HG23  THR  34          2HG2      THR  34 -17.728   5.460   1.900
  286    HA   PRO  35           HA       PRO  35 -13.146  10.317  -0.853
  287    HB2  PRO  35           1HB      PRO  35 -14.195  12.042   1.081
  288    HB3  PRO  35           2HB      PRO  35 -14.552  12.083  -0.647
  289    HG2  PRO  35           1HG      PRO  35 -16.116  10.872   1.581
  290    HG3  PRO  35           2HG      PRO  35 -16.696  11.708   0.131
  291    HD2  PRO  35           1HD      PRO  35 -16.806   9.045   0.346
  292    HD3  PRO  35           2HD      PRO  35 -16.430   9.821  -1.204
  293    H    GLU  36           H        GLU  36 -14.316   9.244   2.339
  294    HA   GLU  36           HA       GLU  36 -11.928  10.004   3.673
  295    HB2  GLU  36           1HB      GLU  36 -14.066   9.666   4.871
  296    HB3  GLU  36           2HB      GLU  36 -13.995   7.951   4.493
  297    HG2  GLU  36           1HG      GLU  36 -12.035   7.689   5.848
  298    HG3  GLU  36           2HG      GLU  36 -11.959   9.426   6.127
  299    H    GLY  37           H        GLY  37 -13.072   7.072   2.114
  300    HA2  GLY  37           1HA      GLY  37 -10.927   5.378   2.790
  301    HA3  GLY  37           2HA      GLY  37 -11.953   5.212   1.368
  302    H    LYS  38           H        LYS  38 -11.441   7.619   0.191
  303    HA   LYS  38           HA       LYS  38  -9.148   7.364  -1.387
  304    HB2  LYS  38           1HB      LYS  38 -10.707   9.819  -0.593
  305    HB3  LYS  38           2HB      LYS  38  -9.347   9.907  -1.691
  306    HG2  LYS  38           1HG      LYS  38 -11.681   8.113  -2.242
  307    HG3  LYS  38           2HG      LYS  38 -11.724   9.823  -2.657
  308    HD2  LYS  38           1HD      LYS  38  -9.703   9.539  -4.019
  309    HD3  LYS  38           2HD      LYS  38  -9.666   7.830  -3.587
  310    HE2  LYS  38           1HE      LYS  38 -11.827   7.498  -4.686
  311    HE3  LYS  38           2HE      LYS  38 -11.909   9.219  -5.056
  312    HZ1  LYS  38           3HZ      LYS  38  -9.733   7.474  -6.077
  313    HZ2  LYS  38           1HZ      LYS  38 -10.141   9.002  -6.606
  314    HZ3  LYS  38           2HZ      LYS  38 -11.157   7.670  -6.908
  315    H    GLU  39           H        GLU  39  -9.563   9.161   1.626
  316    HA   GLU  39           HA       GLU  39  -7.004  10.458   1.525
  317    HB2  GLU  39           1HB      GLU  39  -9.034  11.353   2.675
  318    HB3  GLU  39           2HB      GLU  39  -8.914  10.028   3.820
  319    HG2  GLU  39           1HG      GLU  39  -8.003  11.895   4.896
  320    HG3  GLU  39           2HG      GLU  39  -6.645  10.887   4.399
  321    H    LEU  40           H        LEU  40  -8.522   7.974   3.434
  322    HA   LEU  40           HA       LEU  40  -6.601   7.121   5.164
  323    HG   LEU  40           HG       LEU  40  -7.207   4.183   4.060
  324    HB2  LEU  40           1HB      LEU  40  -8.713   6.266   5.438
  325    HB3  LEU  40           2HB      LEU  40  -8.889   5.875   3.742
  326   HD11  LEU  40          1HD1      LEU  40  -6.951   3.179   6.357
  327   HD12  LEU  40          2HD1      LEU  40  -7.766   4.601   7.011
  328   HD13  LEU  40          3HD1      LEU  40  -6.217   4.772   6.182
  329   HD21  LEU  40          3HD2      LEU  40  -9.882   3.835   5.397
  330   HD22  LEU  40          1HD2      LEU  40  -8.808   2.491   4.989
  331   HD23  LEU  40          2HD2      LEU  40  -9.415   3.508   3.718
  332    H    LYS  41           H        LYS  41  -7.236   5.724   1.937
  333    HA   LYS  41           HA       LYS  41  -5.129   3.831   2.237
  334    HB2  LYS  41           1HB      LYS  41  -6.811   4.530  -0.136
  335    HB3  LYS  41           2HB      LYS  41  -5.823   3.077   0.046
  336    HG2  LYS  41           1HG      LYS  41  -7.132   2.220   1.714
  337    HG3  LYS  41           2HG      LYS  41  -7.926   3.735   2.084
  338    HD2  LYS  41           1HD      LYS  41  -8.763   3.552  -0.351
  339    HD3  LYS  41           2HD      LYS  41  -8.285   1.864  -0.191
  340    HE2  LYS  41           1HE      LYS  41  -9.758   1.650   1.760
  341    HE3  LYS  41           2HE      LYS  41 -10.221   3.339   1.581
  342    HZ1  LYS  41           3HZ      LYS  41 -10.935   1.081  -0.236
  343    HZ2  LYS  41           1HZ      LYS  41 -10.948   2.696  -0.742
  344    HZ3  LYS  41           2HZ      LYS  41 -11.914   2.240   0.526
  345    H    ASP  42           H        ASP  42  -5.471   6.932   0.727
  346    HA   ASP  42           HA       ASP  42  -3.222   6.873  -0.920
  347    HB2  ASP  42           1HB      ASP  42  -4.777   8.697  -1.071
  348    HB3  ASP  42           2HB      ASP  42  -4.509   9.149   0.606
  349    H    HIS  43           H        HIS  43  -3.604   7.761   2.458
  350    HA   HIS  43           HA       HIS  43  -0.775   8.268   2.784
  351    HD1  HIS  43           1HD      HIS  43  -1.116  11.087   5.506
  352    HD2  HIS  43           2HD      HIS  43  -3.830  10.081   2.535
  353    HE1  HIS  43           1HE      HIS  43  -1.981  13.259   4.612
  354    HE2  HIS  43           2HE      HIS  43  -3.962  12.487   3.204
  355    HB2  HIS  43           1HB      HIS  43  -2.979   8.214   4.853
  356    HB3  HIS  43           2HB      HIS  43  -1.306   8.611   5.205
  357    H    LEU  44           H        LEU  44  -2.978   5.665   3.689
  358    HA   LEU  44           HA       LEU  44  -1.094   4.319   5.322
  359    HG   LEU  44           HG       LEU  44  -2.078   2.134   6.320
  360    HB2  LEU  44           1HB      LEU  44  -3.568   4.115   5.502
  361    HB3  LEU  44           2HB      LEU  44  -3.596   3.265   3.982
  362   HD11  LEU  44          1HD1      LEU  44  -4.275   2.624   7.183
  363   HD12  LEU  44          2HD1      LEU  44  -4.173   0.887   6.864
  364   HD13  LEU  44          3HD1      LEU  44  -5.025   1.953   5.743
  365   HD21  LEU  44          3HD2      LEU  44  -2.629   0.015   5.239
  366   HD22  LEU  44          1HD2      LEU  44  -1.804   1.087   4.109
  367   HD23  LEU  44          2HD2      LEU  44  -3.547   0.867   3.997
  368    H    GLN  45           H        GLN  45  -2.188   3.669   1.968
  369    HA   GLN  45           HA       GLN  45  -0.186   1.734   1.658
  370    HB2  GLN  45           1HB      GLN  45  -2.153   2.968  -0.202
  371    HB3  GLN  45           2HB      GLN  45  -0.715   2.271  -0.932
  372    HG2  GLN  45           1HG      GLN  45  -2.554   0.655  -0.937
  373    HG3  GLN  45           2HG      GLN  45  -1.233   0.094   0.065
  374   HE21  GLN  45          1HE2      GLN  45  -2.623  -1.384   1.125
  375   HE22  GLN  45          2HE2      GLN  45  -3.781  -0.913   2.288
  376    H    GLU  46           H        GLU  46  -0.110   5.201   1.354
  377    HA   GLU  46           HA       GLU  46   2.437   5.255   0.082
  378    HB2  GLU  46           1HB      GLU  46   1.033   7.273   0.183
  379    HB3  GLU  46           2HB      GLU  46   1.167   7.287   1.931
  380    HG2  GLU  46           1HG      GLU  46   2.628   8.953   0.992
  381    HG3  GLU  46           2HG      GLU  46   3.573   7.679   1.734
  382    H    ALA  47           H        ALA  47   1.398   4.878   3.437
  383    HA   ALA  47           HA       ALA  47   3.902   5.191   4.679
  384    HB1  ALA  47           3HB      ALA  47   1.783   5.064   5.944
  385    HB2  ALA  47           1HB      ALA  47   1.656   3.349   5.511
  386    HB3  ALA  47           2HB      ALA  47   2.980   3.902   6.538
  387    H    LEU  48           H        LEU  48   2.456   2.561   3.007
  388    HA   LEU  48           HA       LEU  48   4.378   0.534   3.374
  389    HG   LEU  48           HG       LEU  48   4.340   0.152  -0.022
  390    HB2  LEU  48           1HB      LEU  48   2.425  -0.094   2.289
  391    HB3  LEU  48           2HB      LEU  48   2.474   1.264   1.194
  392   HD11  LEU  48          1HD1      LEU  48   4.656  -2.267   0.328
  393   HD12  LEU  48          2HD1      LEU  48   3.711  -2.118   1.825
  394   HD13  LEU  48          3HD1      LEU  48   5.245  -1.258   1.649
  395   HD21  LEU  48          3HD2      LEU  48   2.946  -1.461  -1.134
  396   HD22  LEU  48          1HD2      LEU  48   2.047   0.011  -0.773
  397   HD23  LEU  48          2HD2      LEU  48   1.810  -1.430   0.221
  398    H    GLU  49           H        GLU  49   4.441   3.394   1.280
  399    HA   GLU  49           HA       GLU  49   7.040   2.521   0.384
  400    HB2  GLU  49           1HB      GLU  49   5.691   2.763  -1.562
  401    HB3  GLU  49           2HB      GLU  49   5.050   4.301  -1.024
  402    HG2  GLU  49           1HG      GLU  49   6.634   4.485  -2.921
  403    HG3  GLU  49           2HG      GLU  49   7.123   5.410  -1.513
  404    H    THR  50           H        THR  50   5.965   5.954   0.396
  405    HA   THR  50           HA       THR  50   8.273   6.334   2.185
  406    HB   THR  50           HB       THR  50   7.800   8.131  -0.233
  407    HG1  THR  50           1HG      THR  50   8.639   5.620  -0.266
  408   HG21  THR  50          3HG2      THR  50   9.169   9.057   1.608
  409   HG22  THR  50          1HG2      THR  50  10.138   8.771   0.161
  410   HG23  THR  50          2HG2      THR  50  10.228   7.649   1.516
  411    H    GLY  51           H        GLY  51   5.420   6.378   2.617
  412    HA2  GLY  51           1HA      GLY  51   4.793   9.146   3.191
  413    HA3  GLY  51           2HA      GLY  51   3.802   7.742   3.595
  414    H    CYS  52           H        CYS  52   3.598   7.370   5.566
  415    HA   CYS  52           HA       CYS  52   5.872   7.697   7.269
  416    HB2  CYS  52           1HB      CYS  52   4.827   9.883   7.369
  417    HB3  CYS  52           2HB      CYS  52   3.290   9.152   7.809
  418    H    GLU  53           H        GLU  53   5.962   5.653   7.878
  419    HA   GLU  53           HA       GLU  53   3.769   4.006   8.577
  420    HB2  GLU  53           1HB      GLU  53   5.927   3.064   7.922
  421    HB3  GLU  53           2HB      GLU  53   6.702   3.827   9.302
  422    HG2  GLU  53           1HG      GLU  53   5.241   2.461  10.787
  423    HG3  GLU  53           2HG      GLU  53   4.670   1.613   9.354
  424    H    LYS  54           H        LYS  54   6.294   5.483  10.511
  425    HA   LYS  54           HA       LYS  54   5.248   4.778  13.039
  426    HB2  LYS  54           1HB      LYS  54   7.106   6.313  13.880
  427    HB3  LYS  54           2HB      LYS  54   7.558   4.902  12.944
  428    HG2  LYS  54           1HG      LYS  54   8.932   6.730  12.244
  429    HG3  LYS  54           2HG      LYS  54   7.812   6.378  10.939
  430    HD2  LYS  54           1HD      LYS  54   7.901   8.747  11.098
  431    HD3  LYS  54           2HD      LYS  54   6.388   8.280  11.862
  432    HE2  LYS  54           1HE      LYS  54   7.540   9.997  13.164
  433    HE3  LYS  54           2HE      LYS  54   7.430   8.488  14.068
  434    HZ1  LYS  54           3HZ      LYS  54   9.624   9.558  14.207
  435    HZ2  LYS  54           1HZ      LYS  54   9.840   9.378  12.558
  436    HZ3  LYS  54           2HZ      LYS  54   9.721   8.022  13.559
  437    H    CYS  55           H        CYS  55   3.601   6.603  11.398
  438    HA   CYS  55           HA       CYS  55   3.423   9.005  12.943
  439    HB2  CYS  55           1HB      CYS  55   2.245   7.944  10.530
  440    HB3  CYS  55           2HB      CYS  55   1.194   9.030  11.397
  441    H    THR  56           H        THR  56   0.478   7.377  12.048
  442    HA   THR  56           HA       THR  56  -0.402   7.589  14.816
  443    HB   THR  56           HB       THR  56  -2.022   6.922  12.335
  444    HG1  THR  56           1HG      THR  56  -1.187   9.425  13.369
  445   HG21  THR  56          3HG2      THR  56  -2.791   8.258  14.943
  446   HG22  THR  56          1HG2      THR  56  -3.115   6.577  14.524
  447   HG23  THR  56          2HG2      THR  56  -3.885   7.879  13.615
  448    H    GLU  57           H        GLU  57  -1.373   5.562  15.733
  449    HA   GLU  57           HA       GLU  57   0.069   3.297  14.973
  450    HB2  GLU  57           1HB      GLU  57  -1.391   2.016  16.528
  451    HB3  GLU  57           2HB      GLU  57  -0.695   3.458  17.243
  452    HG2  GLU  57           1HG      GLU  57  -2.818   4.619  16.966
  453    HG3  GLU  57           2HG      GLU  57  -3.501   3.169  16.224
  454    H    ALA  58           H        ALA  58  -3.117   4.380  13.996
  455    HA   ALA  58           HA       ALA  58  -3.903   2.106  12.554
  456    HB1  ALA  58           3HB      ALA  58  -4.448   5.008  11.926
  457    HB2  ALA  58           1HB      ALA  58  -5.296   3.638  11.213
  458    HB3  ALA  58           2HB      ALA  58  -5.443   3.964  12.938
  459    H    GLN  59           H        GLN  59  -1.670   4.690  11.769
  460    HA   GLN  59           HA       GLN  59  -1.415   3.882   9.015
  461    HB2  GLN  59           1HB      GLN  59   0.281   5.807  10.621
  462    HB3  GLN  59           2HB      GLN  59   0.467   5.498   8.903
  463    HG2  GLN  59           1HG      GLN  59  -1.828   6.336   8.550
  464    HG3  GLN  59           2HG      GLN  59  -1.916   6.737  10.261
  465   HE21  GLN  59          1HE2      GLN  59   0.984   7.132   8.255
  466   HE22  GLN  59          2HE2      GLN  59   0.968   8.841   8.297
  467    H    GLU  60           H        GLU  60   0.608   3.765  11.916
  468    HA   GLU  60           HA       GLU  60   2.720   2.303  10.947
  469    HB2  GLU  60           1HB      GLU  60   1.462   1.803  13.652
  470    HB3  GLU  60           2HB      GLU  60   3.097   1.367  13.179
  471    HG2  GLU  60           1HG      GLU  60   3.302   3.811  12.617
  472    HG3  GLU  60           2HG      GLU  60   1.922   4.043  13.664
  473    H    LYS  61           H        LYS  61  -0.095   0.974  12.457
  474    HA   LYS  61           HA       LYS  61   0.486  -1.746  11.824
  475    HB2  LYS  61           1HB      LYS  61  -2.198  -0.558  12.551
  476    HB3  LYS  61           2HB      LYS  61  -1.852  -2.277  12.484
  477    HG2  LYS  61           1HG      LYS  61  -0.608  -0.275  14.378
  478    HG3  LYS  61           2HG      LYS  61  -1.831  -1.474  14.784
  479    HD2  LYS  61           1HD      LYS  61   0.969  -2.102  13.806
  480    HD3  LYS  61           2HD      LYS  61   0.455  -2.131  15.485
  481    HE2  LYS  61           1HE      LYS  61  -1.149  -3.910  14.976
  482    HE3  LYS  61           2HE      LYS  61  -0.674  -3.860  13.282
  483    HZ1  LYS  61           3HZ      LYS  61   0.359  -5.642  14.628
  484    HZ2  LYS  61           1HZ      LYS  61   1.210  -4.478  15.482
  485    HZ3  LYS  61           2HZ      LYS  61   1.483  -4.679  13.817
  486    H    GLY  62           H        GLY  62  -1.363   0.710  10.173
  487    HA2  GLY  62           1HA      GLY  62  -2.495  -0.947   8.195
  488    HA3  GLY  62           2HA      GLY  62  -2.212   0.812   8.082
  489    H    ALA  63           H        ALA  63   0.523   0.835   8.391
  490    HA   ALA  63           HA       ALA  63   1.454   0.379   5.820
  491    HB1  ALA  63           3HB      ALA  63   2.470   1.978   7.384
  492    HB2  ALA  63           1HB      ALA  63   3.066   0.627   8.348
  493    HB3  ALA  63           2HB      ALA  63   3.662   0.865   6.705
  494    H    GLU  64           H        GLU  64   2.040  -1.455   8.800
  495    HA   GLU  64           HA       GLU  64   3.678  -3.337   7.490
  496    HB2  GLU  64           1HB      GLU  64   3.554  -4.702   9.520
  497    HB3  GLU  64           2HB      GLU  64   3.910  -3.021   9.859
  498    HG2  GLU  64           1HG      GLU  64   1.526  -2.693  10.405
  499    HG3  GLU  64           2HG      GLU  64   1.290  -4.429  10.220
  500    H    THR  65           H        THR  65   0.200  -3.343   7.968
  501    HA   THR  65           HA       THR  65  -0.072  -6.070   7.055
  502    HB   THR  65           HB       THR  65  -1.778  -4.915   8.529
  503    HG1  THR  65           1HG      THR  65  -2.295  -6.778   7.147
  504   HG21  THR  65          3HG2      THR  65  -2.587  -3.505   5.990
  505   HG22  THR  65          1HG2      THR  65  -1.890  -2.756   7.424
  506   HG23  THR  65          2HG2      THR  65  -3.494  -3.486   7.504
  507    H    SER  66           H        SER  66  -0.312  -2.916   5.488
  508    HA   SER  66           HA       SER  66  -0.851  -3.891   2.947
  509    HG   SER  66           HG       SER  66   0.573  -0.938   1.650
  510    HB2  SER  66           1HB      SER  66  -0.987  -1.483   3.666
  511    HB3  SER  66           2HB      SER  66   0.773  -1.426   3.667
  512    H    ILE  67           H        ILE  67   2.200  -3.292   4.620
  513    HA   ILE  67           HA       ILE  67   3.960  -3.930   2.510
  514    HB   ILE  67           HB       ILE  67   4.414  -4.084   5.512
  515   HG12  ILE  67          1HG1      ILE  67   5.328  -2.017   3.502
  516   HG13  ILE  67          2HG1      ILE  67   3.940  -1.819   4.565
  517   HG21  ILE  67          1HG2      ILE  67   5.995  -5.557   4.387
  518   HG22  ILE  67          2HG2      ILE  67   6.828  -4.129   5.006
  519   HG23  ILE  67          3HG2      ILE  67   6.446  -4.253   3.290
  520   HD11  ILE  67          3HD1      ILE  67   5.866  -0.607   5.369
  521   HD12  ILE  67          1HD1      ILE  67   6.820  -2.099   5.407
  522   HD13  ILE  67          2HD1      ILE  67   5.430  -1.896   6.494
  523    H    ASP  68           H        ASP  68   2.583  -5.943   5.041
  524    HA   ASP  68           HA       ASP  68   4.082  -8.245   4.591
  525    HB2  ASP  68           1HB      ASP  68   2.724  -8.012   6.550
  526    HB3  ASP  68           2HB      ASP  68   1.258  -7.899   5.590
  527    H    TYR  69           H        TYR  69   0.791  -7.544   3.363
  528    HA   TYR  69           HA       TYR  69   1.117  -9.916   1.803
  529    HD1  TYR  69           1HD      TYR  69  -0.975 -11.735   2.224
  530    HD2  TYR  69           2HD      TYR  69  -1.842  -8.716  -0.622
  531    HE1  TYR  69           1HE      TYR  69  -1.773 -13.449   0.656
  532    HE2  TYR  69           2HE      TYR  69  -2.644 -10.413  -2.180
  533    HH   TYR  69           HH       TYR  69  -3.284 -13.561  -1.281
  534    HB2  TYR  69           1HB      TYR  69  -1.105  -9.349   2.863
  535    HB3  TYR  69           2HB      TYR  69  -1.291  -8.120   1.614
  536    H    LEU  70           H        LEU  70   1.009  -6.459   1.046
  537    HA   LEU  70           HA       LEU  70   0.860  -6.901  -1.701
  538    HG   LEU  70           HG       LEU  70   0.734  -4.883  -3.006
  539    HB2  LEU  70           1HB      LEU  70   0.328  -4.740  -0.442
  540    HB3  LEU  70           2HB      LEU  70   2.046  -4.470  -0.374
  541   HD11  LEU  70          1HD1      LEU  70   0.860  -2.269  -1.483
  542   HD12  LEU  70          2HD1      LEU  70  -0.605  -3.154  -1.900
  543   HD13  LEU  70          3HD1      LEU  70   0.384  -2.441  -3.171
  544   HD21  LEU  70          3HD2      LEU  70   2.530  -3.371  -3.747
  545   HD22  LEU  70          1HD2      LEU  70   3.144  -4.813  -2.940
  546   HD23  LEU  70          2HD2      LEU  70   3.100  -3.279  -2.079
  547    H    ILE  71           H        ILE  71   3.695  -6.519   0.441
  548    HA   ILE  71           HA       ILE  71   5.525  -6.578  -1.713
  549    HB   ILE  71           HB       ILE  71   5.915  -7.194   1.228
  550   HG12  ILE  71          1HG1      ILE  71   5.542  -4.819   0.614
  551   HG13  ILE  71          2HG1      ILE  71   7.126  -5.091   1.319
  552   HG21  ILE  71          1HG2      ILE  71   8.325  -7.249   0.890
  553   HG22  ILE  71          2HG2      ILE  71   8.094  -7.130  -0.854
  554   HG23  ILE  71          3HG2      ILE  71   7.527  -8.557   0.012
  555   HD11  ILE  71          3HD1      ILE  71   7.257  -3.537  -0.534
  556   HD12  ILE  71          1HD1      ILE  71   6.537  -4.727  -1.621
  557   HD13  ILE  71          2HD1      ILE  71   8.134  -5.016  -0.919
  558    H    LYS  72           H        LYS  72   4.065  -9.228   0.210
  559    HA   LYS  72           HA       LYS  72   5.721 -11.014  -1.364
  560    HB2  LYS  72           1HB      LYS  72   4.959 -12.857   0.010
  561    HB3  LYS  72           2HB      LYS  72   5.554 -11.536   0.992
  562    HG2  LYS  72           1HG      LYS  72   3.151 -10.887   1.349
  563    HG3  LYS  72           2HG      LYS  72   2.712 -12.422   0.590
  564    HD2  LYS  72           1HD      LYS  72   4.074 -13.615   2.255
  565    HD3  LYS  72           2HD      LYS  72   4.493 -12.085   3.007
  566    HE2  LYS  72           1HE      LYS  72   2.777 -13.022   4.328
  567    HE3  LYS  72           2HE      LYS  72   2.028 -11.727   3.401
  568    HZ1  LYS  72           3HZ      LYS  72   0.640 -13.679   3.430
  569    HZ2  LYS  72           1HZ      LYS  72   1.877 -14.631   2.817
  570    HZ3  LYS  72           2HZ      LYS  72   1.188 -13.445   1.846
  571    H    ASN  73           H        ASN  73   3.018  -9.538  -2.214
  572    HA   ASN  73           HA       ASN  73   2.320 -11.835  -3.970
  573    HB2  ASN  73           1HB      ASN  73   0.545 -11.654  -2.319
  574    HB3  ASN  73           2HB      ASN  73   0.334  -9.948  -2.708
  575   HD21  ASN  73          1HD2      ASN  73  -1.680  -9.944  -3.522
  576   HD22  ASN  73          2HD2      ASN  73  -2.194 -10.798  -4.909
  577    H    GLU  74           H        GLU  74   1.748  -8.346  -3.576
  578    HA   GLU  74           HA       GLU  74   1.515  -8.102  -6.501
  579    HB2  GLU  74           1HB      GLU  74   0.354  -6.449  -4.260
  580    HB3  GLU  74           2HB      GLU  74   0.256  -5.997  -5.953
  581    HG2  GLU  74           1HG      GLU  74  -0.932  -8.470  -4.709
  582    HG3  GLU  74           2HG      GLU  74  -1.815  -7.004  -5.131
  583    H    LEU  75           H        LEU  75   4.039  -8.182  -5.728
  584    HA   LEU  75           HA       LEU  75   5.252  -5.916  -4.654
  585    HG   LEU  75           HG       LEU  75   7.876  -5.901  -6.323
  586    HB2  LEU  75           1HB      LEU  75   6.361  -8.099  -4.922
  587    HB3  LEU  75           2HB      LEU  75   6.392  -7.865  -6.657
  588   HD11  LEU  75          1HD1      LEU  75   7.264  -5.303  -4.061
  589   HD12  LEU  75          2HD1      LEU  75   8.992  -5.622  -4.159
  590   HD13  LEU  75          3HD1      LEU  75   7.911  -6.827  -3.459
  591   HD21  LEU  75          3HD2      LEU  75   8.797  -8.081  -6.891
  592   HD22  LEU  75          1HD2      LEU  75   8.861  -8.517  -5.185
  593   HD23  LEU  75          2HD2      LEU  75   9.880  -7.216  -5.802
  594    H    GLU  76           H        GLU  76   4.160  -6.556  -7.894
  595    HA   GLU  76           HA       GLU  76   5.551  -4.498  -9.217
  596    HB2  GLU  76           1HB      GLU  76   2.898  -5.743  -9.905
  597    HB3  GLU  76           2HB      GLU  76   3.837  -4.708 -10.973
  598    HG2  GLU  76           1HG      GLU  76   4.597  -7.421  -9.943
  599    HG3  GLU  76           2HG      GLU  76   4.184  -6.984 -11.603
  600    H    ILE  77           H        ILE  77   2.588  -4.514  -7.369
  601    HA   ILE  77           HA       ILE  77   1.704  -1.939  -8.209
  602    HB   ILE  77           HB       ILE  77   0.986  -3.523  -5.712
  603   HG12  ILE  77          1HG1      ILE  77   0.402  -4.736  -7.753
  604   HG13  ILE  77          2HG1      ILE  77  -1.058  -4.172  -6.930
  605   HG21  ILE  77          1HG2      ILE  77   0.460  -1.169  -5.406
  606   HG22  ILE  77          2HG2      ILE  77  -1.019  -2.115  -5.568
  607   HG23  ILE  77          3HG2      ILE  77  -0.436  -1.152  -6.926
  608   HD11  ILE  77          3HD1      ILE  77  -1.259  -3.922  -9.333
  609   HD12  ILE  77          1HD1      ILE  77   0.213  -2.952  -9.379
  610   HD13  ILE  77          2HD1      ILE  77  -1.222  -2.338  -8.559
  611    H    TRP  78           H        TRP  78   3.733  -3.213  -5.695
  612    HA   TRP  78           HA       TRP  78   4.108  -0.863  -4.174
  613    HD1  TRP  78           HD       TRP  78   5.400  -0.962  -1.551
  614    HE1  TRP  78           1HE      TRP  78   7.685  -0.145  -0.741
  615    HE3  TRP  78           3HE      TRP  78   8.314  -2.960  -5.241
  616    HZ2  TRP  78           2HZ      TRP  78  10.381  -0.334  -1.555
  617    HZ3  TRP  78           3HZ      TRP  78  10.744  -2.592  -5.154
  618    HH2  TRP  78           HH       TRP  78  11.757  -1.310  -3.349
  619    HB2  TRP  78           1HB      TRP  78   4.827  -3.035  -3.309
  620    HB3  TRP  78           2HB      TRP  78   5.963  -3.211  -4.638
  621    H    LYS  79           H        LYS  79   5.848  -2.272  -6.866
  622    HA   LYS  79           HA       LYS  79   7.890  -0.399  -7.184
  623    HB2  LYS  79           1HB      LYS  79   6.474  -2.004  -9.304
  624    HB3  LYS  79           2HB      LYS  79   7.994  -1.160  -9.530
  625    HG2  LYS  79           1HG      LYS  79   9.044  -2.587  -7.871
  626    HG3  LYS  79           2HG      LYS  79   7.507  -3.421  -7.614
  627    HD2  LYS  79           1HD      LYS  79   7.481  -4.127  -9.948
  628    HD3  LYS  79           2HD      LYS  79   8.990  -3.273 -10.229
  629    HE2  LYS  79           1HE      LYS  79  10.138  -4.768  -8.660
  630    HE3  LYS  79           2HE      LYS  79   8.610  -5.580  -8.331
  631    HZ1  LYS  79           3HZ      LYS  79  10.023  -6.734  -9.948
  632    HZ2  LYS  79           1HZ      LYS  79   9.867  -5.427 -10.996
  633    HZ3  LYS  79           2HZ      LYS  79   8.492  -6.324 -10.546
  634    H    GLU  80           H        GLU  80   4.570  -0.309  -8.215
  635    HA   GLU  80           HA       GLU  80   4.959   2.005  -9.813
  636    HB2  GLU  80           1HB      GLU  80   2.434   0.668  -8.882
  637    HB3  GLU  80           2HB      GLU  80   2.483   2.063  -9.957
  638    HG2  GLU  80           1HG      GLU  80   3.902   0.727 -11.516
  639    HG3  GLU  80           2HG      GLU  80   3.639  -0.665 -10.475
  640    H    LEU  81           H        LEU  81   4.059   1.458  -6.474
  641    HA   LEU  81           HA       LEU  81   3.385   4.216  -6.025
  642    HG   LEU  81           HG       LEU  81   2.260   1.343  -5.010
  643    HB2  LEU  81           1HB      LEU  81   4.340   2.232  -3.918
  644    HB3  LEU  81           2HB      LEU  81   3.510   3.731  -3.666
  645   HD11  LEU  81          1HD1      LEU  81   2.644   0.949  -2.656
  646   HD12  LEU  81          2HD1      LEU  81   0.921   1.174  -2.982
  647   HD13  LEU  81          3HD1      LEU  81   1.861   2.482  -2.255
  648   HD21  LEU  81          3HD2      LEU  81   1.333   3.446  -5.832
  649   HD22  LEU  81          1HD2      LEU  81   1.081   3.998  -4.176
  650   HD23  LEU  81          2HD2      LEU  81   0.169   2.624  -4.799
  651    H    THR  82           H        THR  82   6.240   2.215  -5.854
  652    HA   THR  82           HA       THR  82   8.070   4.070  -4.935
  653    HB   THR  82           HB       THR  82   8.439   1.848  -6.979
  654    HG1  THR  82           1HG      THR  82   8.500   1.996  -4.161
  655   HG21  THR  82          3HG2      THR  82  10.795   1.855  -6.317
  656   HG22  THR  82          1HG2      THR  82  10.487   3.196  -5.203
  657   HG23  THR  82          2HG2      THR  82  10.331   3.445  -6.945
  658    H    ALA  83           H        ALA  83   6.999   3.352  -8.249
  659    HA   ALA  83           HA       ALA  83   8.510   5.355  -9.528
  660    HB1  ALA  83           3HB      ALA  83   7.093   4.968 -11.463
  661    HB2  ALA  83           1HB      ALA  83   7.515   3.432 -10.705
  662    HB3  ALA  83           2HB      ALA  83   5.915   4.131 -10.454
  663    H    HIS  84           H        HIS  84   5.441   5.462  -7.940
  664    HA   HIS  84           HA       HIS  84   4.495   7.929  -8.909
  665    HD1  HIS  84           1HD      HIS  84   1.066   7.926  -8.026
  666    HD2  HIS  84           2HD      HIS  84   3.608   9.161  -4.974
  667    HE1  HIS  84           1HE      HIS  84  -0.137   9.758  -6.848
  668    HE2  HIS  84           2HE      HIS  84   1.341  10.393  -4.924
  669    HB2  HIS  84           1HB      HIS  84   3.037   6.354  -7.710
  670    HB3  HIS  84           2HB      HIS  84   3.989   6.550  -6.250
  671    H    PHE  85           H        PHE  85   6.526   7.143  -6.098
  672    HA   PHE  85           HA       PHE  85   6.786  10.026  -5.687
  673    HD1  PHE  85           2HD      PHE  85   6.129  11.222  -3.332
  674    HD2  PHE  85           1HD      PHE  85   9.488   8.687  -2.726
  675    HE1  PHE  85           2HE      PHE  85   7.185  12.958  -1.951
  676    HE2  PHE  85           1HE      PHE  85  10.549  10.422  -1.350
  677    HZ   PHE  85           HZ       PHE  85   9.400  12.563  -0.963
  678    HB2  PHE  85           1HB      PHE  85   6.036   8.740  -3.727
  679    HB3  PHE  85           2HB      PHE  85   7.543   7.830  -3.758
  680    H    ASP  86           H        ASP  86   8.954   7.165  -5.778
  681    HA   ASP  86           HA       ASP  86  11.054   8.856  -6.816
  682    HB2  ASP  86           1HB      ASP  86  11.259   9.255  -4.401
  683    HB3  ASP  86           2HB      ASP  86  11.383   7.527  -4.117
  684    HA   PRO  87           HA       PRO  87  11.356   4.544  -8.377
  685    HB2  PRO  87           1HB      PRO  87  11.832   5.273 -10.952
  686    HB3  PRO  87           2HB      PRO  87  10.222   4.997 -10.309
  687    HG2  PRO  87           1HG      PRO  87  11.613   7.536 -10.937
  688    HG3  PRO  87           2HG      PRO  87   9.881   7.187 -10.915
  689    HD2  PRO  87           1HD      PRO  87  11.297   8.577  -8.958
  690    HD3  PRO  87           2HD      PRO  87   9.682   7.880  -8.762
  691    H    ASP  88           H        ASP  88  13.465   7.309  -8.670
  692    HA   ASP  88           HA       ASP  88  15.587   5.644  -9.812
  693    HB2  ASP  88           1HB      ASP  88  14.898   7.850 -10.844
  694    HB3  ASP  88           2HB      ASP  88  15.569   8.645  -9.428
  695    H    GLY  89           H        GLY  89  14.704   5.651  -6.955
  696    HA2  GLY  89           1HA      GLY  89  16.985   6.713  -5.518
  697    HA3  GLY  89           2HA      GLY  89  15.641   5.815  -4.821
  698    H    LYS  90           H        LYS  90  17.293   4.690  -3.611
  699    HA   LYS  90           HA       LYS  90  19.226   3.055  -4.893
  700    HB2  LYS  90           1HB      LYS  90  19.308   3.816  -2.486
  701    HB3  LYS  90           2HB      LYS  90  18.024   2.674  -2.145
  702    HG2  LYS  90           1HG      LYS  90  20.136   1.747  -1.470
  703    HG3  LYS  90           2HG      LYS  90  19.518   0.824  -2.845
  704    HD2  LYS  90           1HD      LYS  90  21.033   2.039  -4.324
  705    HD3  LYS  90           2HD      LYS  90  21.589   3.014  -2.962
  706    HE2  LYS  90           1HE      LYS  90  22.390   0.933  -1.867
  707    HE3  LYS  90           2HE      LYS  90  21.916   0.026  -3.301
  708    HZ1  LYS  90           3HZ      LYS  90  23.927   2.191  -3.187
  709    HZ2  LYS  90           1HZ      LYS  90  23.487   1.365  -4.579
  710    HZ3  LYS  90           2HZ      LYS  90  24.272   0.552  -3.325
  711    H    TRP  91           H        TRP  91  15.933   2.659  -3.920
  712    HA   TRP  91           HA       TRP  91  14.245   1.249  -4.552
  713    HD1  TRP  91           HD       TRP  91  13.169   1.365  -7.975
  714    HE1  TRP  91           1HE      TRP  91  11.456  -0.446  -8.604
  715    HE3  TRP  91           3HE      TRP  91  15.098  -2.619  -5.382
  716    HZ2  TRP  91           2HZ      TRP  91  10.971  -3.115  -8.097
  717    HZ3  TRP  91           3HZ      TRP  91  13.929  -4.775  -5.520
  718    HH2  TRP  91           HH       TRP  91  11.902  -5.023  -6.849
  719    HB2  TRP  91           1HB      TRP  91  15.432   1.399  -6.826
  720    HB3  TRP  91           2HB      TRP  91  16.166  -0.143  -6.430
  721    H    ARG  92           H        ARG  92  17.116  -0.744  -4.748
  722    HA   ARG  92           HA       ARG  92  16.105  -3.120  -3.654
  723    HE   ARG  92           HE       ARG  92  19.175  -1.350  -6.018
  724    HB2  ARG  92           1HB      ARG  92  18.880  -1.989  -3.909
  725    HB3  ARG  92           2HB      ARG  92  18.628  -3.476  -3.020
  726    HG2  ARG  92           1HG      ARG  92  19.369  -3.895  -5.315
  727    HG3  ARG  92           2HG      ARG  92  17.779  -4.572  -5.017
  728    HD2  ARG  92           1HD      ARG  92  17.918  -3.565  -7.241
  729    HD3  ARG  92           2HD      ARG  92  16.763  -2.694  -6.255
  730   HH11  ARG  92          1HH1      ARG  92  16.942  -2.136  -8.672
  731   HH12  ARG  92          2HH1      ARG  92  17.333  -0.752  -9.567
  732   HH21  ARG  92          1HH2      ARG  92  19.689   0.517  -7.268
  733   HH22  ARG  92          2HH2      ARG  92  18.898   0.816  -8.752
  734    H    LYS  93           H        LYS  93  17.484  -0.326  -2.128
  735    HA   LYS  93           HA       LYS  93  17.753  -1.366   0.481
  736    HB2  LYS  93           1HB      LYS  93  18.836   0.680  -0.436
  737    HB3  LYS  93           2HB      LYS  93  17.289   1.500  -0.311
  738    HG2  LYS  93           1HG      LYS  93  17.334   1.249   2.102
  739    HG3  LYS  93           2HG      LYS  93  18.844   0.334   1.997
  740    HD2  LYS  93           1HD      LYS  93  19.853   2.317   0.848
  741    HD3  LYS  93           2HD      LYS  93  18.389   3.211   1.228
  742    HE2  LYS  93           1HE      LYS  93  18.776   2.885   3.608
  743    HE3  LYS  93           2HE      LYS  93  20.200   1.909   3.252
  744    HZ1  LYS  93           3HZ      LYS  93  21.223   3.849   2.220
  745    HZ2  LYS  93           1HZ      LYS  93  20.826   4.163   3.829
  746    HZ3  LYS  93           2HZ      LYS  93  19.880   4.790   2.588
  747    H    LYS  94           H        LYS  94  15.101   0.267  -1.185
  748    HA   LYS  94           HA       LYS  94  13.407   0.561   1.089
  749    HB2  LYS  94           1HB      LYS  94  12.636   0.257  -1.821
  750    HB3  LYS  94           2HB      LYS  94  11.588   0.763  -0.509
  751    HG2  LYS  94           1HG      LYS  94  12.852   2.803  -0.249
  752    HG3  LYS  94           2HG      LYS  94  13.952   2.279  -1.540
  753    HD2  LYS  94           1HD      LYS  94  12.195   2.279  -3.150
  754    HD3  LYS  94           2HD      LYS  94  10.974   2.522  -1.907
  755    HE2  LYS  94           1HE      LYS  94  11.961   4.750  -1.448
  756    HE3  LYS  94           2HE      LYS  94  13.083   4.463  -2.783
  757    HZ1  LYS  94           3HZ      LYS  94  11.399   4.545  -4.335
  758    HZ2  LYS  94           1HZ      LYS  94  10.998   5.780  -3.268
  759    HZ3  LYS  94           2HZ      LYS  94  10.179   4.278  -3.194
  760    H    TYR  95           H        TYR  95  13.752  -1.785  -1.454
  761    HA   TYR  95           HA       TYR  95  11.671  -3.513  -0.873
  762    HD1  TYR  95           1HD      TYR  95  10.851  -5.291  -2.191
  763    HD2  TYR  95           2HD      TYR  95  14.963  -5.996  -3.018
  764    HE1  TYR  95           1HE      TYR  95  10.307  -7.562  -2.981
  765    HE2  TYR  95           2HE      TYR  95  14.433  -8.258  -3.787
  766    HH   TYR  95           HH       TYR  95  12.811  -9.868  -3.674
  767    HB2  TYR  95           1HB      TYR  95  12.880  -3.453  -2.934
  768    HB3  TYR  95           2HB      TYR  95  14.374  -3.965  -2.155
  769    H    GLU  96           H        GLU  96  15.049  -3.574   0.281
  770    HA   GLU  96           HA       GLU  96  14.668  -5.815   1.992
  771    HB2  GLU  96           1HB      GLU  96  16.752  -3.639   2.122
  772    HB3  GLU  96           2HB      GLU  96  16.774  -5.118   3.063
  773    HG2  GLU  96           1HG      GLU  96  16.903  -6.399   0.961
  774    HG3  GLU  96           2HG      GLU  96  17.009  -4.870   0.083
  775    H    ASP  97           H        ASP  97  14.568  -2.332   2.480
  776    HA   ASP  97           HA       ASP  97  14.393  -2.180   5.257
  777    HB2  ASP  97           1HB      ASP  97  14.775  -0.241   3.867
  778    HB3  ASP  97           2HB      ASP  97  13.213  -0.439   3.097
  779    H    ARG  98           H        ARG  98  11.752  -2.182   2.907
  780    HA   ARG  98           HA       ARG  98   9.708  -2.152   4.883
  781    HE   ARG  98           HE       ARG  98   9.051   1.428   1.278
  782    HB2  ARG  98           1HB      ARG  98   9.615  -2.713   1.913
  783    HB3  ARG  98           2HB      ARG  98   8.193  -2.867   2.914
  784    HG2  ARG  98           1HG      ARG  98   8.237  -0.734   1.688
  785    HG3  ARG  98           2HG      ARG  98   8.260  -0.474   3.427
  786    HD2  ARG  98           1HD      ARG  98  10.546   0.122   3.394
  787    HD3  ARG  98           2HD      ARG  98  10.762  -0.514   1.770
  788   HH11  ARG  98          1HH1      ARG  98  11.648   1.605   3.648
  789   HH12  ARG  98          2HH1      ARG  98  12.216   3.129   3.177
  790   HH21  ARG  98          1HH2      ARG  98   9.864   3.514   0.516
  791   HH22  ARG  98          2HH2      ARG  98  11.139   4.276   1.346
  792    H    ALA  99           H        ALA  99  10.969  -4.757   2.823
  793    HA   ALA  99           HA       ALA  99   9.111  -6.661   3.789
  794    HB1  ALA  99           3HB      ALA  99  10.182  -6.771   1.567
  795    HB2  ALA  99           1HB      ALA  99  11.700  -7.162   2.366
  796    HB3  ALA  99           2HB      ALA  99  10.339  -8.272   2.488
  797    H    LYS 100           H        LYS 100  12.605  -6.239   4.420
  798    HA   LYS 100           HA       LYS 100  12.641  -8.558   6.055
  799    HB2  LYS 100           1HB      LYS 100  14.770  -6.426   5.866
  800    HB3  LYS 100           2HB      LYS 100  14.967  -8.038   6.533
  801    HG2  LYS 100           1HG      LYS 100  14.413  -7.343   3.644
  802    HG3  LYS 100           2HG      LYS 100  15.943  -7.899   4.309
  803    HD2  LYS 100           1HD      LYS 100  13.378  -9.509   4.289
  804    HD3  LYS 100           2HD      LYS 100  14.660  -9.663   3.097
  805    HE2  LYS 100           1HE      LYS 100  14.990 -10.139   6.058
  806    HE3  LYS 100           2HE      LYS 100  14.716 -11.397   4.861
  807    HZ1  LYS 100           3HZ      LYS 100  16.800 -10.810   3.797
  808    HZ2  LYS 100           1HZ      LYS 100  17.020 -11.182   5.426
  809    HZ3  LYS 100           2HZ      LYS 100  17.073  -9.574   4.942
  810    H    ALA 101           H        ALA 101  12.120  -5.137   6.764
  811    HA   ALA 101           HA       ALA 101  12.659  -5.350   9.525
  812    HB1  ALA 101           3HB      ALA 101  11.413  -3.291   9.791
  813    HB2  ALA 101           1HB      ALA 101  12.439  -3.191   8.356
  814    HB3  ALA 101           2HB      ALA 101  10.712  -3.480   8.184
  815    H    LYS 102           H        LYS 102   9.858  -6.196   7.622
  816    HA   LYS 102           HA       LYS 102   8.253  -6.549  10.025
  817    HB2  LYS 102           1HB      LYS 102   7.498  -7.082   7.152
  818    HB3  LYS 102           2HB      LYS 102   6.401  -7.047   8.524
  819    HG2  LYS 102           1HG      LYS 102   7.951  -4.733   7.385
  820    HG3  LYS 102           2HG      LYS 102   6.213  -5.001   7.276
  821    HD2  LYS 102           1HD      LYS 102   6.010  -4.731   9.700
  822    HD3  LYS 102           2HD      LYS 102   7.762  -4.547   9.836
  823    HE2  LYS 102           1HE      LYS 102   7.635  -2.563   8.386
  824    HE3  LYS 102           2HE      LYS 102   5.883  -2.737   8.353
  825    HZ1  LYS 102           3HZ      LYS 102   7.520  -2.206  10.780
  826    HZ2  LYS 102           1HZ      LYS 102   5.840  -2.353  10.751
  827    HZ3  LYS 102           2HZ      LYS 102   6.601  -1.098   9.923
  828    H    GLY 103           H        GLY 103  10.004  -8.429   7.724
  829    HA2  GLY 103           1HA      GLY 103  10.815 -10.605   8.504
  830    HA3  GLY 103           2HA      GLY 103   9.234 -10.848   9.243
  831    H    ILE 104           H        ILE 104   9.570  -9.408   6.118
  832    HA   ILE 104           HA       ILE 104   8.200 -11.682   4.953
  833    HB   ILE 104           HB       ILE 104   8.832  -8.964   3.752
  834   HG12  ILE 104          1HG1      ILE 104   7.311  -8.703   5.656
  835   HG13  ILE 104          2HG1      ILE 104   6.468  -8.391   4.142
  836   HG21  ILE 104          1HG2      ILE 104   7.140  -9.545   2.063
  837   HG22  ILE 104          2HG2      ILE 104   6.948 -11.129   2.817
  838   HG23  ILE 104          3HG2      ILE 104   8.484 -10.693   2.068
  839   HD11  ILE 104          3HD1      ILE 104   5.097  -9.661   5.696
  840   HD12  ILE 104          1HD1      ILE 104   6.330 -10.917   5.765
  841   HD13  ILE 104          2HD1      ILE 104   5.466 -10.613   4.257
  842    H    VAL 105           H        VAL 105   9.487 -13.161   4.106
  843    HA   VAL 105           HA       VAL 105  12.170 -12.429   3.343
  844    HB   VAL 105           HB       VAL 105  12.504 -14.881   2.892
  845   HG11  VAL 105          1HG1      VAL 105  11.406 -14.197   5.616
  846   HG12  VAL 105          2HG1      VAL 105  12.431 -15.582   5.244
  847   HG13  VAL 105          3HG1      VAL 105  13.062 -13.943   5.070
  848   HG21  VAL 105          3HG2      VAL 105  10.194 -15.475   2.327
  849   HG22  VAL 105          1HG2      VAL 105   9.696 -15.132   3.986
  850   HG23  VAL 105          2HG2      VAL 105  10.801 -16.464   3.658
  851    H    ILE 106           H        ILE 106  12.910 -12.298   1.314
  852    HA   ILE 106           HA       ILE 106  11.057 -12.824  -0.874
  853    HB   ILE 106           HB       ILE 106  11.421 -10.663  -1.914
  854   HG12  ILE 106          1HG1      ILE 106  13.667 -10.113  -0.968
  855   HG13  ILE 106          2HG1      ILE 106  12.553  -8.763  -0.896
  856   HG21  ILE 106          1HG2      ILE 106  10.344 -10.326   0.853
  857   HG22  ILE 106          2HG2      ILE 106   9.460 -10.822  -0.587
  858   HG23  ILE 106          3HG2      ILE 106  10.121  -9.187  -0.475
  859   HD11  ILE 106          3HD1      ILE 106  13.371 -10.534   1.391
  860   HD12  ILE 106          1HD1      ILE 106  12.227  -9.199   1.493
  861   HD13  ILE 106          2HD1      ILE 106  13.915  -8.884   1.084
  862    HA   PRO 107           HA       PRO 107  14.941 -13.725  -2.969
  863    HB2  PRO 107           1HB      PRO 107  13.947 -12.331  -5.379
  864    HB3  PRO 107           2HB      PRO 107  14.381 -14.031  -5.195
  865    HG2  PRO 107           1HG      PRO 107  11.830 -13.281  -5.492
  866    HG3  PRO 107           2HG      PRO 107  12.280 -14.620  -4.422
  867    HD2  PRO 107           1HD      PRO 107  11.612 -11.789  -3.726
  868    HD3  PRO 107           2HD      PRO 107  11.102 -13.297  -2.929
  869    H    GLU 108           H        GLU 108  16.449 -12.402  -2.088
  870    HA   GLU 108           HA       GLU 108  16.496  -9.610  -2.898
  871    HB2  GLU 108           1HB      GLU 108  17.848  -9.247  -0.804
  872    HB3  GLU 108           2HB      GLU 108  16.201  -9.772  -0.509
  873    HG2  GLU 108           1HG      GLU 108  17.027 -12.064  -0.117
  874    HG3  GLU 108           2HG      GLU 108  18.672 -11.499  -0.375
  Start of MODEL    3
    1    HA   TYR   1           HA       TYR   1 -20.579  -3.475  -0.309
    2    HD1  TYR   1           1HD      TYR   1 -19.956  -4.250  -2.729
    3    HD2  TYR   1           2HD      TYR   1 -21.865  -0.513  -3.366
    4    HE1  TYR   1           1HE      TYR   1 -20.992  -5.134  -4.765
    5    HE2  TYR   1           2HE      TYR   1 -22.909  -1.386  -5.409
    6    HH   TYR   1           HH       TYR   1 -22.610  -3.168  -7.049
    7    H1   TYR   1           1HT      TYR   1 -22.547  -1.278  -0.327
    8    H2   TYR   1           2HT      TYR   1 -22.662  -2.710   0.522
    9    H3   TYR   1           3HT      TYR   1 -22.717  -2.739  -1.162
   10    HB2  TYR   1           1HB      TYR   1 -20.370  -0.730  -1.601
   11    HB3  TYR   1           2HB      TYR   1 -19.162  -2.008  -1.656
   12    H    THR   2           H        THR   2 -19.857  -3.489   1.748
   13    HA   THR   2           HA       THR   2 -19.212  -0.888   2.887
   14    HB   THR   2           HB       THR   2 -21.185  -1.695   4.065
   15    HG1  THR   2           1HG      THR   2 -18.980  -2.131   5.820
   16   HG21  THR   2          3HG2      THR   2 -19.564  -4.164   4.724
   17   HG22  THR   2          1HG2      THR   2 -20.981  -4.104   3.674
   18   HG23  THR   2          2HG2      THR   2 -21.143  -3.777   5.402
   19    H    ASP   3           H        ASP   3 -17.326  -0.648   3.812
   20    HA   ASP   3           HA       ASP   3 -15.316  -0.916   4.541
   21    HB2  ASP   3           1HB      ASP   3 -16.135  -3.734   5.142
   22    HB3  ASP   3           2HB      ASP   3 -14.575  -3.052   5.617
   23    H    LYS   4           H        LYS   4 -15.956  -3.481   2.342
   24    HA   LYS   4           HA       LYS   4 -13.274  -3.415   1.258
   25    HB2  LYS   4           1HB      LYS   4 -15.811  -4.495   0.022
   26    HB3  LYS   4           2HB      LYS   4 -14.218  -4.633  -0.703
   27    HG2  LYS   4           1HG      LYS   4 -13.504  -5.896   1.325
   28    HG3  LYS   4           2HG      LYS   4 -15.196  -5.901   1.834
   29    HD2  LYS   4           1HD      LYS   4 -15.814  -7.016  -0.255
   30    HD3  LYS   4           2HD      LYS   4 -14.121  -7.017  -0.755
   31    HE2  LYS   4           1HE      LYS   4 -13.576  -8.347   1.252
   32    HE3  LYS   4           2HE      LYS   4 -15.287  -8.391   1.656
   33    HZ1  LYS   4           3HZ      LYS   4 -14.068  -9.576  -0.795
   34    HZ2  LYS   4           1HZ      LYS   4 -15.710  -9.584  -0.411
   35    HZ3  LYS   4           2HZ      LYS   4 -14.592 -10.400   0.553
   36    H    TYR   5           H        TYR   5 -12.469  -2.015  -0.047
   37    HA   TYR   5           HA       TYR   5 -12.129  -0.106  -0.880
   38    HD1  TYR   5           2HD      TYR   5 -13.590  -2.797  -3.355
   39    HD2  TYR   5           1HD      TYR   5 -16.114   0.572  -2.834
   40    HE1  TYR   5           2HE      TYR   5 -15.448  -4.063  -4.308
   41    HE2  TYR   5           1HE      TYR   5 -17.996  -0.688  -3.808
   42    HH   TYR   5           HH       TYR   5 -18.240  -2.609  -5.386
   43    HB2  TYR   5           1HB      TYR   5 -13.668   0.771  -2.832
   44    HB3  TYR   5           2HB      TYR   5 -12.657  -0.622  -3.030
   45    H    ASP   6           H        ASP   6 -15.170  -0.166   0.396
   46    HA   ASP   6           HA       ASP   6 -15.446   2.588   0.850
   47    HB2  ASP   6           1HB      ASP   6 -17.430   1.404   1.110
   48    HB3  ASP   6           2HB      ASP   6 -16.670   0.152   2.082
   49    H    LYS   7           H        LYS   7 -13.695   0.035   2.736
   50    HA   LYS   7           HA       LYS   7 -12.759   2.225   4.282
   51    HB2  LYS   7           1HB      LYS   7 -15.066   2.082   5.091
   52    HB3  LYS   7           2HB      LYS   7 -14.706   0.530   5.802
   53    HG2  LYS   7           1HG      LYS   7 -13.459   1.449   7.497
   54    HG3  LYS   7           2HG      LYS   7 -13.142   2.938   6.603
   55    HD2  LYS   7           1HD      LYS   7 -14.717   3.443   8.340
   56    HD3  LYS   7           2HD      LYS   7 -15.555   3.514   6.807
   57    HE2  LYS   7           1HE      LYS   7 -15.689   1.223   8.792
   58    HE3  LYS   7           2HE      LYS   7 -16.911   2.468   8.598
   59    HZ1  LYS   7           3HZ      LYS   7 -16.992   1.469   6.139
   60    HZ2  LYS   7           1HZ      LYS   7 -17.744   0.684   7.442
   61    HZ3  LYS   7           2HZ      LYS   7 -16.273   0.150   6.934
   62    H    ILE   8           H        ILE   8 -13.111  -0.761   6.181
   63    HA   ILE   8           HA       ILE   8 -10.212  -0.544   6.569
   64    HB   ILE   8           HB       ILE   8 -10.568  -2.153   8.445
   65   HG12  ILE   8          1HG1      ILE   8 -13.511  -1.692   7.898
   66   HG13  ILE   8          2HG1      ILE   8 -12.658  -3.177   7.505
   67   HG21  ILE   8          1HG2      ILE   8 -12.175   0.392   8.532
   68   HG22  ILE   8          2HG2      ILE   8 -10.451   0.221   8.856
   69   HG23  ILE   8          3HG2      ILE   8 -11.629  -0.528   9.932
   70   HD11  ILE   8          3HD1      ILE   8 -13.069  -2.013  10.254
   71   HD12  ILE   8          1HD1      ILE   8 -12.192  -3.502   9.897
   72   HD13  ILE   8          2HD1      ILE   8 -13.922  -3.395   9.563
   73    H    ASN   9           H        ASN   9 -11.024  -1.626   4.199
   74    HA   ASN   9           HA       ASN   9 -10.759  -4.501   4.157
   75    HB2  ASN   9           1HB      ASN   9 -10.914  -4.149   1.783
   76    HB3  ASN   9           2HB      ASN   9 -12.157  -3.284   2.706
   77   HD21  ASN   9          1HD2      ASN   9  -9.064  -2.755   1.091
   78   HD22  ASN   9          2HD2      ASN   9  -9.314  -1.096   0.746
   79    H    LEU  10           H        LEU  10  -8.317  -3.065   5.210
   80    HA   LEU  10           HA       LEU  10  -6.707  -2.422   2.939
   81    HG   LEU  10           HG       LEU  10  -5.534  -0.074   5.495
   82    HB2  LEU  10           1HB      LEU  10  -5.814  -2.660   5.814
   83    HB3  LEU  10           2HB      LEU  10  -4.839  -2.033   4.505
   84   HD11  LEU  10          1HD1      LEU  10  -7.668  -0.519   3.492
   85   HD12  LEU  10          2HD1      LEU  10  -6.034   0.085   3.219
   86   HD13  LEU  10          3HD1      LEU  10  -7.169   1.027   4.185
   87   HD21  LEU  10          3HD2      LEU  10  -7.660   0.351   6.527
   88   HD22  LEU  10          1HD2      LEU  10  -6.973  -1.148   7.167
   89   HD23  LEU  10          2HD2      LEU  10  -8.290  -1.208   5.970
   90    H    GLN  11           H        GLN  11  -6.988  -5.095   5.020
   91    HA   GLN  11           HA       GLN  11  -4.927  -6.473   3.559
   92    HB2  GLN  11           1HB      GLN  11  -6.593  -7.207   5.901
   93    HB3  GLN  11           2HB      GLN  11  -5.580  -8.386   5.080
   94    HG2  GLN  11           1HG      GLN  11  -4.643  -5.798   6.282
   95    HG3  GLN  11           2HG      GLN  11  -4.439  -7.397   6.997
   96   HE21  GLN  11          1HE2      GLN  11  -3.434  -5.281   4.314
   97   HE22  GLN  11          2HE2      GLN  11  -2.015  -6.163   3.982
   98    H    GLU  12           H        GLU  12  -8.385  -6.242   3.536
   99    HA   GLU  12           HA       GLU  12  -8.856  -8.874   2.488
  100    HB2  GLU  12           1HB      GLU  12 -10.606  -6.424   2.643
  101    HB3  GLU  12           2HB      GLU  12 -11.140  -7.912   1.896
  102    HG2  GLU  12           1HG      GLU  12 -12.000  -7.706   4.115
  103    HG3  GLU  12           2HG      GLU  12 -10.897  -9.076   4.032
  104    H    ILE  13           H        ILE  13  -8.793  -5.673   1.210
  105    HA   ILE  13           HA       ILE  13  -9.287  -6.445  -1.459
  106    HB   ILE  13           HB       ILE  13  -8.462  -3.933  -0.099
  107   HG12  ILE  13          1HG1      ILE  13 -10.847  -4.445  -0.082
  108   HG13  ILE  13          2HG1      ILE  13 -10.527  -3.040  -1.107
  109   HG21  ILE  13          1HG2      ILE  13  -8.439  -2.741  -2.214
  110   HG22  ILE  13          2HG2      ILE  13  -8.496  -4.301  -3.052
  111   HG23  ILE  13          3HG2      ILE  13  -7.133  -3.902  -1.993
  112   HD11  ILE  13          3HD1      ILE  13 -10.611  -4.567  -3.031
  113   HD12  ILE  13          1HD1      ILE  13 -12.150  -4.360  -2.168
  114   HD13  ILE  13          2HD1      ILE  13 -11.204  -5.818  -1.914
  115    H    LEU  14           H        LEU  14  -6.321  -5.460   0.308
  116    HA   LEU  14           HA       LEU  14  -4.553  -5.468  -1.808
  117    HG   LEU  14           HG       LEU  14  -2.096  -6.627  -0.323
  118    HB2  LEU  14           1HB      LEU  14  -4.125  -4.516   0.362
  119    HB3  LEU  14           2HB      LEU  14  -4.091  -6.114   1.069
  120   HD11  LEU  14          1HD1      LEU  14  -0.865  -4.763  -1.288
  121   HD12  LEU  14          2HD1      LEU  14  -2.225  -3.687  -0.960
  122   HD13  LEU  14          3HD1      LEU  14  -2.403  -5.027  -2.100
  123   HD21  LEU  14          3HD2      LEU  14  -1.988  -4.289   1.505
  124   HD22  LEU  14          1HD2      LEU  14  -0.591  -5.275   1.056
  125   HD23  LEU  14          2HD2      LEU  14  -1.919  -5.997   1.969
  126    H    GLU  15           H        GLU  15  -5.770  -8.155   0.012
  127    HA   GLU  15           HA       GLU  15  -3.815 -10.011  -0.597
  128    HB2  GLU  15           1HB      GLU  15  -5.306 -10.500   1.076
  129    HB3  GLU  15           2HB      GLU  15  -6.739 -10.298   0.059
  130    HG2  GLU  15           1HG      GLU  15  -6.039 -12.320  -1.200
  131    HG3  GLU  15           2HG      GLU  15  -4.690 -12.511  -0.086
  132    H    ASN  16           H        ASN  16  -6.258  -8.701  -2.656
  133    HA   ASN  16           HA       ASN  16  -5.401 -10.597  -4.726
  134    HB2  ASN  16           1HB      ASN  16  -8.217  -9.635  -4.216
  135    HB3  ASN  16           2HB      ASN  16  -7.707 -10.451  -5.686
  136   HD21  ASN  16          1HD2      ASN  16  -8.448 -10.800  -2.339
  137   HD22  ASN  16          2HD2      ASN  16  -8.449 -12.523  -2.318
  138    H    LYS  17           H        LYS  17  -4.563  -9.510  -6.466
  139    HA   LYS  17           HA       LYS  17  -4.663  -6.710  -6.501
  140    HB2  LYS  17           1HB      LYS  17  -3.558  -6.667  -8.661
  141    HB3  LYS  17           2HB      LYS  17  -2.798  -7.850  -7.626
  142    HG2  LYS  17           1HG      LYS  17  -4.829  -8.584  -9.708
  143    HG3  LYS  17           2HG      LYS  17  -3.112  -8.440 -10.077
  144    HD2  LYS  17           1HD      LYS  17  -4.325 -10.295  -8.028
  145    HD3  LYS  17           2HD      LYS  17  -3.860 -10.750  -9.657
  146    HE2  LYS  17           1HE      LYS  17  -2.020  -9.812  -7.438
  147    HE3  LYS  17           2HE      LYS  17  -2.119 -11.430  -8.116
  148    HZ1  LYS  17           3HZ      LYS  17  -1.394 -10.336 -10.307
  149    HZ2  LYS  17           1HZ      LYS  17  -0.243 -10.387  -9.066
  150    HZ3  LYS  17           2HZ      LYS  17  -1.051  -8.978  -9.346
  151    H    ARG  18           H        ARG  18  -6.683  -8.989  -7.859
  152    HA   ARG  18           HA       ARG  18  -8.160  -7.266  -9.529
  153    HE   ARG  18           HE       ARG  18  -8.092 -12.447  -6.668
  154    HB2  ARG  18           1HB      ARG  18 -10.053  -9.015  -9.252
  155    HB3  ARG  18           2HB      ARG  18  -8.570  -9.501 -10.049
  156    HG2  ARG  18           1HG      ARG  18  -9.035 -10.088  -7.131
  157    HG3  ARG  18           2HG      ARG  18  -9.717 -11.120  -8.378
  158    HD2  ARG  18           1HD      ARG  18  -7.418 -11.507  -9.290
  159    HD3  ARG  18           2HD      ARG  18  -6.728 -10.565  -7.970
  160   HH11  ARG  18          1HH1      ARG  18  -5.820 -12.685  -9.405
  161   HH12  ARG  18          2HH1      ARG  18  -5.119 -14.120  -8.836
  162   HH21  ARG  18          1HH2      ARG  18  -7.075 -14.390  -5.911
  163   HH22  ARG  18          2HH2      ARG  18  -5.849 -15.118  -6.849
  164    H    LEU  19           H        LEU  19  -8.348  -7.976  -6.117
  165    HA   LEU  19           HA       LEU  19 -10.688  -6.382  -5.792
  166    HG   LEU  19           HG       LEU  19 -10.222  -9.314  -4.733
  167    HB2  LEU  19           1HB      LEU  19  -8.798  -7.583  -3.783
  168    HB3  LEU  19           2HB      LEU  19 -10.197  -6.628  -3.359
  169   HD11  LEU  19          1HD1      LEU  19 -11.263  -8.440  -2.050
  170   HD12  LEU  19          2HD1      LEU  19  -9.761  -9.308  -2.317
  171   HD13  LEU  19          3HD1      LEU  19 -11.302 -10.075  -2.715
  172   HD21  LEU  19          3HD2      LEU  19 -12.516  -7.489  -4.013
  173   HD22  LEU  19          1HD2      LEU  19 -12.670  -9.157  -4.565
  174   HD23  LEU  19          2HD2      LEU  19 -12.006  -7.938  -5.642
  175    H    LEU  20           H        LEU  20  -7.276  -5.941  -5.798
  176    HA   LEU  20           HA       LEU  20  -7.155  -3.403  -4.579
  177    HG   LEU  20           HG       LEU  20  -5.136  -5.534  -4.285
  178    HB2  LEU  20           1HB      LEU  20  -5.434  -4.789  -6.624
  179    HB3  LEU  20           2HB      LEU  20  -5.079  -3.135  -6.140
  180   HD11  LEU  20          1HD1      LEU  20  -2.796  -3.941  -5.320
  181   HD12  LEU  20          2HD1      LEU  20  -3.227  -5.544  -5.900
  182   HD13  LEU  20          3HD1      LEU  20  -2.727  -5.319  -4.226
  183   HD21  LEU  20          3HD2      LEU  20  -5.735  -3.508  -3.160
  184   HD22  LEU  20          1HD2      LEU  20  -4.383  -2.664  -3.905
  185   HD23  LEU  20          2HD2      LEU  20  -4.061  -3.913  -2.729
  186    H    GLU  21           H        GLU  21  -7.603  -4.433  -7.879
  187    HA   GLU  21           HA       GLU  21  -8.115  -2.010  -9.091
  188    HB2  GLU  21           1HB      GLU  21  -9.074  -4.794  -9.548
  189    HB3  GLU  21           2HB      GLU  21  -9.692  -3.484 -10.533
  190    HG2  GLU  21           1HG      GLU  21  -6.757  -3.987 -10.180
  191    HG3  GLU  21           2HG      GLU  21  -7.703  -4.798 -11.427
  192    H    SER  22           H        SER  22 -10.220  -3.961  -7.037
  193    HA   SER  22           HA       SER  22 -12.549  -2.466  -7.551
  194    HG   SER  22           HG       SER  22 -12.134  -4.766  -7.578
  195    HB2  SER  22           1HB      SER  22 -11.974  -4.027  -4.997
  196    HB3  SER  22           2HB      SER  22 -13.533  -3.614  -5.703
  197    H    TYR  23           H        TYR  23 -10.058  -1.995  -4.914
  198    HA   TYR  23           HA       TYR  23 -11.551   0.451  -4.305
  199    HD1  TYR  23           2HD      TYR  23  -8.013  -0.967  -4.217
  200    HD2  TYR  23           1HD      TYR  23  -9.096   0.279  -0.328
  201    HE1  TYR  23           2HE      TYR  23  -5.668  -1.122  -3.513
  202    HE2  TYR  23           1HE      TYR  23  -6.799   0.165   0.426
  203    HH   TYR  23           HH       TYR  23  -4.712  -0.875  -0.207
  204    HB2  TYR  23           1HB      TYR  23 -10.439   0.790  -2.285
  205    HB3  TYR  23           2HB      TYR  23 -10.792  -0.871  -2.105
  206    H    MET  24           H        MET  24  -9.649  -0.172  -6.543
  207    HA   MET  24           HA       MET  24  -7.669   1.727  -6.475
  208    HB2  MET  24           1HB      MET  24  -9.017   0.448  -8.776
  209    HB3  MET  24           2HB      MET  24  -8.030   1.884  -9.058
  210    HG2  MET  24           1HG      MET  24  -7.108  -0.629  -7.690
  211    HG3  MET  24           2HG      MET  24  -6.737  -0.163  -9.352
  212    HE1  MET  24           3HE      MET  24  -4.126  -0.546  -8.708
  213    HE2  MET  24           1HE      MET  24  -3.341   0.284  -7.367
  214    HE3  MET  24           2HE      MET  24  -4.584  -0.920  -7.046
  215    H    ASP  25           H        ASP  25 -10.973   2.422  -6.658
  216    HA   ASP  25           HA       ASP  25 -10.904   5.004  -7.806
  217    HB2  ASP  25           1HB      ASP  25 -13.019   4.157  -7.278
  218    HB3  ASP  25           2HB      ASP  25 -12.580   3.889  -5.598
  219    H    CYS  26           H        CYS  26 -10.377   3.946  -4.522
  220    HA   CYS  26           HA       CYS  26  -9.856   6.605  -3.771
  221    HB2  CYS  26           1HB      CYS  26  -9.257   5.301  -1.529
  222    HB3  CYS  26           2HB      CYS  26 -10.919   5.663  -2.012
  223    H    VAL  27           H        VAL  27  -7.869   3.853  -4.575
  224    HA   VAL  27           HA       VAL  27  -5.530   5.266  -3.661
  225    HB   VAL  27           HB       VAL  27  -5.717   2.780  -5.382
  226   HG11  VAL  27          1HG1      VAL  27  -3.319   3.979  -3.976
  227   HG12  VAL  27          2HG1      VAL  27  -3.349   2.426  -4.807
  228   HG13  VAL  27          3HG1      VAL  27  -3.573   3.917  -5.720
  229   HG21  VAL  27          3HG2      VAL  27  -5.168   3.132  -2.440
  230   HG22  VAL  27          1HG2      VAL  27  -5.124   1.603  -3.316
  231   HG23  VAL  27          2HG2      VAL  27  -6.644   2.486  -3.155
  232    H    LEU  28           H        LEU  28  -6.718   4.417  -6.952
  233    HA   LEU  28           HA       LEU  28  -4.818   6.391  -8.025
  234    HG   LEU  28           HG       LEU  28  -4.302   4.124 -11.037
  235    HB2  LEU  28           1HB      LEU  28  -4.825   3.908  -8.713
  236    HB3  LEU  28           2HB      LEU  28  -6.285   4.262  -9.589
  237   HD11  LEU  28          1HD1      LEU  28  -4.562   6.169 -12.319
  238   HD12  LEU  28          2HD1      LEU  28  -5.452   6.896 -10.976
  239   HD13  LEU  28          3HD1      LEU  28  -6.115   5.494 -11.819
  240   HD21  LEU  28          3HD2      LEU  28  -2.620   4.907  -9.464
  241   HD22  LEU  28          1HD2      LEU  28  -3.293   6.535  -9.529
  242   HD23  LEU  28          2HD2      LEU  28  -2.554   5.824 -10.966
  243    H    GLY  29           H        GLY  29  -8.198   5.543  -7.940
  244    HA2  GLY  29           1HA      GLY  29  -9.890   7.309  -8.123
  245    HA3  GLY  29           2HA      GLY  29  -8.889   8.049  -9.367
  246    H    LYS  30           H        LYS  30  -9.820   4.645  -8.990
  247    HA   LYS  30           HA       LYS  30 -10.845   4.743 -11.739
  248    HB2  LYS  30           1HB      LYS  30  -9.807   2.378 -10.207
  249    HB3  LYS  30           2HB      LYS  30 -10.327   2.389 -11.892
  250    HG2  LYS  30           1HG      LYS  30  -8.516   3.982 -12.420
  251    HG3  LYS  30           2HG      LYS  30  -8.033   3.940 -10.724
  252    HD2  LYS  30           1HD      LYS  30  -6.571   2.510 -12.059
  253    HD3  LYS  30           2HD      LYS  30  -7.510   1.534 -10.939
  254    HE2  LYS  30           1HE      LYS  30  -9.059   0.955 -12.747
  255    HE3  LYS  30           2HE      LYS  30  -8.121   1.958 -13.854
  256    HZ1  LYS  30           3HZ      LYS  30  -7.191  -0.523 -12.495
  257    HZ2  LYS  30           1HZ      LYS  30  -6.222   0.473 -13.481
  258    HZ3  LYS  30           2HZ      LYS  30  -7.554  -0.294 -14.126
  259    H    GLY  31           H        GLY  31 -11.569   2.472  -9.015
  260    HA2  GLY  31           1HA      GLY  31 -14.210   1.934 -10.030
  261    HA3  GLY  31           2HA      GLY  31 -13.523   1.292  -8.549
  262    H    LYS  32           H        LYS  32 -14.945   1.765  -6.885
  263    HA   LYS  32           HA       LYS  32 -15.416   4.575  -6.441
  264    HB2  LYS  32           1HB      LYS  32 -17.852   4.220  -5.894
  265    HB3  LYS  32           2HB      LYS  32 -17.419   4.211  -7.590
  266    HG2  LYS  32           1HG      LYS  32 -17.703   1.870  -7.747
  267    HG3  LYS  32           2HG      LYS  32 -17.788   1.697  -5.990
  268    HD2  LYS  32           1HD      LYS  32 -19.884   2.815  -5.898
  269    HD3  LYS  32           2HD      LYS  32 -19.743   3.324  -7.580
  270    HE2  LYS  32           1HE      LYS  32 -19.918   0.443  -6.725
  271    HE3  LYS  32           2HE      LYS  32 -21.322   1.415  -7.168
  272    HZ1  LYS  32           3HZ      LYS  32 -20.361   1.768  -9.339
  273    HZ2  LYS  32           1HZ      LYS  32 -20.500   0.124  -9.049
  274    HZ3  LYS  32           2HZ      LYS  32 -19.000   0.881  -8.948
  275    H    CYS  33           H        CYS  33 -14.462   4.874  -4.573
  276    HA   CYS  33           HA       CYS  33 -15.183   3.180  -2.295
  277    HB2  CYS  33           1HB      CYS  33 -12.993   5.260  -2.583
  278    HB3  CYS  33           2HB      CYS  33 -13.206   4.134  -1.248
  279    H    THR  34           H        THR  34 -15.399   4.704  -0.182
  280    HA   THR  34           HA       THR  34 -17.087   6.885  -0.878
  281    HB   THR  34           HB       THR  34 -17.287   6.813   1.691
  282    HG1  THR  34           1HG      THR  34 -16.643   4.441   2.249
  283   HG21  THR  34          3HG2      THR  34 -18.052   4.375   0.058
  284   HG22  THR  34          1HG2      THR  34 -18.989   5.862   0.182
  285   HG23  THR  34          2HG2      THR  34 -18.776   4.838   1.598
  286    HA   PRO  35           HA       PRO  35 -14.121  10.171  -0.023
  287    HB2  PRO  35           1HB      PRO  35 -15.762  10.985   2.324
  288    HB3  PRO  35           2HB      PRO  35 -15.209  11.964   0.960
  289    HG2  PRO  35           1HG      PRO  35 -17.743  11.167   1.110
  290    HG3  PRO  35           2HG      PRO  35 -16.886  11.183  -0.446
  291    HD2  PRO  35           1HD      PRO  35 -17.603   8.903   1.329
  292    HD3  PRO  35           2HD      PRO  35 -17.577   8.994  -0.442
  293    H    GLU  36           H        GLU  36 -15.408   8.761   2.960
  294    HA   GLU  36           HA       GLU  36 -13.217   9.122   4.673
  295    HB2  GLU  36           1HB      GLU  36 -15.506   8.373   5.356
  296    HB3  GLU  36           2HB      GLU  36 -15.204   6.857   4.564
  297    HG2  GLU  36           1HG      GLU  36 -14.943   6.638   6.986
  298    HG3  GLU  36           2HG      GLU  36 -13.453   6.278   6.126
  299    H    GLY  37           H        GLY  37 -14.093   6.586   2.408
  300    HA2  GLY  37           1HA      GLY  37 -12.068   4.768   3.042
  301    HA3  GLY  37           2HA      GLY  37 -12.989   4.822   1.544
  302    H    LYS  38           H        LYS  38 -12.343   7.316   0.682
  303    HA   LYS  38           HA       LYS  38 -10.015   6.923  -0.737
  304    HB2  LYS  38           1HB      LYS  38 -11.624   9.362  -0.169
  305    HB3  LYS  38           2HB      LYS  38 -10.080   9.501  -0.987
  306    HG2  LYS  38           1HG      LYS  38 -10.959   7.818  -2.626
  307    HG3  LYS  38           2HG      LYS  38 -12.541   8.056  -1.896
  308    HD2  LYS  38           1HD      LYS  38 -12.702  10.274  -2.540
  309    HD3  LYS  38           2HD      LYS  38 -10.965  10.463  -2.739
  310    HE2  LYS  38           1HE      LYS  38 -12.051  10.510  -4.905
  311    HE3  LYS  38           2HE      LYS  38 -11.078   9.051  -4.760
  312    HZ1  LYS  38           3HZ      LYS  38 -14.015   9.176  -4.379
  313    HZ2  LYS  38           1HZ      LYS  38 -13.089   7.764  -4.412
  314    HZ3  LYS  38           2HZ      LYS  38 -13.242   8.684  -5.780
  315    H    GLU  39           H        GLU  39 -10.431   8.925   2.127
  316    HA   GLU  39           HA       GLU  39  -7.725   9.797   1.795
  317    HB2  GLU  39           1HB      GLU  39  -9.791  10.526   3.835
  318    HB3  GLU  39           2HB      GLU  39  -8.218  11.320   3.654
  319    HG2  GLU  39           1HG      GLU  39  -8.806  11.945   1.376
  320    HG3  GLU  39           2HG      GLU  39 -10.355  11.129   1.561
  321    H    LEU  40           H        LEU  40  -9.420   7.538   3.747
  322    HA   LEU  40           HA       LEU  40  -7.387   7.315   5.680
  323    HG   LEU  40           HG       LEU  40  -9.728   4.818   3.898
  324    HB2  LEU  40           1HB      LEU  40  -8.560   5.517   6.590
  325    HB3  LEU  40           2HB      LEU  40  -9.793   6.502   5.895
  326   HD11  LEU  40          1HD1      LEU  40  -8.495   3.071   6.052
  327   HD12  LEU  40          2HD1      LEU  40  -7.719   3.564   4.547
  328   HD13  LEU  40          3HD1      LEU  40  -9.104   2.511   4.494
  329   HD21  LEU  40          3HD2      LEU  40 -11.333   3.381   5.053
  330   HD22  LEU  40          1HD2      LEU  40 -11.613   5.092   5.383
  331   HD23  LEU  40          2HD2      LEU  40 -10.831   4.078   6.597
  332    H    LYS  41           H        LYS  41  -8.056   5.625   2.671
  333    HA   LYS  41           HA       LYS  41  -5.799   3.864   2.910
  334    HB2  LYS  41           1HB      LYS  41  -7.582   4.565   0.596
  335    HB3  LYS  41           2HB      LYS  41  -6.314   3.353   0.528
  336    HG2  LYS  41           1HG      LYS  41  -7.451   1.871   1.735
  337    HG3  LYS  41           2HG      LYS  41  -8.392   3.000   2.668
  338    HD2  LYS  41           1HD      LYS  41  -9.518   3.606   0.491
  339    HD3  LYS  41           2HD      LYS  41  -8.682   2.233  -0.221
  340    HE2  LYS  41           1HE      LYS  41 -10.884   1.540   0.362
  341    HE3  LYS  41           2HE      LYS  41  -9.788   0.815   1.534
  342    HZ1  LYS  41           3HZ      LYS  41 -11.334   3.282   1.968
  343    HZ2  LYS  41           1HZ      LYS  41 -10.391   2.471   3.122
  344    HZ3  LYS  41           2HZ      LYS  41 -11.785   1.744   2.500
  345    H    ASP  42           H        ASP  42  -6.531   6.905   1.448
  346    HA   ASP  42           HA       ASP  42  -4.479   7.356  -0.299
  347    HB2  ASP  42           1HB      ASP  42  -6.345   8.897   0.137
  348    HB3  ASP  42           2HB      ASP  42  -5.666   9.261   1.715
  349    H    HIS  43           H        HIS  43  -4.524   8.115   3.154
  350    HA   HIS  43           HA       HIS  43  -1.699   8.588   3.134
  351    HD1  HIS  43           1HD      HIS  43  -0.883  10.918   3.926
  352    HD2  HIS  43           2HD      HIS  43  -4.947  11.040   4.862
  353    HE1  HIS  43           1HE      HIS  43  -1.610  13.261   3.487
  354    HE2  HIS  43           2HE      HIS  43  -4.124  13.148   3.674
  355    HB2  HIS  43           1HB      HIS  43  -3.695   8.693   5.336
  356    HB3  HIS  43           2HB      HIS  43  -1.970   8.907   5.645
  357    H    LEU  44           H        LEU  44  -3.653   5.862   3.892
  358    HA   LEU  44           HA       LEU  44  -1.691   4.621   5.572
  359    HG   LEU  44           HG       LEU  44  -2.489   2.408   6.525
  360    HB2  LEU  44           1HB      LEU  44  -4.156   4.257   5.740
  361    HB3  LEU  44           2HB      LEU  44  -4.103   3.411   4.213
  362   HD11  LEU  44          1HD1      LEU  44  -4.448   1.041   7.171
  363   HD12  LEU  44          2HD1      LEU  44  -5.434   1.950   6.017
  364   HD13  LEU  44          3HD1      LEU  44  -4.730   2.763   7.410
  365   HD21  LEU  44          3HD2      LEU  44  -2.936   0.248   5.443
  366   HD22  LEU  44          1HD2      LEU  44  -2.179   1.379   4.322
  367   HD23  LEU  44          2HD2      LEU  44  -3.909   1.064   4.218
  368    H    GLN  45           H        GLN  45  -2.791   3.994   2.228
  369    HA   GLN  45           HA       GLN  45  -0.648   2.236   1.720
  370    HB2  GLN  45           1HB      GLN  45  -2.796   3.474   0.076
  371    HB3  GLN  45           2HB      GLN  45  -1.352   2.972  -0.785
  372    HG2  GLN  45           1HG      GLN  45  -3.086   1.239  -0.855
  373    HG3  GLN  45           2HG      GLN  45  -1.642   0.680  -0.032
  374   HE21  GLN  45          1HE2      GLN  45  -2.837  -1.014   0.915
  375   HE22  GLN  45          2HE2      GLN  45  -3.829  -0.779   2.293
  376    H    GLU  46           H        GLU  46  -1.009   5.687   1.611
  377    HA   GLU  46           HA       GLU  46   1.380   6.372   0.316
  378    HB2  GLU  46           1HB      GLU  46  -0.325   7.993   1.019
  379    HB3  GLU  46           2HB      GLU  46   0.034   7.621   2.692
  380    HG2  GLU  46           1HG      GLU  46   2.212   8.550   2.469
  381    HG3  GLU  46           2HG      GLU  46   1.933   8.910   0.762
  382    H    ALA  47           H        ALA  47   0.723   5.697   3.764
  383    HA   ALA  47           HA       ALA  47   3.229   5.978   4.893
  384    HB1  ALA  47           3HB      ALA  47   2.508   4.416   6.601
  385    HB2  ALA  47           1HB      ALA  47   1.192   5.539   6.196
  386    HB3  ALA  47           2HB      ALA  47   1.189   3.878   5.569
  387    H    LEU  48           H        LEU  48   1.904   3.346   3.114
  388    HA   LEU  48           HA       LEU  48   3.696   1.299   3.529
  389    HG   LEU  48           HG       LEU  48   2.972  -0.739   1.959
  390    HB2  LEU  48           1HB      LEU  48   1.553   1.307   2.202
  391    HB3  LEU  48           2HB      LEU  48   2.429   2.046   0.894
  392   HD11  LEU  48          1HD1      LEU  48   1.740  -1.541   0.080
  393   HD12  LEU  48          2HD1      LEU  48   1.487   0.099  -0.510
  394   HD13  LEU  48          3HD1      LEU  48   0.714  -0.423   0.984
  395   HD21  LEU  48          3HD2      LEU  48   4.193  -1.071  -0.128
  396   HD22  LEU  48          1HD2      LEU  48   4.891   0.282   0.761
  397   HD23  LEU  48          2HD2      LEU  48   3.841   0.585  -0.625
  398    H    GLU  49           H        GLU  49   4.016   3.997   1.125
  399    HA   GLU  49           HA       GLU  49   6.890   3.424   1.126
  400    HB2  GLU  49           1HB      GLU  49   5.450   2.302  -0.787
  401    HB3  GLU  49           2HB      GLU  49   5.577   3.894  -1.510
  402    HG2  GLU  49           1HG      GLU  49   7.935   2.360  -0.565
  403    HG3  GLU  49           2HG      GLU  49   7.292   2.137  -2.197
  404    H    THR  50           H        THR  50   4.369   5.643  -0.194
  405    HA   THR  50           HA       THR  50   6.299   7.566  -0.972
  406    HB   THR  50           HB       THR  50   4.088   8.815  -1.477
  407    HG1  THR  50           1HG      THR  50   2.351   7.337  -1.683
  408   HG21  THR  50          3HG2      THR  50   4.873   6.228  -2.832
  409   HG22  THR  50          1HG2      THR  50   5.464   7.845  -3.211
  410   HG23  THR  50          2HG2      THR  50   3.780   7.426  -3.530
  411    H    GLY  51           H        GLY  51   4.904   6.939   1.959
  412    HA2  GLY  51           1HA      GLY  51   5.267   9.752   2.741
  413    HA3  GLY  51           2HA      GLY  51   3.839   8.901   3.271
  414    H    CYS  52           H        CYS  52   3.905   8.024   5.155
  415    HA   CYS  52           HA       CYS  52   6.508   7.464   6.300
  416    HB2  CYS  52           1HB      CYS  52   5.835   8.634   8.422
  417    HB3  CYS  52           2HB      CYS  52   6.160   9.674   7.041
  418    H    GLU  53           H        GLU  53   6.463   5.500   6.745
  419    HA   GLU  53           HA       GLU  53   4.376   3.763   7.259
  420    HB2  GLU  53           1HB      GLU  53   7.094   3.384   8.496
  421    HB3  GLU  53           2HB      GLU  53   5.989   2.172   7.889
  422    HG2  GLU  53           1HG      GLU  53   7.741   2.191   6.366
  423    HG3  GLU  53           2HG      GLU  53   6.483   3.137   5.572
  424    H    LYS  54           H        LYS  54   6.665   5.180   9.548
  425    HA   LYS  54           HA       LYS  54   5.154   4.056  11.732
  426    HB2  LYS  54           1HB      LYS  54   7.064   4.889  13.176
  427    HB3  LYS  54           2HB      LYS  54   7.412   3.610  12.035
  428    HG2  LYS  54           1HG      LYS  54   9.264   5.123  12.086
  429    HG3  LYS  54           2HG      LYS  54   8.462   5.309  10.545
  430    HD2  LYS  54           1HD      LYS  54   9.120   7.489  11.415
  431    HD3  LYS  54           2HD      LYS  54   7.366   7.359  11.386
  432    HE2  LYS  54           1HE      LYS  54   8.175   8.443  13.438
  433    HE3  LYS  54           2HE      LYS  54   7.336   6.936  13.787
  434    HZ1  LYS  54           3HZ      LYS  54   9.463   5.861  14.139
  435    HZ2  LYS  54           1HZ      LYS  54   9.364   7.251  15.074
  436    HZ3  LYS  54           2HZ      LYS  54  10.288   7.276  13.685
  437    H    CYS  55           H        CYS  55   4.199   6.424  10.254
  438    HA   CYS  55           HA       CYS  55   4.363   8.696  11.874
  439    HB2  CYS  55           1HB      CYS  55   2.865   7.876   9.580
  440    HB3  CYS  55           2HB      CYS  55   1.898   8.889  10.635
  441    H    THR  56           H        THR  56   1.096   7.280  11.524
  442    HA   THR  56           HA       THR  56   0.739   7.796  14.356
  443    HB   THR  56           HB       THR  56  -1.679   7.500  13.833
  444    HG1  THR  56           1HG      THR  56  -2.210   7.394  11.523
  445   HG21  THR  56          3HG2      THR  56  -0.300   9.440  11.979
  446   HG22  THR  56          1HG2      THR  56  -0.667   9.739  13.676
  447   HG23  THR  56          2HG2      THR  56  -1.978   9.529  12.515
  448    H    GLU  57           H        GLU  57  -0.672   6.070  15.437
  449    HA   GLU  57           HA       GLU  57   0.489   3.565  15.118
  450    HB2  GLU  57           1HB      GLU  57  -0.481   4.134  17.230
  451    HB3  GLU  57           2HB      GLU  57  -2.058   4.385  16.497
  452    HG2  GLU  57           1HG      GLU  57  -2.347   2.082  16.124
  453    HG3  GLU  57           2HG      GLU  57  -0.662   1.738  16.504
  454    H    ALA  58           H        ALA  58  -2.465   4.960  13.940
  455    HA   ALA  58           HA       ALA  58  -3.569   2.723  12.675
  456    HB1  ALA  58           3HB      ALA  58  -4.837   4.776  13.015
  457    HB2  ALA  58           1HB      ALA  58  -3.785   5.624  11.884
  458    HB3  ALA  58           2HB      ALA  58  -4.840   4.328  11.309
  459    H    GLN  59           H        GLN  59  -1.285   5.177  11.445
  460    HA   GLN  59           HA       GLN  59  -1.118   3.952   8.897
  461    HB2  GLN  59           1HB      GLN  59   0.676   6.018  10.153
  462    HB3  GLN  59           2HB      GLN  59   0.890   5.404   8.522
  463    HG2  GLN  59           1HG      GLN  59  -1.399   6.209   7.975
  464    HG3  GLN  59           2HG      GLN  59  -1.482   6.903   9.592
  465   HE21  GLN  59          1HE2      GLN  59   1.460   6.916   7.683
  466   HE22  GLN  59          2HE2      GLN  59   1.476   8.581   7.354
  467    H    GLU  60           H        GLU  60   1.047   3.783  11.736
  468    HA   GLU  60           HA       GLU  60   2.932   2.155  10.420
  469    HB2  GLU  60           1HB      GLU  60   3.718   1.360  12.636
  470    HB3  GLU  60           2HB      GLU  60   3.537   3.103  12.568
  471    HG2  GLU  60           1HG      GLU  60   1.606   3.065  13.775
  472    HG3  GLU  60           2HG      GLU  60   1.406   1.324  13.709
  473    H    LYS  61           H        LYS  61  -0.031   1.216  12.020
  474    HA   LYS  61           HA       LYS  61   0.474  -1.595  11.727
  475    HB2  LYS  61           1HB      LYS  61  -2.184  -0.214  12.108
  476    HB3  LYS  61           2HB      LYS  61  -1.841  -1.910  12.408
  477    HG2  LYS  61           1HG      LYS  61  -0.679   0.418  13.925
  478    HG3  LYS  61           2HG      LYS  61  -2.000  -0.608  14.464
  479    HD2  LYS  61           1HD      LYS  61  -0.577  -2.477  14.670
  480    HD3  LYS  61           2HD      LYS  61   0.750  -1.661  13.830
  481    HE2  LYS  61           1HE      LYS  61   1.134  -1.705  16.235
  482    HE3  LYS  61           2HE      LYS  61   0.913  -0.058  15.661
  483    HZ1  LYS  61           3HZ      LYS  61  -0.321  -0.329  17.683
  484    HZ2  LYS  61           1HZ      LYS  61  -1.084  -1.716  17.106
  485    HZ3  LYS  61           2HZ      LYS  61  -1.434  -0.224  16.439
  486    H    GLY  62           H        GLY  62  -1.115   0.911   9.914
  487    HA2  GLY  62           1HA      GLY  62  -2.309  -0.780   7.969
  488    HA3  GLY  62           2HA      GLY  62  -2.043   0.981   7.847
  489    H    ALA  63           H        ALA  63   0.722   0.918   8.190
  490    HA   ALA  63           HA       ALA  63   1.584   0.366   5.586
  491    HB1  ALA  63           3HB      ALA  63   2.606   2.097   6.990
  492    HB2  ALA  63           1HB      ALA  63   3.242   0.847   8.059
  493    HB3  ALA  63           2HB      ALA  63   3.808   0.950   6.393
  494    H    GLU  64           H        GLU  64   1.834  -1.428   8.622
  495    HA   GLU  64           HA       GLU  64   3.749  -3.234   7.487
  496    HB2  GLU  64           1HB      GLU  64   3.675  -4.469   9.524
  497    HB3  GLU  64           2HB      GLU  64   3.686  -2.756   9.905
  498    HG2  GLU  64           1HG      GLU  64   1.355  -2.823  10.391
  499    HG3  GLU  64           2HG      GLU  64   1.266  -4.538   9.960
  500    H    THR  65           H        THR  65   0.326  -3.135   7.801
  501    HA   THR  65           HA       THR  65  -0.054  -5.840   7.032
  502    HB   THR  65           HB       THR  65  -2.390  -4.846   6.444
  503    HG1  THR  65           1HG      THR  65  -1.594  -2.837   8.224
  504   HG21  THR  65          3HG2      THR  65  -1.428  -4.888   9.307
  505   HG22  THR  65          1HG2      THR  65  -2.030  -6.274   8.383
  506   HG23  THR  65          2HG2      THR  65  -3.111  -4.934   8.769
  507    H    SER  66           H        SER  66  -0.165  -2.724   5.382
  508    HA   SER  66           HA       SER  66  -0.846  -3.860   2.939
  509    HG   SER  66           HG       SER  66  -1.500  -1.191   4.554
  510    HB2  SER  66           1HB      SER  66   0.342  -1.147   3.482
  511    HB3  SER  66           2HB      SER  66  -0.490  -1.665   2.003
  512    H    ILE  67           H        ILE  67   2.288  -2.984   4.293
  513    HA   ILE  67           HA       ILE  67   3.722  -3.532   1.922
  514    HB   ILE  67           HB       ILE  67   4.648  -3.474   4.826
  515   HG12  ILE  67          1HG1      ILE  67   5.024  -1.411   2.629
  516   HG13  ILE  67          2HG1      ILE  67   3.729  -1.358   3.817
  517   HG21  ILE  67          1HG2      ILE  67   6.182  -4.831   3.474
  518   HG22  ILE  67          2HG2      ILE  67   6.933  -3.316   3.960
  519   HG23  ILE  67          3HG2      ILE  67   6.334  -3.513   2.312
  520   HD11  ILE  67          3HD1      ILE  67   6.690  -1.115   4.365
  521   HD12  ILE  67          1HD1      ILE  67   5.414  -1.159   5.600
  522   HD13  ILE  67          2HD1      ILE  67   5.452   0.161   4.444
  523    H    ASP  68           H        ASP  68   2.720  -5.513   4.676
  524    HA   ASP  68           HA       ASP  68   4.224  -7.794   4.146
  525    HB2  ASP  68           1HB      ASP  68   3.181  -7.785   6.235
  526    HB3  ASP  68           2HB      ASP  68   1.611  -7.381   5.557
  527    H    TYR  69           H        TYR  69   0.801  -7.232   3.099
  528    HA   TYR  69           HA       TYR  69   1.121  -9.686   1.704
  529    HD1  TYR  69           1HD      TYR  69  -1.540  -9.383  -0.949
  530    HD2  TYR  69           2HD      TYR  69  -1.179 -11.277   2.831
  531    HE1  TYR  69           1HE      TYR  69  -2.182 -11.530  -1.960
  532    HE2  TYR  69           2HE      TYR  69  -1.829 -13.422   1.828
  533    HH   TYR  69           HH       TYR  69  -1.946 -13.939  -1.544
  534    HB2  TYR  69           1HB      TYR  69  -1.234  -8.870   2.662
  535    HB3  TYR  69           2HB      TYR  69  -1.334  -8.074   1.091
  536    H    LEU  70           H        LEU  70   1.273  -6.338   0.744
  537    HA   LEU  70           HA       LEU  70   1.154  -6.695  -2.043
  538    HG   LEU  70           HG       LEU  70   3.043  -4.726  -2.949
  539    HB2  LEU  70           1HB      LEU  70   1.131  -4.537  -0.688
  540    HB3  LEU  70           2HB      LEU  70   2.857  -4.745  -0.513
  541   HD11  LEU  70          1HD1      LEU  70   0.716  -5.248  -3.547
  542   HD12  LEU  70          2HD1      LEU  70   1.193  -3.708  -4.255
  543   HD13  LEU  70          3HD1      LEU  70   0.179  -3.732  -2.816
  544   HD21  LEU  70          3HD2      LEU  70   2.966  -2.331  -3.139
  545   HD22  LEU  70          1HD2      LEU  70   3.513  -2.783  -1.528
  546   HD23  LEU  70          2HD2      LEU  70   1.848  -2.228  -1.786
  547    H    ILE  71           H        ILE  71   4.018  -6.761   0.128
  548    HA   ILE  71           HA       ILE  71   5.787  -7.321  -2.011
  549    HB   ILE  71           HB       ILE  71   6.160  -7.867   0.957
  550   HG12  ILE  71          1HG1      ILE  71   5.830  -5.482   0.430
  551   HG13  ILE  71          2HG1      ILE  71   7.460  -5.799   1.004
  552   HG21  ILE  71          1HG2      ILE  71   8.573  -7.963   0.490
  553   HG22  ILE  71          2HG2      ILE  71   8.235  -7.803  -1.235
  554   HG23  ILE  71          3HG2      ILE  71   7.694  -9.235  -0.364
  555   HD11  ILE  71          3HD1      ILE  71   8.265  -5.732  -1.307
  556   HD12  ILE  71          1HD1      ILE  71   7.477  -4.225  -0.821
  557   HD13  ILE  71          2HD1      ILE  71   6.619  -5.375  -1.854
  558    H    LYS  72           H        LYS  72   3.901  -9.428   0.083
  559    HA   LYS  72           HA       LYS  72   5.341 -11.759  -0.850
  560    HB2  LYS  72           1HB      LYS  72   4.135 -13.039   0.759
  561    HB3  LYS  72           2HB      LYS  72   4.539 -11.512   1.528
  562    HG2  LYS  72           1HG      LYS  72   2.247 -10.785   0.706
  563    HG3  LYS  72           2HG      LYS  72   1.879 -12.513   0.605
  564    HD2  LYS  72           1HD      LYS  72   2.704 -10.913   3.044
  565    HD3  LYS  72           2HD      LYS  72   1.129 -11.638   2.751
  566    HE2  LYS  72           1HE      LYS  72   2.139 -13.850   2.940
  567    HE3  LYS  72           2HE      LYS  72   3.720 -13.110   3.212
  568    HZ1  LYS  72           3HZ      LYS  72   2.818 -13.608   5.346
  569    HZ2  LYS  72           1HZ      LYS  72   1.329 -12.897   4.956
  570    HZ3  LYS  72           2HZ      LYS  72   2.686 -11.937   5.136
  571    H    ASN  73           H        ASN  73   2.823  -9.990  -2.186
  572    HA   ASN  73           HA       ASN  73   2.267 -12.304  -3.921
  573    HB2  ASN  73           1HB      ASN  73   0.334 -12.256  -2.410
  574    HB3  ASN  73           2HB      ASN  73   0.030 -10.577  -2.842
  575   HD21  ASN  73          1HD2      ASN  73  -2.124 -10.974  -3.794
  576   HD22  ASN  73          2HD2      ASN  73  -2.228 -11.891  -5.226
  577    H    GLU  74           H        GLU  74   1.500  -8.818  -3.586
  578    HA   GLU  74           HA       GLU  74   1.587  -8.793  -6.482
  579    HB2  GLU  74           1HB      GLU  74  -0.647  -8.301  -5.661
  580    HB3  GLU  74           2HB      GLU  74  -0.026  -7.000  -4.660
  581    HG2  GLU  74           1HG      GLU  74  -1.136  -6.239  -6.738
  582    HG3  GLU  74           2HG      GLU  74   0.536  -5.703  -6.573
  583    H    LEU  75           H        LEU  75   3.690  -8.571  -6.504
  584    HA   LEU  75           HA       LEU  75   4.965  -6.276  -5.324
  585    HG   LEU  75           HG       LEU  75   7.649  -6.366  -6.798
  586    HB2  LEU  75           1HB      LEU  75   6.028  -8.547  -5.481
  587    HB3  LEU  75           2HB      LEU  75   6.153  -8.297  -7.210
  588   HD11  LEU  75          1HD1      LEU  75   7.479  -7.249  -3.920
  589   HD12  LEU  75          2HD1      LEU  75   6.841  -5.742  -4.577
  590   HD13  LEU  75          3HD1      LEU  75   8.575  -6.029  -4.568
  591   HD21  LEU  75          3HD2      LEU  75   9.580  -7.686  -6.043
  592   HD22  LEU  75          1HD2      LEU  75   8.607  -8.559  -7.229
  593   HD23  LEU  75          2HD2      LEU  75   8.484  -8.963  -5.518
  594    H    GLU  76           H        GLU  76   3.309  -6.900  -8.257
  595    HA   GLU  76           HA       GLU  76   4.916  -5.324 -10.012
  596    HB2  GLU  76           1HB      GLU  76   1.980  -6.009 -10.271
  597    HB3  GLU  76           2HB      GLU  76   3.063  -5.520 -11.561
  598    HG2  GLU  76           1HG      GLU  76   3.270  -8.074  -9.990
  599    HG3  GLU  76           2HG      GLU  76   2.564  -7.919 -11.592
  600    H    ILE  77           H        ILE  77   2.083  -4.828  -8.045
  601    HA   ILE  77           HA       ILE  77   1.801  -2.097  -8.839
  602    HB   ILE  77           HB       ILE  77   0.470  -3.640  -6.594
  603   HG12  ILE  77          1HG1      ILE  77  -0.471  -2.701  -9.313
  604   HG13  ILE  77          2HG1      ILE  77  -0.113  -4.360  -8.824
  605   HG21  ILE  77          1HG2      ILE  77  -1.110  -1.753  -6.386
  606   HG22  ILE  77          2HG2      ILE  77  -0.107  -0.808  -7.492
  607   HG23  ILE  77          3HG2      ILE  77   0.532  -1.303  -5.927
  608   HD11  ILE  77          3HD1      ILE  77  -1.995  -4.299  -7.289
  609   HD12  ILE  77          1HD1      ILE  77  -2.495  -3.949  -8.944
  610   HD13  ILE  77          2HD1      ILE  77  -2.336  -2.635  -7.773
  611    H    TRP  78           H        TRP  78   3.518  -3.750  -6.327
  612    HA   TRP  78           HA       TRP  78   4.186  -1.484  -4.773
  613    HD1  TRP  78           HD       TRP  78   5.335  -2.087  -1.956
  614    HE1  TRP  78           1HE      TRP  78   7.633  -1.380  -1.070
  615    HE3  TRP  78           3HE      TRP  78   8.218  -3.497  -5.937
  616    HZ2  TRP  78           2HZ      TRP  78  10.307  -1.407  -1.928
  617    HZ3  TRP  78           3HZ      TRP  78  10.635  -3.111  -5.819
  618    HH2  TRP  78           HH       TRP  78  11.658  -2.084  -3.868
  619    HB2  TRP  78           1HB      TRP  78   4.653  -3.794  -3.995
  620    HB3  TRP  78           2HB      TRP  78   5.835  -3.981  -5.285
  621    H    LYS  79           H        LYS  79   5.629  -2.971  -7.621
  622    HA   LYS  79           HA       LYS  79   7.797  -1.259  -7.995
  623    HB2  LYS  79           1HB      LYS  79   6.079  -2.696 -10.018
  624    HB3  LYS  79           2HB      LYS  79   7.548  -1.833 -10.439
  625    HG2  LYS  79           1HG      LYS  79   8.863  -3.343  -9.089
  626    HG3  LYS  79           2HG      LYS  79   7.399  -4.151  -8.524
  627    HD2  LYS  79           1HD      LYS  79   6.911  -4.952 -10.731
  628    HD3  LYS  79           2HD      LYS  79   8.211  -3.988 -11.422
  629    HE2  LYS  79           1HE      LYS  79   8.595  -6.222  -9.438
  630    HE3  LYS  79           2HE      LYS  79   8.773  -6.396 -11.183
  631    HZ1  LYS  79           3HZ      LYS  79  10.458  -4.738  -9.366
  632    HZ2  LYS  79           1HZ      LYS  79  10.517  -4.652 -11.059
  633    HZ3  LYS  79           2HZ      LYS  79  10.898  -6.077 -10.283
  634    H    GLU  80           H        GLU  80   4.427  -0.912  -8.932
  635    HA   GLU  80           HA       GLU  80   4.792   1.470 -10.395
  636    HB2  GLU  80           1HB      GLU  80   2.304   0.448  -9.038
  637    HB3  GLU  80           2HB      GLU  80   2.352   1.776 -10.186
  638    HG2  GLU  80           1HG      GLU  80   3.359   0.133 -11.824
  639    HG3  GLU  80           2HG      GLU  80   2.912  -1.121 -10.667
  640    H    LEU  81           H        LEU  81   3.921   0.922  -7.000
  641    HA   LEU  81           HA       LEU  81   3.584   3.691  -6.444
  642    HG   LEU  81           HG       LEU  81   2.183   0.895  -5.537
  643    HB2  LEU  81           1HB      LEU  81   4.277   1.582  -4.345
  644    HB3  LEU  81           2HB      LEU  81   3.580   3.145  -4.113
  645   HD11  LEU  81          1HD1      LEU  81   0.753   0.824  -3.564
  646   HD12  LEU  81          2HD1      LEU  81   1.781   2.026  -2.776
  647   HD13  LEU  81          3HD1      LEU  81   2.431   0.431  -3.176
  648   HD21  LEU  81          3HD2      LEU  81   0.195   2.354  -5.389
  649   HD22  LEU  81          1HD2      LEU  81   1.463   3.082  -6.370
  650   HD23  LEU  81          2HD2      LEU  81   1.196   3.640  -4.723
  651    H    THR  82           H        THR  82   6.332   1.519  -6.229
  652    HA   THR  82           HA       THR  82   7.988   3.463  -5.034
  653    HB   THR  82           HB       THR  82   9.870   1.939  -5.791
  654    HG1  THR  82           1HG      THR  82   7.778   0.116  -6.279
  655   HG21  THR  82          3HG2      THR  82   9.322   0.242  -4.122
  656   HG22  THR  82          1HG2      THR  82   7.646   0.800  -4.116
  657   HG23  THR  82          2HG2      THR  82   8.943   1.875  -3.562
  658    H    ALA  83           H        ALA  83   7.362   2.544  -8.377
  659    HA   ALA  83           HA       ALA  83   9.333   4.230  -9.511
  660    HB1  ALA  83           3HB      ALA  83   6.709   3.352 -10.729
  661    HB2  ALA  83           1HB      ALA  83   8.094   4.006 -11.603
  662    HB3  ALA  83           2HB      ALA  83   8.220   2.444 -10.795
  663    H    HIS  84           H        HIS  84   6.299   4.811  -8.143
  664    HA   HIS  84           HA       HIS  84   5.894   7.404  -9.275
  665    HD1  HIS  84           1HD      HIS  84   2.397   7.718  -9.239
  666    HD2  HIS  84           2HD      HIS  84   4.367   8.829  -5.752
  667    HE1  HIS  84           1HE      HIS  84   1.201   9.743  -8.398
  668    HE2  HIS  84           2HE      HIS  84   2.435  10.419  -6.310
  669    HB2  HIS  84           1HB      HIS  84   4.027   5.969  -8.448
  670    HB3  HIS  84           2HB      HIS  84   4.653   6.124  -6.820
  671    H    PHE  85           H        PHE  85   7.460   6.092  -6.388
  672    HA   PHE  85           HA       PHE  85   7.935   8.810  -5.433
  673    HD1  PHE  85           1HD      PHE  85   7.005   9.397  -2.969
  674    HD2  PHE  85           2HD      PHE  85  10.426   6.896  -2.667
  675    HE1  PHE  85           1HE      PHE  85   7.848  10.787  -1.131
  676    HE2  PHE  85           2HE      PHE  85  11.279   8.283  -0.824
  677    HZ   PHE  85           HZ       PHE  85   9.991  10.229  -0.053
  678    HB2  PHE  85           1HB      PHE  85   7.085   6.998  -3.878
  679    HB3  PHE  85           2HB      PHE  85   8.658   6.248  -4.034
  680    H    ASP  86           H        ASP  86   9.995   5.856  -5.613
  681    HA   ASP  86           HA       ASP  86  12.041   7.301  -6.992
  682    HB2  ASP  86           1HB      ASP  86  12.700   8.060  -4.819
  683    HB3  ASP  86           2HB      ASP  86  12.565   6.437  -4.143
  684    HA   PRO  87           HA       PRO  87  12.282   2.880  -8.090
  685    HB2  PRO  87           1HB      PRO  87  12.489   3.294 -10.734
  686    HB3  PRO  87           2HB      PRO  87  10.931   3.212  -9.915
  687    HG2  PRO  87           1HG      PRO  87  12.463   5.581 -10.885
  688    HG3  PRO  87           2HG      PRO  87  10.713   5.323 -10.853
  689    HD2  PRO  87           1HD      PRO  87  12.130   6.843  -9.031
  690    HD3  PRO  87           2HD      PRO  87  10.527   6.145  -8.731
  691    H    ASP  88           H        ASP  88  14.315   5.628  -8.578
  692    HA   ASP  88           HA       ASP  88  16.324   3.975  -9.982
  693    HB2  ASP  88           1HB      ASP  88  15.547   5.702 -11.380
  694    HB3  ASP  88           2HB      ASP  88  15.711   6.900 -10.107
  695    H    GLY  89           H        GLY  89  15.923   5.930  -7.093
  696    HA2  GLY  89           1HA      GLY  89  18.770   6.215  -6.760
  697    HA3  GLY  89           2HA      GLY  89  17.506   6.737  -5.651
  698    H    LYS  90           H        LYS  90  16.703   5.343  -4.196
  699    HA   LYS  90           HA       LYS  90  18.534   3.247  -3.445
  700    HB2  LYS  90           1HB      LYS  90  16.064   4.369  -2.140
  701    HB3  LYS  90           2HB      LYS  90  16.795   2.880  -1.569
  702    HG2  LYS  90           1HG      LYS  90  18.215   5.533  -1.731
  703    HG3  LYS  90           2HG      LYS  90  17.473   4.867  -0.275
  704    HD2  LYS  90           1HD      LYS  90  18.949   2.874  -0.503
  705    HD3  LYS  90           2HD      LYS  90  19.754   3.671  -1.853
  706    HE2  LYS  90           1HE      LYS  90  20.394   5.510  -0.360
  707    HE3  LYS  90           2HE      LYS  90  19.603   4.680   0.975
  708    HZ1  LYS  90           3HZ      LYS  90  21.957   3.672  -0.547
  709    HZ2  LYS  90           1HZ      LYS  90  21.153   2.823   0.663
  710    HZ3  LYS  90           2HZ      LYS  90  21.959   4.234   1.030
  711    H    TRP  91           H        TRP  91  15.050   3.294  -3.685
  712    HA   TRP  91           HA       TRP  91  13.455   1.809  -4.221
  713    HD1  TRP  91           HD       TRP  91  11.756   1.806  -6.285
  714    HE1  TRP  91           1HE      TRP  91  10.316  -0.076  -7.263
  715    HE3  TRP  91           3HE      TRP  91  15.411  -1.673  -6.970
  716    HZ2  TRP  91           2HZ      TRP  91  10.709  -2.718  -8.236
  717    HZ3  TRP  91           3HZ      TRP  91  14.804  -3.853  -7.928
  718    HH2  TRP  91           HH       TRP  91  12.504  -4.361  -8.551
  719    HB2  TRP  91           1HB      TRP  91  14.519   2.158  -6.492
  720    HB3  TRP  91           2HB      TRP  91  15.424   0.672  -6.221
  721    H    ARG  92           H        ARG  92  16.417   0.036  -4.356
  722    HA   ARG  92           HA       ARG  92  15.519  -2.494  -3.582
  723    HE   ARG  92           HE       ARG  92  18.698   0.087  -5.233
  724    HB2  ARG  92           1HB      ARG  92  18.208  -1.143  -3.550
  725    HB3  ARG  92           2HB      ARG  92  17.982  -2.849  -3.168
  726    HG2  ARG  92           1HG      ARG  92  17.492  -3.392  -5.345
  727    HG3  ARG  92           2HG      ARG  92  16.835  -1.790  -5.678
  728    HD2  ARG  92           1HD      ARG  92  19.765  -2.284  -5.227
  729    HD3  ARG  92           2HD      ARG  92  19.012  -2.371  -6.821
  730   HH11  ARG  92          1HH1      ARG  92  20.132  -1.515  -8.078
  731   HH12  ARG  92          2HH1      ARG  92  20.468  -0.049  -8.866
  732   HH21  ARG  92          1HH2      ARG  92  19.231   2.136  -6.398
  733   HH22  ARG  92          2HH2      ARG  92  19.970   1.989  -7.914
  734    H    LYS  93           H        LYS  93  16.844   0.209  -1.686
  735    HA   LYS  93           HA       LYS  93  16.954  -1.107   0.789
  736    HB2  LYS  93           1HB      LYS  93  17.947   1.154   0.458
  737    HB3  LYS  93           2HB      LYS  93  16.323   1.833   0.377
  738    HG2  LYS  93           1HG      LYS  93  15.914   1.063   2.701
  739    HG3  LYS  93           2HG      LYS  93  17.571   0.474   2.779
  740    HD2  LYS  93           1HD      LYS  93  18.355   2.799   2.350
  741    HD3  LYS  93           2HD      LYS  93  16.680   3.332   2.396
  742    HE2  LYS  93           1HE      LYS  93  18.186   2.028   4.678
  743    HE3  LYS  93           2HE      LYS  93  17.834   3.742   4.538
  744    HZ1  LYS  93           3HZ      LYS  93  15.931   1.528   5.175
  745    HZ2  LYS  93           1HZ      LYS  93  15.389   3.024   4.551
  746    HZ3  LYS  93           2HZ      LYS  93  16.241   2.961   5.957
  747    H    LYS  94           H        LYS  94  14.305   0.498  -0.842
  748    HA   LYS  94           HA       LYS  94  12.442   0.543   1.281
  749    HB2  LYS  94           1HB      LYS  94  11.897   0.153  -1.669
  750    HB3  LYS  94           2HB      LYS  94  10.752   0.742  -0.472
  751    HG2  LYS  94           1HG      LYS  94  11.998   2.777  -0.209
  752    HG3  LYS  94           2HG      LYS  94  13.287   2.167  -1.245
  753    HD2  LYS  94           1HD      LYS  94  11.732   2.069  -3.139
  754    HD3  LYS  94           2HD      LYS  94  10.441   2.651  -2.096
  755    HE2  LYS  94           1HE      LYS  94  12.967   4.188  -2.677
  756    HE3  LYS  94           2HE      LYS  94  11.443   4.414  -3.532
  757    HZ1  LYS  94           3HZ      LYS  94  11.729   6.029  -1.749
  758    HZ2  LYS  94           1HZ      LYS  94  11.830   4.803  -0.605
  759    HZ3  LYS  94           2HZ      LYS  94  10.404   5.018  -1.448
  760    H    TYR  95           H        TYR  95  13.149  -1.774  -1.239
  761    HA   TYR  95           HA       TYR  95  11.226  -3.738  -0.709
  762    HD1  TYR  95           1HD      TYR  95  10.609  -5.083  -3.037
  763    HD2  TYR  95           2HD      TYR  95  14.503  -6.296  -1.840
  764    HE1  TYR  95           1HE      TYR  95  10.114  -7.379  -3.770
  765    HE2  TYR  95           2HE      TYR  95  14.013  -8.591  -2.563
  766    HH   TYR  95           HH       TYR  95  11.488  -9.354  -4.536
  767    HB2  TYR  95           1HB      TYR  95  12.572  -3.471  -2.790
  768    HB3  TYR  95           2HB      TYR  95  13.984  -4.015  -1.913
  769    H    GLU  96           H        GLU  96  14.690  -3.659   0.172
  770    HA   GLU  96           HA       GLU  96  14.563  -6.047   1.699
  771    HB2  GLU  96           1HB      GLU  96  16.644  -3.877   1.652
  772    HB3  GLU  96           2HB      GLU  96  16.825  -5.403   2.496
  773    HG2  GLU  96           1HG      GLU  96  16.618  -6.587   0.353
  774    HG3  GLU  96           2HG      GLU  96  16.500  -5.031  -0.472
  775    H    ASP  97           H        ASP  97  14.713  -2.649   2.646
  776    HA   ASP  97           HA       ASP  97  15.076  -2.955   5.399
  777    HB2  ASP  97           1HB      ASP  97  15.342  -0.851   4.065
  778    HB3  ASP  97           2HB      ASP  97  13.597  -0.724   4.016
  779    H    ARG  98           H        ARG  98  12.071  -2.496   3.565
  780    HA   ARG  98           HA       ARG  98  10.663  -2.759   6.039
  781    HE   ARG  98           HE       ARG  98   9.478   1.576   6.087
  782    HB2  ARG  98           1HB      ARG  98   9.624  -2.242   3.266
  783    HB3  ARG  98           2HB      ARG  98   8.584  -2.458   4.675
  784    HG2  ARG  98           1HG      ARG  98  10.698  -0.325   4.384
  785    HG3  ARG  98           2HG      ARG  98   8.948  -0.099   4.220
  786    HD2  ARG  98           1HD      ARG  98   8.605  -0.767   6.522
  787    HD3  ARG  98           2HD      ARG  98  10.308  -1.126   6.718
  788   HH11  ARG  98          1HH1      ARG  98  11.100  -0.751   8.223
  789   HH12  ARG  98          2HH1      ARG  98  11.518   0.369   9.417
  790   HH21  ARG  98          1HH2      ARG  98  10.041   3.147   7.740
  791   HH22  ARG  98          2HH2      ARG  98  10.906   2.656   9.141
  792    H    ALA  99           H        ALA  99  11.328  -4.945   3.453
  793    HA   ALA  99           HA       ALA  99   9.385  -6.836   4.295
  794    HB1  ALA  99           3HB      ALA  99  10.391  -6.929   2.072
  795    HB2  ALA  99           1HB      ALA  99  11.967  -7.248   2.792
  796    HB3  ALA  99           2HB      ALA  99  10.676  -8.438   2.940
  797    H    LYS 100           H        LYS 100  12.858  -6.448   4.973
  798    HA   LYS 100           HA       LYS 100  12.939  -8.761   6.657
  799    HB2  LYS 100           1HB      LYS 100  14.986  -6.565   6.325
  800    HB3  LYS 100           2HB      LYS 100  15.256  -8.101   7.131
  801    HG2  LYS 100           1HG      LYS 100  14.598  -7.746   4.205
  802    HG3  LYS 100           2HG      LYS 100  16.204  -8.036   4.862
  803    HD2  LYS 100           1HD      LYS 100  13.861  -9.929   5.148
  804    HD3  LYS 100           2HD      LYS 100  15.102 -10.061   3.910
  805    HE2  LYS 100           1HE      LYS 100  16.808 -10.315   5.674
  806    HE3  LYS 100           2HE      LYS 100  15.545 -10.201   6.899
  807    HZ1  LYS 100           3HZ      LYS 100  14.554 -12.196   6.028
  808    HZ2  LYS 100           1HZ      LYS 100  16.157 -12.486   6.437
  809    HZ3  LYS 100           2HZ      LYS 100  15.747 -12.322   4.819
  810    H    ALA 101           H        ALA 101  12.109  -5.485   7.200
  811    HA   ALA 101           HA       ALA 101  12.789  -5.375   9.975
  812    HB1  ALA 101           3HB      ALA 101  10.714  -3.778   8.471
  813    HB2  ALA 101           1HB      ALA 101  11.342  -3.399  10.074
  814    HB3  ALA 101           2HB      ALA 101  12.408  -3.332   8.669
  815    H    LYS 102           H        LYS 102  10.078  -6.535   8.169
  816    HA   LYS 102           HA       LYS 102   8.590  -7.034  10.623
  817    HB2  LYS 102           1HB      LYS 102   7.788  -7.126   7.727
  818    HB3  LYS 102           2HB      LYS 102   6.724  -7.572   9.054
  819    HG2  LYS 102           1HG      LYS 102   8.031  -4.888   8.776
  820    HG3  LYS 102           2HG      LYS 102   6.399  -5.261   8.218
  821    HD2  LYS 102           1HD      LYS 102   5.763  -5.864  10.521
  822    HD3  LYS 102           2HD      LYS 102   7.400  -5.520  11.070
  823    HE2  LYS 102           1HE      LYS 102   7.137  -3.184  10.486
  824    HE3  LYS 102           2HE      LYS 102   5.562  -3.523   9.794
  825    HZ1  LYS 102           3HZ      LYS 102   6.282  -3.876  12.650
  826    HZ2  LYS 102           1HZ      LYS 102   4.746  -4.137  11.984
  827    HZ3  LYS 102           2HZ      LYS 102   5.431  -2.580  12.022
  828    H    GLY 103           H        GLY 103   9.843  -8.745   7.797
  829    HA2  GLY 103           1HA      GLY 103  10.862 -10.929   8.586
  830    HA3  GLY 103           2HA      GLY 103   9.270 -11.226   9.269
  831    H    ILE 104           H        ILE 104   9.538  -9.596   6.219
  832    HA   ILE 104           HA       ILE 104   8.282 -11.865   4.931
  833    HB   ILE 104           HB       ILE 104   8.995  -9.111   3.839
  834   HG12  ILE 104          1HG1      ILE 104   7.244  -8.814   5.464
  835   HG13  ILE 104          2HG1      ILE 104   6.518  -8.725   3.860
  836   HG21  ILE 104          1HG2      ILE 104   7.587  -9.633   1.926
  837   HG22  ILE 104          2HG2      ILE 104   7.269 -11.233   2.579
  838   HG23  ILE 104          3HG2      ILE 104   8.902 -10.802   2.069
  839   HD11  ILE 104          3HD1      ILE 104   5.121  -9.981   5.359
  840   HD12  ILE 104          1HD1      ILE 104   6.439 -11.114   5.668
  841   HD13  ILE 104          2HD1      ILE 104   5.731 -10.998   4.054
  842    H    VAL 105           H        VAL 105   9.405 -13.233   3.702
  843    HA   VAL 105           HA       VAL 105  12.236 -12.659   3.491
  844    HB   VAL 105           HB       VAL 105  11.624 -14.756   4.638
  845   HG11  VAL 105          1HG1      VAL 105  10.772 -16.675   3.405
  846   HG12  VAL 105          2HG1      VAL 105   9.609 -15.354   3.527
  847   HG13  VAL 105          3HG1      VAL 105  10.481 -15.622   2.019
  848   HG21  VAL 105          3HG2      VAL 105  13.126 -16.274   3.402
  849   HG22  VAL 105          1HG2      VAL 105  13.779 -14.646   3.604
  850   HG23  VAL 105          2HG2      VAL 105  13.098 -15.134   2.056
  851    H    ILE 106           H        ILE 106  13.236 -12.398   1.638
  852    HA   ILE 106           HA       ILE 106  11.791 -12.698  -0.882
  853    HB   ILE 106           HB       ILE 106  12.395 -10.427  -1.583
  854   HG12  ILE 106          1HG1      ILE 106  14.426 -10.127  -0.112
  855   HG13  ILE 106          2HG1      ILE 106  13.386  -8.723  -0.169
  856   HG21  ILE 106          1HG2      ILE 106  10.862  -9.090  -0.261
  857   HG22  ILE 106          2HG2      ILE 106  10.814 -10.376   0.945
  858   HG23  ILE 106          3HG2      ILE 106  10.215 -10.677  -0.686
  859   HD11  ILE 106          3HD1      ILE 106  14.226  -9.056   2.046
  860   HD12  ILE 106          1HD1      ILE 106  13.606 -10.709   2.078
  861   HD13  ILE 106          2HD1      ILE 106  12.486  -9.350   2.022
  862    HA   PRO 107           HA       PRO 107  16.014 -13.494  -2.414
  863    HB2  PRO 107           1HB      PRO 107  16.141 -11.596  -4.481
  864    HB3  PRO 107           2HB      PRO 107  15.569 -13.257  -4.675
  865    HG2  PRO 107           1HG      PRO 107  14.013 -10.740  -4.293
  866    HG3  PRO 107           2HG      PRO 107  13.635 -12.147  -5.300
  867    HD2  PRO 107           1HD      PRO 107  12.374 -11.760  -2.990
  868    HD3  PRO 107           2HD      PRO 107  12.869 -13.384  -3.490
  869    H    GLU 108           H        GLU 108  17.406 -12.714  -0.938
  870    HA   GLU 108           HA       GLU 108  17.654  -9.822  -0.651
  871    HB2  GLU 108           1HB      GLU 108  18.379 -10.409   1.740
  872    HB3  GLU 108           2HB      GLU 108  16.675 -10.552   1.334
  873    HG2  GLU 108           1HG      GLU 108  16.962 -12.972   1.032
  874    HG3  GLU 108           2HG      GLU 108  18.653 -12.826   1.495
  Start of MODEL    4
    1    HA   TYR   1           HA       TYR   1 -21.511   1.857   1.256
    2    HD1  TYR   1           1HD      TYR   1 -23.994   1.916   0.200
    3    HD2  TYR   1           2HD      TYR   1 -22.154  -1.618  -1.270
    4    HE1  TYR   1           1HE      TYR   1 -25.111   2.242  -1.971
    5    HE2  TYR   1           2HE      TYR   1 -23.249  -1.299  -3.434
    6    HH   TYR   1           HH       TYR   1 -24.878   1.597  -4.272
    7    H1   TYR   1           1HT      TYR   1 -20.383   0.958  -0.648
    8    H2   TYR   1           2HT      TYR   1 -19.640  -0.221   0.326
    9    H3   TYR   1           3HT      TYR   1 -19.339   1.423   0.595
   10    HB2  TYR   1           1HB      TYR   1 -21.995  -1.125   0.979
   11    HB3  TYR   1           2HB      TYR   1 -23.091   0.014   1.720
   12    H    THR   2           H        THR   2 -20.599  -1.445   2.398
   13    HA   THR   2           HA       THR   2 -20.367  -0.254   5.060
   14    HB   THR   2           HB       THR   2 -20.686  -2.679   5.774
   15    HG1  THR   2           1HG      THR   2 -20.344  -3.803   3.868
   16   HG21  THR   2          3HG2      THR   2 -22.908  -1.309   4.241
   17   HG22  THR   2          1HG2      THR   2 -22.435  -0.948   5.901
   18   HG23  THR   2          2HG2      THR   2 -23.110  -2.524   5.504
   19    H    ASP   3           H        ASP   3 -18.664  -2.219   2.725
   20    HA   ASP   3           HA       ASP   3 -16.218  -2.122   4.149
   21    HB2  ASP   3           1HB      ASP   3 -15.986  -4.500   4.578
   22    HB3  ASP   3           2HB      ASP   3 -17.438  -3.936   5.397
   23    H    LYS   4           H        LYS   4 -14.612  -3.107   2.887
   24    HA   LYS   4           HA       LYS   4 -13.485  -3.508   1.054
   25    HB2  LYS   4           1HB      LYS   4 -16.018  -4.799   0.094
   26    HB3  LYS   4           2HB      LYS   4 -14.501  -4.866  -0.804
   27    HG2  LYS   4           1HG      LYS   4 -13.416  -5.965   1.005
   28    HG3  LYS   4           2HG      LYS   4 -14.848  -5.776   2.018
   29    HD2  LYS   4           1HD      LYS   4 -16.097  -7.129   0.358
   30    HD3  LYS   4           2HD      LYS   4 -14.555  -7.406  -0.464
   31    HE2  LYS   4           1HE      LYS   4 -15.274  -9.210   1.202
   32    HE3  LYS   4           2HE      LYS   4 -13.643  -8.560   1.379
   33    HZ1  LYS   4           3HZ      LYS   4 -15.004  -8.765   3.489
   34    HZ2  LYS   4           1HZ      LYS   4 -15.925  -7.452   2.955
   35    HZ3  LYS   4           2HZ      LYS   4 -14.245  -7.315   3.225
   36    H    TYR   5           H        TYR   5 -12.878  -2.767  -0.923
   37    HA   TYR   5           HA       TYR   5 -12.349  -1.068  -2.215
   38    HD1  TYR   5           2HD      TYR   5 -16.323   0.643  -2.749
   39    HD2  TYR   5           1HD      TYR   5 -15.483  -3.456  -3.516
   40    HE1  TYR   5           2HE      TYR   5 -18.679   0.116  -2.443
   41    HE2  TYR   5           1HE      TYR   5 -17.871  -3.994  -3.210
   42    HH   TYR   5           HH       TYR   5 -20.262  -1.613  -3.136
   43    HB2  TYR   5           1HB      TYR   5 -14.170  -0.036  -3.725
   44    HB3  TYR   5           2HB      TYR   5 -13.784  -1.663  -4.032
   45    H    ASP   6           H        ASP   6 -15.169  -0.177  -0.675
   46    HA   ASP   6           HA       ASP   6 -15.362   2.538  -0.737
   47    HB2  ASP   6           1HB      ASP   6 -16.996   0.847   0.030
   48    HB3  ASP   6           2HB      ASP   6 -16.035   0.591   1.464
   49    H    LYS   7           H        LYS   7 -14.001   0.521   1.837
   50    HA   LYS   7           HA       LYS   7 -12.691   2.909   2.753
   51    HB2  LYS   7           1HB      LYS   7 -13.558   2.565   5.100
   52    HB3  LYS   7           2HB      LYS   7 -14.774   2.925   3.884
   53    HG2  LYS   7           1HG      LYS   7 -15.454   0.647   3.794
   54    HG3  LYS   7           2HG      LYS   7 -14.183   0.187   4.932
   55    HD2  LYS   7           1HD      LYS   7 -16.137   0.328   6.236
   56    HD3  LYS   7           2HD      LYS   7 -15.275   1.823   6.562
   57    HE2  LYS   7           1HE      LYS   7 -17.636   1.499   4.683
   58    HE3  LYS   7           2HE      LYS   7 -17.717   2.161   6.305
   59    HZ1  LYS   7           3HZ      LYS   7 -16.142   3.993   5.384
   60    HZ2  LYS   7           1HZ      LYS   7 -17.727   3.958   4.805
   61    HZ3  LYS   7           2HZ      LYS   7 -16.553   3.337   3.863
   62    H    ILE   8           H        ILE   8 -12.307   1.335   5.399
   63    HA   ILE   8           HA       ILE   8  -9.595   0.718   5.286
   64    HB   ILE   8           HB       ILE   8 -10.025  -0.355   7.498
   65   HG12  ILE   8          1HG1      ILE   8 -12.889   0.470   6.982
   66   HG13  ILE   8          2HG1      ILE   8 -12.332  -1.189   6.846
   67   HG21  ILE   8          1HG2      ILE   8 -11.247   2.362   7.025
   68   HG22  ILE   8          2HG2      ILE   8  -9.541   2.026   7.317
   69   HG23  ILE   8          3HG2      ILE   8 -10.728   1.735   8.590
   70   HD11  ILE   8          3HD1      ILE   8 -13.440  -0.795   8.974
   71   HD12  ILE   8          1HD1      ILE   8 -12.341   0.541   9.326
   72   HD13  ILE   8          2HD1      ILE   8 -11.728  -1.109   9.242
   73    H    ASN   9           H        ASN   9 -10.798  -0.957   3.304
   74    HA   ASN   9           HA       ASN   9 -10.587  -3.672   4.418
   75    HB2  ASN   9           1HB      ASN   9 -11.704  -4.474   2.498
   76    HB3  ASN   9           2HB      ASN   9 -12.493  -2.950   2.855
   77   HD21  ASN   9          1HD2      ASN   9 -10.676  -1.044   1.573
   78   HD22  ASN   9          2HD2      ASN   9 -10.641  -1.564  -0.071
   79    H    LEU  10           H        LEU  10  -8.387  -1.952   4.109
   80    HA   LEU  10           HA       LEU  10  -6.726  -1.919   1.915
   81    HG   LEU  10           HG       LEU  10  -7.511  -0.411   4.381
   82    HB2  LEU  10           1HB      LEU  10  -5.778  -2.373   4.733
   83    HB3  LEU  10           2HB      LEU  10  -4.940  -1.583   3.427
   84   HD11  LEU  10          1HD1      LEU  10  -6.241   0.900   5.975
   85   HD12  LEU  10          2HD1      LEU  10  -4.784  -0.029   5.587
   86   HD13  LEU  10          3HD1      LEU  10  -6.145  -0.816   6.366
   87   HD21  LEU  10          3HD2      LEU  10  -6.541   0.428   2.359
   88   HD22  LEU  10          1HD2      LEU  10  -4.977   0.653   3.165
   89   HD23  LEU  10          2HD2      LEU  10  -6.373   1.619   3.664
   90    H    GLN  11           H        GLN  11  -6.784  -4.350   4.464
   91    HA   GLN  11           HA       GLN  11  -4.693  -5.847   3.267
   92    HB2  GLN  11           1HB      GLN  11  -5.056  -5.622   5.717
   93    HB3  GLN  11           2HB      GLN  11  -6.492  -6.616   5.548
   94    HG2  GLN  11           1HG      GLN  11  -4.519  -7.836   6.372
   95    HG3  GLN  11           2HG      GLN  11  -5.205  -8.497   4.890
   96   HE21  GLN  11          1HE2      GLN  11  -3.217  -5.558   4.757
   97   HE22  GLN  11          2HE2      GLN  11  -1.853  -6.292   4.070
   98    H    GLU  12           H        GLU  12  -8.176  -5.895   3.031
   99    HA   GLU  12           HA       GLU  12  -8.303  -8.635   2.183
  100    HB2  GLU  12           1HB      GLU  12 -10.362  -6.428   1.871
  101    HB3  GLU  12           2HB      GLU  12 -10.654  -8.143   1.642
  102    HG2  GLU  12           1HG      GLU  12  -9.990  -8.417   4.087
  103    HG3  GLU  12           2HG      GLU  12 -10.124  -6.664   4.199
  104    H    ILE  13           H        ILE  13  -7.663  -5.565   0.928
  105    HA   ILE  13           HA       ILE  13  -8.119  -6.069  -1.827
  106    HB   ILE  13           HB       ILE  13  -6.192  -4.132  -0.557
  107   HG12  ILE  13          1HG1      ILE  13  -8.395  -3.464   0.147
  108   HG13  ILE  13          2HG1      ILE  13  -7.916  -2.454  -1.223
  109   HG21  ILE  13          1HG2      ILE  13  -7.284  -4.312  -3.313
  110   HG22  ILE  13          2HG2      ILE  13  -5.607  -4.622  -2.830
  111   HG23  ILE  13          3HG2      ILE  13  -6.282  -2.986  -2.722
  112   HD11  ILE  13          3HD1      ILE  13 -10.175  -3.034  -1.452
  113   HD12  ILE  13          1HD1      ILE  13  -9.785  -4.744  -1.300
  114   HD13  ILE  13          2HD1      ILE  13  -9.221  -3.833  -2.707
  115    H    LEU  14           H        LEU  14  -5.106  -5.677  -0.074
  116    HA   LEU  14           HA       LEU  14  -3.290  -6.502  -1.909
  117    HG   LEU  14           HG       LEU  14  -1.296  -5.268  -0.513
  118    HB2  LEU  14           1HB      LEU  14  -3.364  -6.796   1.053
  119    HB3  LEU  14           2HB      LEU  14  -2.049  -7.424   0.090
  120   HD11  LEU  14          1HD1      LEU  14  -2.458  -3.203   0.049
  121   HD12  LEU  14          2HD1      LEU  14  -3.802  -4.124   0.725
  122   HD13  LEU  14          3HD1      LEU  14  -3.469  -4.198  -1.003
  123   HD21  LEU  14          3HD2      LEU  14  -0.782  -5.988   1.753
  124   HD22  LEU  14          1HD2      LEU  14  -2.230  -5.181   2.333
  125   HD23  LEU  14          2HD2      LEU  14  -0.928  -4.250   1.607
  126    H    GLU  15           H        GLU  15  -5.272  -8.542   0.083
  127    HA   GLU  15           HA       GLU  15  -3.810 -10.888  -0.513
  128    HB2  GLU  15           1HB      GLU  15  -4.843 -10.597   1.589
  129    HB3  GLU  15           2HB      GLU  15  -6.439 -10.420   0.871
  130    HG2  GLU  15           1HG      GLU  15  -6.427 -12.750   0.213
  131    HG3  GLU  15           2HG      GLU  15  -4.766 -12.925   0.788
  132    H    ASN  16           H        ASN  16  -6.187  -9.220  -2.351
  133    HA   ASN  16           HA       ASN  16  -6.642 -11.610  -4.036
  134    HB2  ASN  16           1HB      ASN  16  -8.854  -9.750  -3.155
  135    HB3  ASN  16           2HB      ASN  16  -9.015 -11.123  -4.233
  136   HD21  ASN  16          1HD2      ASN  16  -8.742 -10.047  -0.950
  137   HD22  ASN  16          2HD2      ASN  16  -9.105 -11.584  -0.246
  138    H    LYS  17           H        LYS  17  -5.952 -10.945  -6.064
  139    HA   LYS  17           HA       LYS  17  -5.663  -8.358  -6.915
  140    HB2  LYS  17           1HB      LYS  17  -5.682  -9.130  -9.280
  141    HB3  LYS  17           2HB      LYS  17  -4.596 -10.021  -8.241
  142    HG2  LYS  17           1HG      LYS  17  -7.324 -11.045  -8.990
  143    HG3  LYS  17           2HG      LYS  17  -5.909 -11.305 -10.004
  144    HD2  LYS  17           1HD      LYS  17  -4.769 -12.411  -8.130
  145    HD3  LYS  17           2HD      LYS  17  -6.208 -12.204  -7.133
  146    HE2  LYS  17           1HE      LYS  17  -7.463 -13.620  -8.656
  147    HE3  LYS  17           2HE      LYS  17  -6.042 -13.806  -9.683
  148    HZ1  LYS  17           3HZ      LYS  17  -6.276 -15.697  -8.210
  149    HZ2  LYS  17           1HZ      LYS  17  -6.266 -14.696  -6.850
  150    HZ3  LYS  17           2HZ      LYS  17  -4.896 -14.830  -7.810
  151    H    ARG  18           H        ARG  18  -8.666 -10.191  -7.134
  152    HA   ARG  18           HA       ARG  18  -9.990  -8.225  -8.685
  153    HE   ARG  18           HE       ARG  18 -11.948 -12.175  -4.607
  154    HB2  ARG  18           1HB      ARG  18 -12.102  -9.275  -7.989
  155    HB3  ARG  18           2HB      ARG  18 -10.931 -10.474  -8.501
  156    HG2  ARG  18           1HG      ARG  18 -10.447 -10.839  -6.019
  157    HG3  ARG  18           2HG      ARG  18 -11.843  -9.818  -5.728
  158    HD2  ARG  18           1HD      ARG  18 -13.310 -11.308  -6.874
  159    HD3  ARG  18           2HD      ARG  18 -11.956 -12.300  -7.416
  160   HH11  ARG  18          1HH1      ARG  18 -13.863 -13.622  -7.219
  161   HH12  ARG  18          2HH1      ARG  18 -14.366 -14.937  -6.257
  162   HH21  ARG  18          1HH2      ARG  18 -12.623 -13.982  -3.362
  163   HH22  ARG  18          2HH2      ARG  18 -13.645 -15.165  -4.048
  164    H    LEU  19           H        LEU  19  -9.292  -8.418  -5.297
  165    HA   LEU  19           HA       LEU  19 -11.023  -6.211  -4.759
  166    HG   LEU  19           HG       LEU  19 -11.055  -8.014  -1.473
  167    HB2  LEU  19           1HB      LEU  19  -9.172  -7.780  -2.959
  168    HB3  LEU  19           2HB      LEU  19  -9.780  -6.197  -2.535
  169   HD11  LEU  19          1HD1      LEU  19 -12.032  -5.838  -1.745
  170   HD12  LEU  19          2HD1      LEU  19 -13.257  -7.090  -1.972
  171   HD13  LEU  19          3HD1      LEU  19 -12.585  -6.256  -3.368
  172   HD21  LEU  19          3HD2      LEU  19 -11.022  -9.647  -3.323
  173   HD22  LEU  19          1HD2      LEU  19 -12.040  -8.551  -4.258
  174   HD23  LEU  19          2HD2      LEU  19 -12.663  -9.287  -2.777
  175    H    LEU  20           H        LEU  20  -7.670  -6.724  -5.552
  176    HA   LEU  20           HA       LEU  20  -6.672  -4.108  -5.072
  177    HG   LEU  20           HG       LEU  20  -4.160  -4.671  -5.316
  178    HB2  LEU  20           1HB      LEU  20  -6.036  -6.249  -7.071
  179    HB3  LEU  20           2HB      LEU  20  -5.487  -4.627  -7.450
  180   HD11  LEU  20          1HD1      LEU  20  -3.726  -6.780  -4.221
  181   HD12  LEU  20          2HD1      LEU  20  -4.900  -7.581  -5.248
  182   HD13  LEU  20          3HD1      LEU  20  -5.429  -6.358  -4.100
  183   HD21  LEU  20          3HD2      LEU  20  -3.583  -6.850  -7.298
  184   HD22  LEU  20          1HD2      LEU  20  -2.435  -6.168  -6.148
  185   HD23  LEU  20          2HD2      LEU  20  -3.112  -5.151  -7.417
  186    H    GLU  21           H        GLU  21  -8.256  -5.500  -7.794
  187    HA   GLU  21           HA       GLU  21  -8.782  -3.308  -9.362
  188    HB2  GLU  21           1HB      GLU  21 -10.308  -5.825  -8.850
  189    HB3  GLU  21           2HB      GLU  21 -10.779  -4.681 -10.086
  190    HG2  GLU  21           1HG      GLU  21  -8.130  -6.080  -9.910
  191    HG3  GLU  21           2HG      GLU  21  -9.442  -6.562 -10.980
  192    H    SER  22           H        SER  22 -10.429  -4.351  -6.402
  193    HA   SER  22           HA       SER  22 -12.707  -2.737  -6.870
  194    HG   SER  22           HG       SER  22 -12.306  -5.339  -6.376
  195    HB2  SER  22           1HB      SER  22 -11.930  -4.083  -4.210
  196    HB3  SER  22           2HB      SER  22 -13.492  -3.456  -4.700
  197    H    TYR  23           H        TYR  23  -9.904  -2.266  -4.547
  198    HA   TYR  23           HA       TYR  23 -11.043   0.401  -4.273
  199    HD1  TYR  23           1HD      TYR  23  -7.480  -0.947  -4.195
  200    HD2  TYR  23           2HD      TYR  23  -8.448   0.317  -0.242
  201    HE1  TYR  23           1HE      TYR  23  -5.114  -1.166  -3.537
  202    HE2  TYR  23           2HE      TYR  23  -6.069   0.098   0.431
  203    HH   TYR  23           HH       TYR  23  -3.592  -0.271  -1.836
  204    HB2  TYR  23           1HB      TYR  23  -9.878   0.903  -2.328
  205    HB3  TYR  23           2HB      TYR  23 -10.276  -0.753  -2.046
  206    H    MET  24           H        MET  24  -9.358  -0.758  -6.491
  207    HA   MET  24           HA       MET  24  -7.240   1.003  -6.811
  208    HB2  MET  24           1HB      MET  24  -8.697  -0.668  -8.751
  209    HB3  MET  24           2HB      MET  24  -7.796   0.693  -9.409
  210    HG2  MET  24           1HG      MET  24  -6.686  -1.489  -7.663
  211    HG3  MET  24           2HG      MET  24  -6.422  -1.308  -9.397
  212    HE1  MET  24           3HE      MET  24  -2.929  -0.433  -7.859
  213    HE2  MET  24           1HE      MET  24  -4.073  -1.627  -7.246
  214    HE3  MET  24           2HE      MET  24  -3.807  -1.471  -8.982
  215    H    ASP  25           H        ASP  25 -10.505   1.752  -6.982
  216    HA   ASP  25           HA       ASP  25 -10.592   4.027  -8.603
  217    HB2  ASP  25           1HB      ASP  25 -12.574   3.278  -7.644
  218    HB3  ASP  25           2HB      ASP  25 -11.938   3.390  -6.013
  219    H    CYS  26           H        CYS  26  -9.925   3.795  -5.178
  220    HA   CYS  26           HA       CYS  26  -9.337   6.554  -5.031
  221    HB2  CYS  26           1HB      CYS  26  -8.882   5.890  -2.593
  222    HB3  CYS  26           2HB      CYS  26 -10.512   5.741  -3.277
  223    H    VAL  27           H        VAL  27  -7.464   3.611  -5.250
  224    HA   VAL  27           HA       VAL  27  -5.050   5.046  -4.616
  225    HB   VAL  27           HB       VAL  27  -5.404   2.232  -5.678
  226   HG11  VAL  27          1HG1      VAL  27  -2.922   3.575  -4.586
  227   HG12  VAL  27          2HG1      VAL  27  -3.067   1.869  -5.006
  228   HG13  VAL  27          3HG1      VAL  27  -3.188   3.099  -6.264
  229   HG21  VAL  27          3HG2      VAL  27  -4.815   3.270  -2.908
  230   HG22  VAL  27          1HG2      VAL  27  -4.888   1.571  -3.373
  231   HG23  VAL  27          2HG2      VAL  27  -6.339   2.575  -3.455
  232    H    LEU  28           H        LEU  28  -6.256   3.533  -7.680
  233    HA   LEU  28           HA       LEU  28  -4.209   5.102  -9.083
  234    HG   LEU  28           HG       LEU  28  -4.797   4.052 -11.914
  235    HB2  LEU  28           1HB      LEU  28  -4.198   2.633  -9.325
  236    HB3  LEU  28           2HB      LEU  28  -5.783   2.730 -10.063
  237   HD11  LEU  28          1HD1      LEU  28  -2.892   5.006 -10.764
  238   HD12  LEU  28          2HD1      LEU  28  -2.353   4.081 -12.168
  239   HD13  LEU  28          3HD1      LEU  28  -2.194   3.402 -10.545
  240   HD21  LEU  28          3HD2      LEU  28  -5.109   1.646 -12.125
  241   HD22  LEU  28          1HD2      LEU  28  -3.521   1.370 -11.406
  242   HD23  LEU  28          2HD2      LEU  28  -3.652   2.166 -12.978
  243    H    GLY  29           H        GLY  29  -7.631   4.505  -8.927
  244    HA2  GLY  29           1HA      GLY  29  -9.177   6.255  -9.558
  245    HA3  GLY  29           2HA      GLY  29  -8.109   6.637 -10.908
  246    H    LYS  30           H        LYS  30  -9.491   3.556  -9.715
  247    HA   LYS  30           HA       LYS  30 -10.567   3.181 -12.433
  248    HB2  LYS  30           1HB      LYS  30  -9.577   0.970 -10.657
  249    HB3  LYS  30           2HB      LYS  30 -10.210   0.780 -12.284
  250    HG2  LYS  30           1HG      LYS  30  -8.259   2.458 -12.861
  251    HG3  LYS  30           2HG      LYS  30  -7.600   1.847 -11.344
  252    HD2  LYS  30           1HD      LYS  30  -8.342   0.214 -13.793
  253    HD3  LYS  30           2HD      LYS  30  -6.715   0.563 -13.234
  254    HE2  LYS  30           1HE      LYS  30  -7.138  -0.749 -11.212
  255    HE3  LYS  30           2HE      LYS  30  -8.780  -1.077 -11.762
  256    HZ1  LYS  30           3HZ      LYS  30  -7.366  -2.943 -12.288
  257    HZ2  LYS  30           1HZ      LYS  30  -6.272  -1.939 -13.096
  258    HZ3  LYS  30           2HZ      LYS  30  -7.818  -2.177 -13.719
  259    H    GLY  31           H        GLY  31 -11.141   1.355  -9.389
  260    HA2  GLY  31           1HA      GLY  31 -13.874   0.813 -10.150
  261    HA3  GLY  31           2HA      GLY  31 -13.095   0.303  -8.663
  262    H    LYS  32           H        LYS  32 -14.264   1.039  -6.919
  263    HA   LYS  32           HA       LYS  32 -14.768   3.864  -6.789
  264    HB2  LYS  32           1HB      LYS  32 -17.187   3.608  -6.184
  265    HB3  LYS  32           2HB      LYS  32 -16.800   3.287  -7.867
  266    HG2  LYS  32           1HG      LYS  32 -16.950   0.892  -7.471
  267    HG3  LYS  32           2HG      LYS  32 -17.237   1.178  -5.756
  268    HD2  LYS  32           1HD      LYS  32 -19.327   0.699  -6.900
  269    HD3  LYS  32           2HD      LYS  32 -19.319   2.355  -6.299
  270    HE2  LYS  32           1HE      LYS  32 -20.276   2.288  -8.523
  271    HE3  LYS  32           2HE      LYS  32 -18.741   3.142  -8.574
  272    HZ1  LYS  32           3HZ      LYS  32 -17.716   1.091  -9.451
  273    HZ2  LYS  32           1HZ      LYS  32 -18.950   1.645 -10.429
  274    HZ3  LYS  32           2HZ      LYS  32 -19.202   0.321  -9.437
  275    H    CYS  33           H        CYS  33 -13.817   4.367  -4.967
  276    HA   CYS  33           HA       CYS  33 -14.439   2.861  -2.511
  277    HB2  CYS  33           1HB      CYS  33 -12.364   5.062  -2.802
  278    HB3  CYS  33           2HB      CYS  33 -12.502   3.825  -1.549
  279    H    THR  34           H        THR  34 -14.336   4.778  -0.523
  280    HA   THR  34           HA       THR  34 -16.084   6.932  -1.410
  281    HB   THR  34           HB       THR  34 -16.293   7.181   1.170
  282    HG1  THR  34           1HG      THR  34 -15.979   4.621   1.747
  283   HG21  THR  34          3HG2      THR  34 -18.112   6.386  -0.273
  284   HG22  THR  34          1HG2      THR  34 -18.071   5.484   1.244
  285   HG23  THR  34          2HG2      THR  34 -17.431   4.759  -0.231
  286    HA   PRO  35           HA       PRO  35 -13.071  10.181  -0.685
  287    HB2  PRO  35           1HB      PRO  35 -14.405  11.636   1.337
  288    HB3  PRO  35           2HB      PRO  35 -14.491  11.931  -0.401
  289    HG2  PRO  35           1HG      PRO  35 -16.373  10.450   1.362
  290    HG3  PRO  35           2HG      PRO  35 -16.709  11.418  -0.083
  291    HD2  PRO  35           1HD      PRO  35 -16.797   8.750  -0.139
  292    HD3  PRO  35           2HD      PRO  35 -16.172   9.678  -1.517
  293    H    GLU  36           H        GLU  36 -14.559   9.025   2.378
  294    HA   GLU  36           HA       GLU  36 -12.431   9.614   4.112
  295    HB2  GLU  36           1HB      GLU  36 -13.409   8.002   5.661
  296    HB3  GLU  36           2HB      GLU  36 -14.712   8.866   4.863
  297    HG2  GLU  36           1HG      GLU  36 -15.054   6.974   3.349
  298    HG3  GLU  36           2HG      GLU  36 -13.700   6.149   4.128
  299    H    GLY  37           H        GLY  37 -13.024   6.967   1.974
  300    HA2  GLY  37           1HA      GLY  37 -10.994   5.225   2.843
  301    HA3  GLY  37           2HA      GLY  37 -11.812   5.184   1.288
  302    H    LYS  38           H        LYS  38 -11.190   7.691   0.317
  303    HA   LYS  38           HA       LYS  38  -8.652   7.169  -0.748
  304    HB2  LYS  38           1HB      LYS  38 -10.124   9.813  -0.814
  305    HB3  LYS  38           2HB      LYS  38  -8.802   9.328  -1.868
  306    HG2  LYS  38           1HG      LYS  38 -10.345   7.367  -2.471
  307    HG3  LYS  38           2HG      LYS  38 -11.628   8.377  -1.821
  308    HD2  LYS  38           1HD      LYS  38  -9.741   9.124  -4.058
  309    HD3  LYS  38           2HD      LYS  38 -11.416   8.614  -4.254
  310    HE2  LYS  38           1HE      LYS  38 -12.132  10.564  -2.961
  311    HE3  LYS  38           2HE      LYS  38 -10.446  11.061  -2.812
  312    HZ1  LYS  38           3HZ      LYS  38 -10.322  11.310  -5.190
  313    HZ2  LYS  38           1HZ      LYS  38 -11.585  12.233  -4.586
  314    HZ3  LYS  38           2HZ      LYS  38 -11.906  10.784  -5.390
  315    H    GLU  39           H        GLU  39  -9.651   9.014   2.045
  316    HA   GLU  39           HA       GLU  39  -7.240  10.525   2.206
  317    HB2  GLU  39           1HB      GLU  39  -9.266   9.900   4.345
  318    HB3  GLU  39           2HB      GLU  39  -8.034  11.146   4.411
  319    HG2  GLU  39           1HG      GLU  39  -9.162  12.298   2.554
  320    HG3  GLU  39           2HG      GLU  39 -10.420  11.061   2.592
  321    H    LEU  40           H        LEU  40  -8.671   7.710   3.803
  322    HA   LEU  40           HA       LEU  40  -6.538   7.359   5.576
  323    HG   LEU  40           HG       LEU  40  -8.791   5.053   3.605
  324    HB2  LEU  40           1HB      LEU  40  -7.645   5.459   6.332
  325    HB3  LEU  40           2HB      LEU  40  -8.905   6.523   5.805
  326   HD11  LEU  40          1HD1      LEU  40  -6.897   3.693   4.298
  327   HD12  LEU  40          2HD1      LEU  40  -8.332   2.705   4.070
  328   HD13  LEU  40          3HD1      LEU  40  -7.797   3.120   5.702
  329   HD21  LEU  40          3HD2      LEU  40 -10.538   3.608   4.543
  330   HD22  LEU  40          1HD2      LEU  40 -10.760   5.303   4.981
  331   HD23  LEU  40          2HD2      LEU  40 -10.104   4.165   6.158
  332    H    LYS  41           H        LYS  41  -7.162   5.964   2.398
  333    HA   LYS  41           HA       LYS  41  -4.989   4.107   2.547
  334    HB2  LYS  41           1HB      LYS  41  -6.586   5.056   0.178
  335    HB3  LYS  41           2HB      LYS  41  -5.495   3.671   0.206
  336    HG2  LYS  41           1HG      LYS  41  -6.872   2.427   1.535
  337    HG3  LYS  41           2HG      LYS  41  -7.708   3.847   2.164
  338    HD2  LYS  41           1HD      LYS  41  -8.608   4.207  -0.118
  339    HD3  LYS  41           2HD      LYS  41  -7.930   2.635  -0.555
  340    HE2  LYS  41           1HE      LYS  41  -9.306   1.533   1.080
  341    HE3  LYS  41           2HE      LYS  41  -9.824   3.083   1.729
  342    HZ1  LYS  41           3HZ      LYS  41 -11.475   2.034   0.215
  343    HZ2  LYS  41           1HZ      LYS  41 -10.389   2.217  -1.046
  344    HZ3  LYS  41           2HZ      LYS  41 -10.998   3.561  -0.259
  345    H    ASP  42           H        ASP  42  -5.407   7.368   1.300
  346    HA   ASP  42           HA       ASP  42  -3.063   7.545  -0.232
  347    HB2  ASP  42           1HB      ASP  42  -4.868   9.296  -0.156
  348    HB3  ASP  42           2HB      ASP  42  -4.329   9.726   1.457
  349    H    HIS  43           H        HIS  43  -3.728   8.176   3.134
  350    HA   HIS  43           HA       HIS  43  -1.029   8.884   3.779
  351    HD1  HIS  43           1HD      HIS  43  -5.046  10.054   5.508
  352    HD2  HIS  43           2HD      HIS  43  -1.203  11.440   4.759
  353    HE1  HIS  43           1HE      HIS  43  -5.276  12.502   5.140
  354    HE2  HIS  43           2HE      HIS  43  -3.054  13.103   4.180
  355    HB2  HIS  43           1HB      HIS  43  -3.354   8.225   5.599
  356    HB3  HIS  43           2HB      HIS  43  -1.792   8.792   6.163
  357    H    LEU  44           H        LEU  44  -2.939   5.926   4.158
  358    HA   LEU  44           HA       LEU  44  -0.889   4.683   5.705
  359    HG   LEU  44           HG       LEU  44  -1.537   2.375   6.576
  360    HB2  LEU  44           1HB      LEU  44  -3.280   4.302   6.097
  361    HB3  LEU  44           2HB      LEU  44  -3.407   3.524   4.540
  362   HD11  LEU  44          1HD1      LEU  44  -3.600   2.774   7.802
  363   HD12  LEU  44          2HD1      LEU  44  -3.457   1.049   7.420
  364   HD13  LEU  44          3HD1      LEU  44  -4.526   2.079   6.480
  365   HD21  LEU  44          3HD2      LEU  44  -3.321   1.185   4.418
  366   HD22  LEU  44          1HD2      LEU  44  -2.237   0.281   5.480
  367   HD23  LEU  44          2HD2      LEU  44  -1.592   1.433   4.312
  368    H    GLN  45           H        GLN  45  -2.062   4.126   2.347
  369    HA   GLN  45           HA       GLN  45  -0.009   2.262   1.902
  370    HB2  GLN  45           1HB      GLN  45  -2.058   3.542   0.195
  371    HB3  GLN  45           2HB      GLN  45  -0.598   3.057  -0.650
  372    HG2  GLN  45           1HG      GLN  45  -2.370   1.332  -0.755
  373    HG3  GLN  45           2HG      GLN  45  -0.911   0.746   0.018
  374   HE21  GLN  45          1HE2      GLN  45  -2.115  -0.981   0.992
  375   HE22  GLN  45          2HE2      GLN  45  -3.096  -0.724   2.360
  376    H    GLU  46           H        GLU  46  -0.022   5.756   1.754
  377    HA   GLU  46           HA       GLU  46   2.527   6.067   0.500
  378    HB2  GLU  46           1HB      GLU  46   1.028   7.986   0.967
  379    HB3  GLU  46           2HB      GLU  46   1.238   7.717   2.687
  380    HG2  GLU  46           1HG      GLU  46   3.642   8.187   2.429
  381    HG3  GLU  46           2HG      GLU  46   3.356   8.563   0.728
  382    H    ALA  47           H        ALA  47   1.508   5.353   3.751
  383    HA   ALA  47           HA       ALA  47   4.047   5.520   4.916
  384    HB1  ALA  47           3HB      ALA  47   3.074   4.311   6.798
  385    HB2  ALA  47           1HB      ALA  47   1.975   5.576   6.224
  386    HB3  ALA  47           2HB      ALA  47   1.675   3.887   5.805
  387    H    LEU  48           H        LEU  48   2.395   3.083   3.191
  388    HA   LEU  48           HA       LEU  48   4.119   0.895   3.673
  389    HG   LEU  48           HG       LEU  48   3.620  -1.051   1.605
  390    HB2  LEU  48           1HB      LEU  48   1.908   0.455   2.912
  391    HB3  LEU  48           2HB      LEU  48   2.061   1.560   1.578
  392   HD11  LEU  48          1HD1      LEU  48   1.278  -1.574   1.955
  393   HD12  LEU  48          2HD1      LEU  48   1.765  -1.991   0.313
  394   HD13  LEU  48          3HD1      LEU  48   0.825  -0.525   0.612
  395   HD21  LEU  48          3HD2      LEU  48   3.483  -0.808  -0.813
  396   HD22  LEU  48          1HD2      LEU  48   4.206   0.632  -0.102
  397   HD23  LEU  48          2HD2      LEU  48   2.525   0.661  -0.634
  398    H    GLU  49           H        GLU  49   3.864   3.103   0.887
  399    HA   GLU  49           HA       GLU  49   6.201   1.894  -0.332
  400    HB2  GLU  49           1HB      GLU  49   4.136   2.560  -1.599
  401    HB3  GLU  49           2HB      GLU  49   4.543   4.234  -1.292
  402    HG2  GLU  49           1HG      GLU  49   6.237   2.289  -2.837
  403    HG3  GLU  49           2HG      GLU  49   5.135   3.445  -3.575
  404    H    THR  50           H        THR  50   5.288   5.251   0.207
  405    HA   THR  50           HA       THR  50   7.818   6.310  -0.135
  406    HB   THR  50           HB       THR  50   5.473   7.441   1.395
  407    HG1  THR  50           1HG      THR  50   5.948   6.860  -1.297
  408   HG21  THR  50          3HG2      THR  50   7.660   8.803  -0.215
  409   HG22  THR  50          1HG2      THR  50   7.561   8.772   1.547
  410   HG23  THR  50          2HG2      THR  50   6.326   9.608   0.614
  411    H    GLY  51           H        GLY  51   6.254   4.923   2.568
  412    HA2  GLY  51           1HA      GLY  51   7.358   3.947   4.373
  413    HA3  GLY  51           2HA      GLY  51   8.776   4.911   3.984
  414    H    CYS  52           H        CYS  52   5.737   4.849   5.580
  415    HA   CYS  52           HA       CYS  52   6.783   7.038   7.185
  416    HB2  CYS  52           1HB      CYS  52   5.008   8.054   5.832
  417    HB3  CYS  52           2HB      CYS  52   3.871   6.822   6.369
  418    H    GLU  53           H        GLU  53   7.572   5.519   8.561
  419    HA   GLU  53           HA       GLU  53   5.730   3.749   9.948
  420    HB2  GLU  53           1HB      GLU  53   7.713   2.880  11.019
  421    HB3  GLU  53           2HB      GLU  53   8.097   3.123   9.327
  422    HG2  GLU  53           1HG      GLU  53   8.938   5.468  10.288
  423    HG3  GLU  53           2HG      GLU  53   9.124   4.477  11.731
  424    H    LYS  54           H        LYS  54   6.738   6.872  10.065
  425    HA   LYS  54           HA       LYS  54   6.532   7.336  12.916
  426    HB2  LYS  54           1HB      LYS  54   6.965   9.685  12.286
  427    HB3  LYS  54           2HB      LYS  54   8.204   8.581  11.695
  428    HG2  LYS  54           1HG      LYS  54   7.516   8.788   9.492
  429    HG3  LYS  54           2HG      LYS  54   5.909   9.362   9.945
  430    HD2  LYS  54           1HD      LYS  54   6.857  11.422  10.742
  431    HD3  LYS  54           2HD      LYS  54   8.484  10.867  10.326
  432    HE2  LYS  54           1HE      LYS  54   7.934  10.856   7.989
  433    HE3  LYS  54           2HE      LYS  54   6.234  11.159   8.330
  434    HZ1  LYS  54           3HZ      LYS  54   8.432  13.035   8.988
  435    HZ2  LYS  54           1HZ      LYS  54   6.777  13.302   9.163
  436    HZ3  LYS  54           2HZ      LYS  54   7.445  13.160   7.614
  437    H    CYS  55           H        CYS  55   4.335   6.737  10.664
  438    HA   CYS  55           HA       CYS  55   2.599   8.960  10.898
  439    HB2  CYS  55           1HB      CYS  55   2.372   6.252   9.671
  440    HB3  CYS  55           2HB      CYS  55   0.906   7.179   9.940
  441    H    THR  56           H        THR  56   0.130   8.194  11.470
  442    HA   THR  56           HA       THR  56   0.126   8.035  14.307
  443    HB   THR  56           HB       THR  56  -2.290   7.680  12.535
  444    HG1  THR  56           1HG      THR  56  -0.625   9.954  12.928
  445   HG21  THR  56          3HG2      THR  56  -1.761   9.313  15.041
  446   HG22  THR  56          1HG2      THR  56  -2.540   7.731  15.017
  447   HG23  THR  56          2HG2      THR  56  -3.320   9.107  14.242
  448    H    GLU  57           H        GLU  57  -1.050   6.363  15.551
  449    HA   GLU  57           HA       GLU  57   0.069   3.927  15.454
  450    HB2  GLU  57           1HB      GLU  57  -1.202   4.832  17.329
  451    HB3  GLU  57           2HB      GLU  57  -2.700   4.452  16.488
  452    HG2  GLU  57           1HG      GLU  57  -2.025   2.072  16.494
  453    HG3  GLU  57           2HG      GLU  57  -0.622   2.515  17.461
  454    H    ALA  58           H        ALA  58  -3.189   4.497  14.069
  455    HA   ALA  58           HA       ALA  58  -3.419   1.751  13.268
  456    HB1  ALA  58           3HB      ALA  58  -5.413   3.140  13.712
  457    HB2  ALA  58           1HB      ALA  58  -5.050   4.085  12.264
  458    HB3  ALA  58           2HB      ALA  58  -5.458   2.382  12.121
  459    H    GLN  59           H        GLN  59  -2.281   4.631  11.823
  460    HA   GLN  59           HA       GLN  59  -2.186   3.618   9.157
  461    HB2  GLN  59           1HB      GLN  59  -0.808   5.973  10.412
  462    HB3  GLN  59           2HB      GLN  59  -0.731   5.577   8.701
  463    HG2  GLN  59           1HG      GLN  59  -3.140   5.877   8.523
  464    HG3  GLN  59           2HG      GLN  59  -3.226   6.248  10.243
  465   HE21  GLN  59          1HE2      GLN  59  -0.591   7.339   8.197
  466   HE22  GLN  59          2HE2      GLN  59  -1.020   9.000   8.248
  467    H    GLU  60           H        GLU  60   0.190   3.959  11.777
  468    HA   GLU  60           HA       GLU  60   2.311   3.079  10.189
  469    HB2  GLU  60           1HB      GLU  60   3.580   2.712  12.341
  470    HB3  GLU  60           2HB      GLU  60   2.870   4.307  12.176
  471    HG2  GLU  60           1HG      GLU  60   1.171   3.818  13.715
  472    HG3  GLU  60           2HG      GLU  60   1.524   2.100  13.705
  473    H    LYS  61           H        LYS  61   0.119   1.422  12.389
  474    HA   LYS  61           HA       LYS  61   1.273  -1.160  12.285
  475    HB2  LYS  61           1HB      LYS  61  -0.289  -0.338  14.038
  476    HB3  LYS  61           2HB      LYS  61  -1.566  -0.308  12.835
  477    HG2  LYS  61           1HG      LYS  61  -1.434  -2.731  12.616
  478    HG3  LYS  61           2HG      LYS  61  -0.115  -2.775  13.788
  479    HD2  LYS  61           1HD      LYS  61  -2.191  -3.350  14.905
  480    HD3  LYS  61           2HD      LYS  61  -1.634  -1.779  15.481
  481    HE2  LYS  61           1HE      LYS  61  -3.217  -0.688  13.896
  482    HE3  LYS  61           2HE      LYS  61  -3.788  -2.291  13.432
  483    HZ1  LYS  61           3HZ      LYS  61  -4.463  -2.620  15.766
  484    HZ2  LYS  61           1HZ      LYS  61  -5.248  -1.332  15.002
  485    HZ3  LYS  61           2HZ      LYS  61  -4.019  -1.008  16.088
  486    H    GLY  62           H        GLY  62  -1.475   0.358  10.604
  487    HA2  GLY  62           1HA      GLY  62  -2.061  -1.833   8.967
  488    HA3  GLY  62           2HA      GLY  62  -2.534  -0.137   8.685
  489    H    ALA  63           H        ALA  63   0.266   0.749   8.672
  490    HA   ALA  63           HA       ALA  63   0.884   0.561   5.965
  491    HB1  ALA  63           3HB      ALA  63   3.046   1.529   6.534
  492    HB2  ALA  63           1HB      ALA  63   1.755   2.330   7.432
  493    HB3  ALA  63           2HB      ALA  63   2.780   1.146   8.236
  494    H    GLU  64           H        GLU  64   2.434  -1.052   8.741
  495    HA   GLU  64           HA       GLU  64   4.068  -2.585   7.037
  496    HB2  GLU  64           1HB      GLU  64   4.569  -4.013   9.025
  497    HB3  GLU  64           2HB      GLU  64   4.879  -2.294   9.208
  498    HG2  GLU  64           1HG      GLU  64   3.055  -1.990  10.559
  499    HG3  GLU  64           2HG      GLU  64   2.372  -3.592  10.213
  500    H    THR  65           H        THR  65   0.902  -3.299   8.375
  501    HA   THR  65           HA       THR  65   0.686  -6.010   7.440
  502    HB   THR  65           HB       THR  65  -1.463  -3.882   7.673
  503    HG1  THR  65           1HG      THR  65   0.060  -5.122   9.627
  504   HG21  THR  65          3HG2      THR  65  -2.178  -5.984   6.620
  505   HG22  THR  65          1HG2      THR  65  -2.937  -5.759   8.192
  506   HG23  THR  65          2HG2      THR  65  -1.589  -6.891   8.023
  507    H    SER  66           H        SER  66   0.105  -2.941   5.868
  508    HA   SER  66           HA       SER  66  -0.714  -4.180   3.520
  509    HG   SER  66           HG       SER  66  -1.386  -1.458   5.131
  510    HB2  SER  66           1HB      SER  66   0.335  -1.380   3.932
  511    HB3  SER  66           2HB      SER  66  -0.586  -1.958   2.531
  512    H    ILE  67           H        ILE  67   2.417  -3.053   4.673
  513    HA   ILE  67           HA       ILE  67   3.915  -3.471   2.338
  514    HB   ILE  67           HB       ILE  67   4.730  -3.677   5.257
  515   HG12  ILE  67          1HG1      ILE  67   5.150  -1.448   3.245
  516   HG13  ILE  67          2HG1      ILE  67   3.924  -1.458   4.503
  517   HG21  ILE  67          1HG2      ILE  67   6.558  -3.541   2.861
  518   HG22  ILE  67          2HG2      ILE  67   6.293  -4.954   3.879
  519   HG23  ILE  67          3HG2      ILE  67   7.052  -3.516   4.557
  520   HD11  ILE  67          3HD1      ILE  67   5.791  -0.062   5.118
  521   HD12  ILE  67          1HD1      ILE  67   6.906  -1.421   4.906
  522   HD13  ILE  67          2HD1      ILE  67   5.698  -1.461   6.199
  523    H    ASP  68           H        ASP  68   3.111  -5.629   5.010
  524    HA   ASP  68           HA       ASP  68   4.590  -7.865   4.347
  525    HB2  ASP  68           1HB      ASP  68   3.524  -7.801   6.479
  526    HB3  ASP  68           2HB      ASP  68   1.935  -7.613   5.753
  527    H    TYR  69           H        TYR  69   1.152  -7.304   3.471
  528    HA   TYR  69           HA       TYR  69   1.337  -9.755   2.005
  529    HD1  TYR  69           2HD      TYR  69  -1.246  -9.839  -0.334
  530    HD2  TYR  69           1HD      TYR  69  -1.173 -10.935   3.776
  531    HE1  TYR  69           2HE      TYR  69  -2.078 -12.084  -0.908
  532    HE2  TYR  69           1HE      TYR  69  -2.011 -13.164   3.205
  533    HH   TYR  69           HH       TYR  69  -3.143 -14.289   1.523
  534    HB2  TYR  69           1HB      TYR  69  -0.878  -8.716   3.183
  535    HB3  TYR  69           2HB      TYR  69  -1.093  -8.143   1.537
  536    H    LEU  70           H        LEU  70   1.424  -6.366   1.089
  537    HA   LEU  70           HA       LEU  70   0.969  -6.864  -1.670
  538    HG   LEU  70           HG       LEU  70   2.368  -4.833  -2.926
  539    HB2  LEU  70           1HB      LEU  70   0.790  -4.644  -0.423
  540    HB3  LEU  70           2HB      LEU  70   2.539  -4.594  -0.502
  541   HD11  LEU  70          1HD1      LEU  70  -0.568  -4.362  -2.397
  542   HD12  LEU  70          2HD1      LEU  70   0.154  -5.771  -3.174
  543   HD13  LEU  70          3HD1      LEU  70   0.159  -4.218  -3.989
  544   HD21  LEU  70          3HD2      LEU  70   1.055  -2.392  -1.732
  545   HD22  LEU  70          1HD2      LEU  70   1.758  -2.470  -3.348
  546   HD23  LEU  70          2HD2      LEU  70   2.788  -2.663  -1.930
  547    H    ILE  71           H        ILE  71   3.973  -6.732   0.226
  548    HA   ILE  71           HA       ILE  71   5.502  -7.026  -2.154
  549    HB   ILE  71           HB       ILE  71   6.353  -7.551   0.718
  550   HG12  ILE  71          1HG1      ILE  71   6.786  -5.163  -1.093
  551   HG13  ILE  71          2HG1      ILE  71   5.724  -5.221   0.308
  552   HG21  ILE  71          1HG2      ILE  71   8.055  -7.278  -1.771
  553   HG22  ILE  71          2HG2      ILE  71   7.792  -8.762  -0.859
  554   HG23  ILE  71          3HG2      ILE  71   8.665  -7.420  -0.122
  555   HD11  ILE  71          3HD1      ILE  71   8.723  -5.465   0.336
  556   HD12  ILE  71          1HD1      ILE  71   7.671  -5.553   1.757
  557   HD13  ILE  71          2HD1      ILE  71   7.772  -4.054   0.823
  558    H    LYS  72           H        LYS  72   4.095  -9.296   0.126
  559    HA   LYS  72           HA       LYS  72   5.595 -11.470  -0.991
  560    HB2  LYS  72           1HB      LYS  72   4.598 -12.871   0.629
  561    HB3  LYS  72           2HB      LYS  72   4.820 -11.321   1.416
  562    HG2  LYS  72           1HG      LYS  72   2.331 -10.950   0.672
  563    HG3  LYS  72           2HG      LYS  72   2.312 -12.707   0.600
  564    HD2  LYS  72           1HD      LYS  72   2.936 -10.976   2.999
  565    HD3  LYS  72           2HD      LYS  72   1.551 -12.035   2.790
  566    HE2  LYS  72           1HE      LYS  72   3.041 -13.985   2.870
  567    HE3  LYS  72           2HE      LYS  72   4.430 -12.913   3.033
  568    HZ1  LYS  72           3HZ      LYS  72   2.212 -13.242   4.967
  569    HZ2  LYS  72           1HZ      LYS  72   3.423 -12.080   5.152
  570    HZ3  LYS  72           2HZ      LYS  72   3.787 -13.724   5.183
  571    H    ASN  73           H        ASN  73   2.500 -10.026  -1.684
  572    HA   ASN  73           HA       ASN  73   1.733 -12.383  -3.259
  573    HB2  ASN  73           1HB      ASN  73   0.047 -11.487  -1.705
  574    HB3  ASN  73           2HB      ASN  73   0.062  -9.962  -2.579
  575   HD21  ASN  73          1HD2      ASN  73  -2.147 -10.135  -3.069
  576   HD22  ASN  73          2HD2      ASN  73  -2.703 -11.241  -4.262
  577    H    GLU  74           H        GLU  74   1.789  -8.799  -3.794
  578    HA   GLU  74           HA       GLU  74   2.718  -9.312  -6.459
  579    HB2  GLU  74           1HB      GLU  74   0.237  -9.438  -6.759
  580    HB3  GLU  74           2HB      GLU  74   0.092  -7.807  -6.129
  581    HG2  GLU  74           1HG      GLU  74   1.337  -6.918  -8.007
  582    HG3  GLU  74           2HG      GLU  74   1.629  -8.540  -8.623
  583    H    LEU  75           H        LEU  75   4.472  -8.353  -5.608
  584    HA   LEU  75           HA       LEU  75   4.616  -5.745  -4.640
  585    HG   LEU  75           HG       LEU  75   6.533  -8.639  -6.120
  586    HB2  LEU  75           1HB      LEU  75   7.074  -5.829  -5.162
  587    HB3  LEU  75           2HB      LEU  75   6.465  -7.097  -4.130
  588   HD11  LEU  75          1HD1      LEU  75   8.038  -6.383  -7.429
  589   HD12  LEU  75          2HD1      LEU  75   6.470  -7.016  -7.925
  590   HD13  LEU  75          3HD1      LEU  75   7.907  -8.032  -8.043
  591   HD21  LEU  75          3HD2      LEU  75   9.130  -7.355  -5.306
  592   HD22  LEU  75          1HD2      LEU  75   8.955  -8.947  -6.039
  593   HD23  LEU  75          2HD2      LEU  75   8.285  -8.632  -4.436
  594    H    GLU  76           H        GLU  76   3.891  -6.606  -7.738
  595    HA   GLU  76           HA       GLU  76   5.105  -4.627  -9.286
  596    HB2  GLU  76           1HB      GLU  76   2.443  -5.982  -9.594
  597    HB3  GLU  76           2HB      GLU  76   3.141  -4.908 -10.797
  598    HG2  GLU  76           1HG      GLU  76   4.388  -7.456  -9.810
  599    HG3  GLU  76           2HG      GLU  76   3.503  -7.258 -11.323
  600    H    ILE  77           H        ILE  77   2.307  -4.490  -7.204
  601    HA   ILE  77           HA       ILE  77   1.383  -1.940  -8.068
  602    HB   ILE  77           HB       ILE  77   1.010  -3.340  -5.426
  603   HG12  ILE  77          1HG1      ILE  77   0.223  -4.716  -7.269
  604   HG13  ILE  77          2HG1      ILE  77  -1.148  -4.119  -6.322
  605   HG21  ILE  77          1HG2      ILE  77  -0.599  -1.093  -6.655
  606   HG22  ILE  77          2HG2      ILE  77   0.449  -0.965  -5.245
  607   HG23  ILE  77          3HG2      ILE  77  -1.022  -1.936  -5.165
  608   HD11  ILE  77          3HD1      ILE  77  -0.206  -3.028  -8.975
  609   HD12  ILE  77          1HD1      ILE  77  -1.577  -2.433  -8.042
  610   HD13  ILE  77          2HD1      ILE  77  -1.607  -4.060  -8.715
  611    H    TRP  78           H        TRP  78   3.663  -3.085  -5.684
  612    HA   TRP  78           HA       TRP  78   4.162  -0.690  -4.285
  613    HD1  TRP  78           HD       TRP  78   8.007  -0.860  -4.794
  614    HE1  TRP  78           1HE      TRP  78   9.294  -0.047  -2.756
  615    HE3  TRP  78           3HE      TRP  78   4.960  -2.725  -1.141
  616    HZ2  TRP  78           2HZ      TRP  78   9.074  -0.198   0.072
  617    HZ3  TRP  78           3HZ      TRP  78   5.582  -2.350   1.204
  618    HH2  TRP  78           HH       TRP  78   7.596  -1.115   1.795
  619    HB2  TRP  78           1HB      TRP  78   4.968  -2.950  -3.554
  620    HB3  TRP  78           2HB      TRP  78   6.079  -2.973  -4.910
  621    H    LYS  79           H        LYS  79   5.688  -2.187  -7.094
  622    HA   LYS  79           HA       LYS  79   7.600  -0.283  -7.753
  623    HB2  LYS  79           1HB      LYS  79   5.943  -2.061  -9.528
  624    HB3  LYS  79           2HB      LYS  79   7.269  -1.073 -10.113
  625    HG2  LYS  79           1HG      LYS  79   8.862  -2.326  -8.861
  626    HG3  LYS  79           2HG      LYS  79   7.591  -3.167  -7.974
  627    HD2  LYS  79           1HD      LYS  79   8.632  -4.533  -9.796
  628    HD3  LYS  79           2HD      LYS  79   6.894  -4.345  -9.960
  629    HE2  LYS  79           1HE      LYS  79   7.317  -2.489 -11.572
  630    HE3  LYS  79           2HE      LYS  79   9.040  -2.862 -11.479
  631    HZ1  LYS  79           3HZ      LYS  79   8.583  -5.043 -12.358
  632    HZ2  LYS  79           1HZ      LYS  79   7.910  -3.883 -13.378
  633    HZ3  LYS  79           2HZ      LYS  79   6.922  -4.761 -12.322
  634    H    GLU  80           H        GLU  80   4.200  -0.427  -8.731
  635    HA   GLU  80           HA       GLU  80   4.234   1.859 -10.373
  636    HB2  GLU  80           1HB      GLU  80   1.967   0.528  -8.908
  637    HB3  GLU  80           2HB      GLU  80   1.770   1.810 -10.094
  638    HG2  GLU  80           1HG      GLU  80   2.851   0.361 -11.783
  639    HG3  GLU  80           2HG      GLU  80   2.942  -0.923 -10.578
  640    H    LEU  81           H        LEU  81   3.498   1.418  -6.957
  641    HA   LEU  81           HA       LEU  81   2.723   4.091  -6.500
  642    HG   LEU  81           HG       LEU  81   1.724   1.254  -5.447
  643    HB2  LEU  81           1HB      LEU  81   3.855   2.079  -4.534
  644    HB3  LEU  81           2HB      LEU  81   3.082   3.591  -4.111
  645   HD11  LEU  81          1HD1      LEU  81   0.557   1.011  -3.317
  646   HD12  LEU  81          2HD1      LEU  81   1.547   2.303  -2.628
  647   HD13  LEU  81          3HD1      LEU  81   2.301   0.788  -3.141
  648   HD21  LEU  81          3HD2      LEU  81   0.602   3.869  -4.430
  649   HD22  LEU  81          1HD2      LEU  81  -0.347   2.506  -5.019
  650   HD23  LEU  81          2HD2      LEU  81   0.721   3.372  -6.120
  651    H    THR  82           H        THR  82   5.823   2.394  -6.195
  652    HA   THR  82           HA       THR  82   7.355   4.567  -5.291
  653    HB   THR  82           HB       THR  82   8.244   2.196  -6.981
  654    HG1  THR  82           1HG      THR  82   7.987   2.622  -4.195
  655   HG21  THR  82          3HG2      THR  82   9.794   3.965  -5.083
  656   HG22  THR  82          1HG2      THR  82   9.916   3.996  -6.846
  657   HG23  THR  82          2HG2      THR  82  10.429   2.559  -5.952
  658    H    ALA  83           H        ALA  83   6.446   3.518  -8.495
  659    HA   ALA  83           HA       ALA  83   8.028   5.272  -9.994
  660    HB1  ALA  83           3HB      ALA  83   5.295   4.181 -10.637
  661    HB2  ALA  83           1HB      ALA  83   6.425   4.876 -11.796
  662    HB3  ALA  83           2HB      ALA  83   6.831   3.373 -10.960
  663    H    HIS  84           H        HIS  84   5.053   5.746  -8.275
  664    HA   HIS  84           HA       HIS  84   4.728   8.399  -9.432
  665    HD1  HIS  84           1HD      HIS  84   0.914   5.881  -8.475
  666    HD2  HIS  84           2HD      HIS  84   3.281   7.874 -11.235
  667    HE1  HIS  84           1HE      HIS  84   0.007   5.241 -10.720
  668    HE2  HIS  84           2HE      HIS  84   1.649   6.254 -12.357
  669    HB2  HIS  84           1HB      HIS  84   2.995   6.922  -7.449
  670    HB3  HIS  84           2HB      HIS  84   2.661   8.553  -8.006
  671    H    PHE  85           H        PHE  85   5.386   7.032  -6.222
  672    HA   PHE  85           HA       PHE  85   5.501   9.692  -5.114
  673    HD1  PHE  85           2HD      PHE  85   3.801  10.087  -3.127
  674    HD2  PHE  85           1HD      PHE  85   3.716   5.964  -4.170
  675    HE1  PHE  85           2HE      PHE  85   1.356  10.086  -2.911
  676    HE2  PHE  85           1HE      PHE  85   1.266   5.955  -3.955
  677    HZ   PHE  85           HZ       PHE  85   0.081   8.018  -3.322
  678    HB2  PHE  85           1HB      PHE  85   5.762   7.011  -3.784
  679    HB3  PHE  85           2HB      PHE  85   5.834   8.546  -2.935
  680    H    ASP  86           H        ASP  86   7.811   6.925  -4.906
  681    HA   ASP  86           HA       ASP  86   9.918   8.990  -4.848
  682    HB2  ASP  86           1HB      ASP  86   9.904   6.384  -3.316
  683    HB3  ASP  86           2HB      ASP  86  11.347   7.339  -3.567
  684    HA   PRO  87           HA       PRO  87  10.849   6.065  -8.306
  685    HB2  PRO  87           1HB      PRO  87  11.276   8.340 -10.054
  686    HB3  PRO  87           2HB      PRO  87  10.044   7.070 -10.154
  687    HG2  PRO  87           1HG      PRO  87   9.509   9.712  -9.562
  688    HG3  PRO  87           2HG      PRO  87   8.462   8.343  -9.160
  689    HD2  PRO  87           1HD      PRO  87  10.365   9.854  -7.439
  690    HD3  PRO  87           2HD      PRO  87   8.789   9.145  -7.025
  691    H    ASP  88           H        ASP  88  12.183   8.852  -6.963
  692    HA   ASP  88           HA       ASP  88  14.883   8.435  -7.941
  693    HB2  ASP  88           1HB      ASP  88  13.992  10.739  -7.715
  694    HB3  ASP  88           2HB      ASP  88  13.766  10.479  -5.994
  695    H    GLY  89           H        GLY  89  12.973   7.034  -5.737
  696    HA2  GLY  89           1HA      GLY  89  14.702   6.790  -3.478
  697    HA3  GLY  89           2HA      GLY  89  13.280   5.811  -3.828
  698    H    LYS  90           H        LYS  90  15.512   4.548  -2.853
  699    HA   LYS  90           HA       LYS  90  17.101   3.627  -5.038
  700    HB2  LYS  90           1HB      LYS  90  16.978   2.727  -2.188
  701    HB3  LYS  90           2HB      LYS  90  18.080   2.055  -3.379
  702    HG2  LYS  90           1HG      LYS  90  17.980   4.908  -2.433
  703    HG3  LYS  90           2HG      LYS  90  19.192   3.704  -1.999
  704    HD2  LYS  90           1HD      LYS  90  19.800   3.531  -4.414
  705    HD3  LYS  90           2HD      LYS  90  18.675   4.851  -4.743
  706    HE2  LYS  90           1HE      LYS  90  21.079   4.962  -2.955
  707    HE3  LYS  90           2HE      LYS  90  20.958   5.656  -4.571
  708    HZ1  LYS  90           3HZ      LYS  90  19.350   6.459  -2.205
  709    HZ2  LYS  90           1HZ      LYS  90  19.206   7.124  -3.737
  710    HZ3  LYS  90           2HZ      LYS  90  20.619   7.341  -2.865
  711    H    TRP  91           H        TRP  91  14.062   2.764  -4.077
  712    HA   TRP  91           HA       TRP  91  12.608   1.061  -4.621
  713    HD1  TRP  91           HD       TRP  91  14.706   3.119  -7.093
  714    HE1  TRP  91           1HE      TRP  91  13.247   4.406  -8.755
  715    HE3  TRP  91           3HE      TRP  91  11.052  -0.384  -7.801
  716    HZ2  TRP  91           2HZ      TRP  91  10.851   3.982 -10.213
  717    HZ3  TRP  91           3HZ      TRP  91   9.215   0.134  -9.357
  718    HH2  TRP  91           HH       TRP  91   9.119   2.269 -10.537
  719    HB2  TRP  91           1HB      TRP  91  14.770   0.328  -6.628
  720    HB3  TRP  91           2HB      TRP  91  13.177  -0.413  -6.573
  721    H    ARG  92           H        ARG  92  15.666  -0.586  -4.966
  722    HA   ARG  92           HA       ARG  92  14.708  -2.974  -3.792
  723    HE   ARG  92           HE       ARG  92  15.197  -3.967  -5.945
  724    HB2  ARG  92           1HB      ARG  92  16.544  -2.711  -5.517
  725    HB3  ARG  92           2HB      ARG  92  17.583  -2.203  -4.198
  726    HG2  ARG  92           1HG      ARG  92  17.850  -4.590  -4.824
  727    HG3  ARG  92           2HG      ARG  92  17.398  -4.327  -3.138
  728    HD2  ARG  92           1HD      ARG  92  16.186  -6.194  -4.387
  729    HD3  ARG  92           2HD      ARG  92  15.192  -5.057  -3.487
  730   HH11  ARG  92          1HH1      ARG  92  14.604  -7.339  -4.972
  731   HH12  ARG  92          2HH1      ARG  92  13.460  -7.614  -6.194
  732   HH21  ARG  92          1HH2      ARG  92  13.626  -4.382  -7.607
  733   HH22  ARG  92          2HH2      ARG  92  12.872  -5.902  -7.698
  734    H    LYS  93           H        LYS  93  16.409  -0.206  -2.556
  735    HA   LYS  93           HA       LYS  93  17.207  -1.351  -0.118
  736    HB2  LYS  93           1HB      LYS  93  18.149   0.786  -0.977
  737    HB3  LYS  93           2HB      LYS  93  16.594   1.547  -0.662
  738    HG2  LYS  93           1HG      LYS  93  18.222   2.065   1.082
  739    HG3  LYS  93           2HG      LYS  93  16.839   1.163   1.710
  740    HD2  LYS  93           1HD      LYS  93  18.181  -0.906   1.597
  741    HD3  LYS  93           2HD      LYS  93  19.563   0.045   1.045
  742    HE2  LYS  93           1HE      LYS  93  19.507   1.304   3.131
  743    HE3  LYS  93           2HE      LYS  93  18.109   0.374   3.660
  744    HZ1  LYS  93           3HZ      LYS  93  20.826  -0.703   3.131
  745    HZ2  LYS  93           1HZ      LYS  93  19.479  -1.636   3.532
  746    HZ3  LYS  93           2HZ      LYS  93  20.090  -0.508   4.636
  747    H    LYS  94           H        LYS  94  14.218   0.213  -1.133
  748    HA   LYS  94           HA       LYS  94  13.071   0.259   1.458
  749    HB2  LYS  94           1HB      LYS  94  11.702   0.212  -1.242
  750    HB3  LYS  94           2HB      LYS  94  10.896   0.453   0.298
  751    HG2  LYS  94           1HG      LYS  94  12.263   2.502   0.624
  752    HG3  LYS  94           2HG      LYS  94  12.871   2.292  -1.023
  753    HD2  LYS  94           1HD      LYS  94  10.632   2.437  -1.916
  754    HD3  LYS  94           2HD      LYS  94   9.954   2.490  -0.293
  755    HE2  LYS  94           1HE      LYS  94  11.224   4.631   0.061
  756    HE3  LYS  94           2HE      LYS  94  11.641   4.586  -1.655
  757    HZ1  LYS  94           3HZ      LYS  94   9.619   5.966  -1.260
  758    HZ2  LYS  94           1HZ      LYS  94   8.901   4.625  -0.546
  759    HZ3  LYS  94           2HZ      LYS  94   9.211   4.577  -2.148
  760    H    TYR  95           H        TYR  95  13.125  -2.038  -1.177
  761    HA   TYR  95           HA       TYR  95  11.344  -3.899  -0.100
  762    HD1  TYR  95           2HD      TYR  95  10.205  -5.669  -1.829
  763    HD2  TYR  95           1HD      TYR  95  12.772  -2.949  -3.850
  764    HE1  TYR  95           2HE      TYR  95   8.509  -5.374  -3.577
  765    HE2  TYR  95           1HE      TYR  95  11.090  -2.653  -5.607
  766    HH   TYR  95           HH       TYR  95   7.909  -3.632  -5.301
  767    HB2  TYR  95           1HB      TYR  95  13.606  -4.220  -2.042
  768    HB3  TYR  95           2HB      TYR  95  12.723  -5.620  -1.456
  769    H    GLU  96           H        GLU  96  14.928  -3.899   0.176
  770    HA   GLU  96           HA       GLU  96  14.941  -6.181   1.821
  771    HB2  GLU  96           1HB      GLU  96  17.241  -5.512   2.516
  772    HB3  GLU  96           2HB      GLU  96  17.013  -5.544   0.776
  773    HG2  GLU  96           1HG      GLU  96  17.015  -3.219   0.618
  774    HG3  GLU  96           2HG      GLU  96  16.760  -3.006   2.347
  775    H    ASP  97           H        ASP  97  14.757  -2.786   2.643
  776    HA   ASP  97           HA       ASP  97  15.142  -3.121   5.431
  777    HB2  ASP  97           1HB      ASP  97  15.566  -1.003   4.312
  778    HB3  ASP  97           2HB      ASP  97  13.877  -0.874   3.866
  779    H    ARG  98           H        ARG  98  12.205  -2.529   3.519
  780    HA   ARG  98           HA       ARG  98  10.614  -2.684   5.884
  781    HE   ARG  98           HE       ARG  98  10.229   1.775   4.860
  782    HB2  ARG  98           1HB      ARG  98   9.774  -2.435   3.000
  783    HB3  ARG  98           2HB      ARG  98   8.694  -2.315   4.377
  784    HG2  ARG  98           1HG      ARG  98  10.968  -0.433   3.724
  785    HG3  ARG  98           2HG      ARG  98   9.245  -0.094   3.567
  786    HD2  ARG  98           1HD      ARG  98   8.991  -0.374   6.011
  787    HD3  ARG  98           2HD      ARG  98  10.723  -0.688   6.119
  788   HH11  ARG  98          1HH1      ARG  98  10.393   0.257   8.053
  789   HH12  ARG  98          2HH1      ARG  98  10.671   1.721   8.901
  790   HH21  ARG  98          1HH2      ARG  98  10.628   3.763   6.023
  791   HH22  ARG  98          2HH2      ARG  98  10.819   3.744   7.726
  792    H    ALA  99           H        ALA  99  11.318  -4.902   3.248
  793    HA   ALA  99           HA       ALA  99   9.218  -6.680   3.995
  794    HB1  ALA  99           3HB      ALA  99  10.032  -6.636   1.717
  795    HB2  ALA  99           1HB      ALA  99  11.629  -7.133   2.251
  796    HB3  ALA  99           2HB      ALA  99  10.279  -8.250   2.378
  797    H    LYS 100           H        LYS 100  12.775  -6.754   4.459
  798    HA   LYS 100           HA       LYS 100  12.627  -9.246   5.816
  799    HB2  LYS 100           1HB      LYS 100  14.900  -7.256   5.838
  800    HB3  LYS 100           2HB      LYS 100  14.992  -8.931   6.356
  801    HG2  LYS 100           1HG      LYS 100  14.375  -8.022   3.543
  802    HG3  LYS 100           2HG      LYS 100  15.956  -8.531   4.109
  803    HD2  LYS 100           1HD      LYS 100  13.567 -10.365   4.294
  804    HD3  LYS 100           2HD      LYS 100  14.481 -10.195   2.804
  805    HE2  LYS 100           1HE      LYS 100  15.268 -12.130   3.985
  806    HE3  LYS 100           2HE      LYS 100  16.523 -10.903   4.003
  807    HZ1  LYS 100           3HZ      LYS 100  16.017 -10.437   6.296
  808    HZ2  LYS 100           1HZ      LYS 100  16.249 -12.081   6.086
  809    HZ3  LYS 100           2HZ      LYS 100  14.696 -11.510   6.268
  810    H    ALA 101           H        ALA 101  12.275  -5.952   6.916
  811    HA   ALA 101           HA       ALA 101  12.779  -6.613   9.663
  812    HB1  ALA 101           3HB      ALA 101  11.919  -4.409  10.186
  813    HB2  ALA 101           1HB      ALA 101  13.033  -4.325   8.817
  814    HB3  ALA 101           2HB      ALA 101  11.293  -4.256   8.546
  815    H    LYS 102           H        LYS 102   9.971  -6.670   7.601
  816    HA   LYS 102           HA       LYS 102   8.281  -7.088   9.949
  817    HB2  LYS 102           1HB      LYS 102   7.491  -6.729   7.068
  818    HB3  LYS 102           2HB      LYS 102   6.391  -6.805   8.443
  819    HG2  LYS 102           1HG      LYS 102   8.500  -4.708   7.985
  820    HG3  LYS 102           2HG      LYS 102   6.768  -4.540   7.707
  821    HD2  LYS 102           1HD      LYS 102   6.348  -4.859  10.119
  822    HD3  LYS 102           2HD      LYS 102   8.063  -5.139  10.390
  823    HE2  LYS 102           1HE      LYS 102   8.552  -2.828   9.690
  824    HE3  LYS 102           2HE      LYS 102   6.848  -2.563   9.395
  825    HZ1  LYS 102           3HZ      LYS 102   6.381  -2.865  11.713
  826    HZ2  LYS 102           1HZ      LYS 102   7.581  -1.704  11.563
  827    HZ3  LYS 102           2HZ      LYS 102   7.967  -3.269  12.059
  828    H    GLY 103           H        GLY 103   9.899  -8.812   7.715
  829    HA2  GLY 103           1HA      GLY 103  10.260 -11.165   8.271
  830    HA3  GLY 103           2HA      GLY 103   8.576 -11.249   8.755
  831    H    ILE 104           H        ILE 104   9.524  -9.705   5.796
  832    HA   ILE 104           HA       ILE 104   8.108 -11.794   4.354
  833    HB   ILE 104           HB       ILE 104   8.987  -9.052   3.450
  834   HG12  ILE 104          1HG1      ILE 104   7.219  -8.905   5.071
  835   HG13  ILE 104          2HG1      ILE 104   6.577  -8.521   3.476
  836   HG21  ILE 104          1HG2      ILE 104   7.606  -9.455   1.446
  837   HG22  ILE 104          2HG2      ILE 104   7.238 -11.076   2.033
  838   HG23  ILE 104          3HG2      ILE 104   8.890 -10.663   1.580
  839   HD11  ILE 104          3HD1      ILE 104   5.017  -9.918   4.684
  840   HD12  ILE 104          1HD1      ILE 104   6.265 -11.139   4.929
  841   HD13  ILE 104          2HD1      ILE 104   5.678 -10.795   3.305
  842    H    VAL 105           H        VAL 105   9.274 -13.351   3.620
  843    HA   VAL 105           HA       VAL 105  12.061 -12.940   3.155
  844    HB   VAL 105           HB       VAL 105  12.140 -15.419   2.642
  845   HG11  VAL 105          1HG1      VAL 105  10.984 -14.589   5.300
  846   HG12  VAL 105          2HG1      VAL 105  11.868 -16.083   4.988
  847   HG13  VAL 105          3HG1      VAL 105  12.685 -14.526   4.844
  848   HG21  VAL 105          3HG2      VAL 105  10.219 -16.797   3.303
  849   HG22  VAL 105          1HG2      VAL 105   9.784 -15.725   1.973
  850   HG23  VAL 105          2HG2      VAL 105   9.273 -15.344   3.619
  851    H    ILE 106           H        ILE 106  12.513 -11.864   1.438
  852    HA   ILE 106           HA       ILE 106  11.560 -12.961  -1.094
  853    HB   ILE 106           HB       ILE 106  11.971 -10.876  -2.233
  854   HG12  ILE 106          1HG1      ILE 106  13.984 -10.116  -0.928
  855   HG13  ILE 106          2HG1      ILE 106  12.846  -8.828  -1.270
  856   HG21  ILE 106          1HG2      ILE 106   9.807 -11.013  -1.208
  857   HG22  ILE 106          2HG2      ILE 106  10.375  -9.344  -1.216
  858   HG23  ILE 106          3HG2      ILE 106  10.439 -10.287   0.270
  859   HD11  ILE 106          3HD1      ILE 106  13.769  -8.658   0.965
  860   HD12  ILE 106          1HD1      ILE 106  13.158 -10.269   1.346
  861   HD13  ILE 106          2HD1      ILE 106  12.028  -8.955   1.020
  862    HA   PRO 107           HA       PRO 107  15.745 -14.201  -1.800
  863    HB2  PRO 107           1HB      PRO 107  15.468 -13.350  -4.616
  864    HB3  PRO 107           2HB      PRO 107  15.802 -14.959  -3.967
  865    HG2  PRO 107           1HG      PRO 107  13.425 -14.369  -5.040
  866    HG3  PRO 107           2HG      PRO 107  13.551 -15.423  -3.620
  867    HD2  PRO 107           1HD      PRO 107  12.800 -12.530  -3.779
  868    HD3  PRO 107           2HD      PRO 107  12.080 -13.836  -2.812
  869    H    GLU 108           H        GLU 108  17.090 -12.766  -0.852
  870    HA   GLU 108           HA       GLU 108  17.439 -10.195  -2.052
  871    HB2  GLU 108           1HB      GLU 108  18.992  -9.717  -0.179
  872    HB3  GLU 108           2HB      GLU 108  17.420 -10.250   0.379
  873    HG2  GLU 108           1HG      GLU 108  18.361 -12.481   0.813
  874    HG3  GLU 108           2HG      GLU 108  19.937 -11.903   0.279
  Start of MODEL    5
    1    HA   TYR   1           HA       TYR   1 -21.667  -2.166   4.740
    2    HD1  TYR   1           1HD      TYR   1 -24.163  -1.586   5.696
    3    HD2  TYR   1           2HD      TYR   1 -21.957  -3.127   8.984
    4    HE1  TYR   1           1HE      TYR   1 -26.173  -2.750   6.492
    5    HE2  TYR   1           2HE      TYR   1 -23.963  -4.296   9.789
    6    HH   TYR   1           HH       TYR   1 -26.406  -4.016   9.580
    7    H1   TYR   1           1HT      TYR   1 -21.541  -4.192   5.981
    8    H2   TYR   1           2HT      TYR   1 -20.197  -3.703   6.804
    9    H3   TYR   1           3HT      TYR   1 -20.058  -4.063   5.184
   10    HB2  TYR   1           1HB      TYR   1 -20.986  -1.512   7.620
   11    HB3  TYR   1           2HB      TYR   1 -21.975  -0.542   6.537
   12    H    THR   2           H        THR   2 -18.621  -2.859   6.138
   13    HA   THR   2           HA       THR   2 -17.376  -0.988   4.398
   14    HB   THR   2           HB       THR   2 -16.694  -1.077   7.374
   15    HG1  THR   2           1HG      THR   2 -18.584   0.337   6.083
   16   HG21  THR   2          3HG2      THR   2 -15.168   0.711   6.862
   17   HG22  THR   2          1HG2      THR   2 -15.750   0.766   5.194
   18   HG23  THR   2          2HG2      THR   2 -14.861  -0.639   5.755
   19    H    ASP   3           H        ASP   3 -16.767  -2.804   3.309
   20    HA   ASP   3           HA       ASP   3 -15.106  -4.771   4.779
   21    HB2  ASP   3           1HB      ASP   3 -17.308  -5.420   2.814
   22    HB3  ASP   3           2HB      ASP   3 -16.189  -6.584   3.498
   23    H    LYS   4           H        LYS   4 -15.785  -3.056   1.822
   24    HA   LYS   4           HA       LYS   4 -13.350  -3.664   0.614
   25    HB2  LYS   4           1HB      LYS   4 -15.703  -5.235  -0.470
   26    HB3  LYS   4           2HB      LYS   4 -14.385  -4.773  -1.524
   27    HG2  LYS   4           1HG      LYS   4 -12.843  -6.013   0.020
   28    HG3  LYS   4           2HG      LYS   4 -14.272  -6.596   0.869
   29    HD2  LYS   4           1HD      LYS   4 -15.081  -7.658  -1.159
   30    HD3  LYS   4           2HD      LYS   4 -13.715  -7.006  -2.069
   31    HE2  LYS   4           1HE      LYS   4 -13.248  -9.302  -1.534
   32    HE3  LYS   4           2HE      LYS   4 -12.189  -8.266  -0.591
   33    HZ1  LYS   4           3HZ      LYS   4 -13.090 -10.048   0.741
   34    HZ2  LYS   4           1HZ      LYS   4 -14.660  -9.565   0.393
   35    HZ3  LYS   4           2HZ      LYS   4 -13.668  -8.579   1.330
   36    H    TYR   5           H        TYR   5 -12.941  -2.257  -1.047
   37    HA   TYR   5           HA       TYR   5 -13.004  -0.129  -1.737
   38    HD1  TYR   5           2HD      TYR   5 -17.034   0.581  -3.009
   39    HD2  TYR   5           1HD      TYR   5 -15.179  -3.159  -3.792
   40    HE1  TYR   5           2HE      TYR   5 -19.243  -0.432  -3.379
   41    HE2  TYR   5           1HE      TYR   5 -17.381  -4.179  -4.173
   42    HH   TYR   5           HH       TYR   5 -19.712  -3.754  -3.514
   43    HB2  TYR   5           1HB      TYR   5 -14.650   0.432  -3.522
   44    HB3  TYR   5           2HB      TYR   5 -13.882  -1.068  -3.817
   45    H    ASP   6           H        ASP   6 -14.171  -0.574   0.748
   46    HA   ASP   6           HA       ASP   6 -15.892   1.794   0.922
   47    HB2  ASP   6           1HB      ASP   6 -15.435  -0.348   3.015
   48    HB3  ASP   6           2HB      ASP   6 -16.506   1.033   3.166
   49    H    LYS   7           H        LYS   7 -13.463   0.105   2.854
   50    HA   LYS   7           HA       LYS   7 -11.988   2.435   3.329
   51    HB2  LYS   7           1HB      LYS   7 -14.049   3.153   4.433
   52    HB3  LYS   7           2HB      LYS   7 -13.901   1.783   5.521
   53    HG2  LYS   7           1HG      LYS   7 -11.868   2.653   6.467
   54    HG3  LYS   7           2HG      LYS   7 -11.844   3.930   5.248
   55    HD2  LYS   7           1HD      LYS   7 -12.585   4.772   7.425
   56    HD3  LYS   7           2HD      LYS   7 -13.836   4.919   6.199
   57    HE2  LYS   7           1HE      LYS   7 -14.950   2.940   7.075
   58    HE3  LYS   7           2HE      LYS   7 -13.662   2.735   8.262
   59    HZ1  LYS   7           3HZ      LYS   7 -15.278   5.192   8.090
   60    HZ2  LYS   7           1HZ      LYS   7 -14.286   4.695   9.347
   61    HZ3  LYS   7           2HZ      LYS   7 -15.742   3.876   9.071
   62    H    ILE   8           H        ILE   8 -12.948   0.049   5.878
   63    HA   ILE   8           HA       ILE   8 -10.141  -0.430   6.420
   64    HB   ILE   8           HB       ILE   8 -11.000  -1.969   8.178
   65   HG12  ILE   8          1HG1      ILE   8 -13.729  -1.011   7.346
   66   HG13  ILE   8          2HG1      ILE   8 -13.104  -2.585   6.860
   67   HG21  ILE   8          1HG2      ILE   8 -12.003  -0.226   9.582
   68   HG22  ILE   8          2HG2      ILE   8 -12.242   0.780   8.152
   69   HG23  ILE   8          3HG2      ILE   8 -10.611   0.381   8.683
   70   HD11  ILE   8          3HD1      ILE   8 -13.630  -1.593   9.661
   71   HD12  ILE   8          1HD1      ILE   8 -12.973  -3.180   9.266
   72   HD13  ILE   8          2HD1      ILE   8 -14.613  -2.755   8.768
   73    H    ASN   9           H        ASN   9 -10.906  -1.226   3.909
   74    HA   ASN   9           HA       ASN   9 -10.931  -4.145   3.932
   75    HB2  ASN   9           1HB      ASN   9 -11.374  -3.896   1.547
   76    HB3  ASN   9           2HB      ASN   9 -12.556  -3.055   2.535
   77   HD21  ASN   9          1HD2      ASN   9  -9.569  -2.486   0.833
   78   HD22  ASN   9          2HD2      ASN   9  -9.856  -0.930   0.267
   79    H    LEU  10           H        LEU  10  -8.474  -2.278   4.492
   80    HA   LEU  10           HA       LEU  10  -6.899  -1.949   2.273
   81    HG   LEU  10           HG       LEU  10  -7.759  -0.565   4.730
   82    HB2  LEU  10           1HB      LEU  10  -5.975  -2.449   5.106
   83    HB3  LEU  10           2HB      LEU  10  -5.110  -1.621   3.831
   84   HD11  LEU  10          1HD1      LEU  10  -6.363  -0.728   6.706
   85   HD12  LEU  10          2HD1      LEU  10  -6.551   0.946   6.189
   86   HD13  LEU  10          3HD1      LEU  10  -5.051   0.074   5.847
   87   HD21  LEU  10          3HD2      LEU  10  -5.370   0.564   3.294
   88   HD22  LEU  10          1HD2      LEU  10  -6.760   1.516   3.864
   89   HD23  LEU  10          2HD2      LEU  10  -6.988   0.247   2.657
   90    H    GLN  11           H        GLN  11  -6.852  -4.659   4.572
   91    HA   GLN  11           HA       GLN  11  -5.077  -6.093   2.780
   92    HB2  GLN  11           1HB      GLN  11  -4.844  -6.169   5.323
   93    HB3  GLN  11           2HB      GLN  11  -6.305  -7.150   5.329
   94    HG2  GLN  11           1HG      GLN  11  -4.658  -8.760   5.390
   95    HG3  GLN  11           2HG      GLN  11  -4.995  -8.653   3.667
   96   HE21  GLN  11          1HE2      GLN  11  -3.334  -5.949   3.566
   97   HE22  GLN  11          2HE2      GLN  11  -1.742  -6.569   3.654
   98    H    GLU  12           H        GLU  12  -8.449  -5.820   3.402
   99    HA   GLU  12           HA       GLU  12  -9.243  -8.475   2.589
  100    HB2  GLU  12           1HB      GLU  12 -10.820  -5.892   2.672
  101    HB3  GLU  12           2HB      GLU  12 -11.513  -7.479   2.390
  102    HG2  GLU  12           1HG      GLU  12 -10.110  -6.598   4.898
  103    HG3  GLU  12           2HG      GLU  12 -11.856  -6.720   4.670
  104    H    ILE  13           H        ILE  13  -8.276  -5.708   1.138
  105    HA   ILE  13           HA       ILE  13  -9.202  -6.483  -1.490
  106    HB   ILE  13           HB       ILE  13  -8.324  -3.935  -0.251
  107   HG12  ILE  13          1HG1      ILE  13 -10.675  -4.460  -0.163
  108   HG13  ILE  13          2HG1      ILE  13 -10.414  -3.067  -1.204
  109   HG21  ILE  13          1HG2      ILE  13  -8.413  -4.421  -3.181
  110   HG22  ILE  13          2HG2      ILE  13  -6.999  -4.029  -2.199
  111   HG23  ILE  13          3HG2      ILE  13  -8.294  -2.849  -2.403
  112   HD11  ILE  13          3HD1      ILE  13 -11.117  -5.883  -1.983
  113   HD12  ILE  13          1HD1      ILE  13 -10.605  -4.638  -3.133
  114   HD13  ILE  13          2HD1      ILE  13 -12.071  -4.415  -2.181
  115    H    LEU  14           H        LEU  14  -6.229  -5.358   0.249
  116    HA   LEU  14           HA       LEU  14  -4.483  -5.445  -1.831
  117    HG   LEU  14           HG       LEU  14  -1.936  -6.399  -0.536
  118    HB2  LEU  14           1HB      LEU  14  -4.052  -4.446   0.335
  119    HB3  LEU  14           2HB      LEU  14  -3.849  -6.045   1.020
  120   HD11  LEU  14          1HD1      LEU  14  -2.484  -4.736  -2.227
  121   HD12  LEU  14          2HD1      LEU  14  -0.887  -4.437  -1.541
  122   HD13  LEU  14          3HD1      LEU  14  -2.256  -3.444  -1.047
  123   HD21  LEU  14          3HD2      LEU  14  -0.425  -5.020   0.759
  124   HD22  LEU  14          1HD2      LEU  14  -1.632  -5.793   1.789
  125   HD23  LEU  14          2HD2      LEU  14  -1.811  -4.099   1.339
  126    H    GLU  15           H        GLU  15  -5.759  -8.153  -0.182
  127    HA   GLU  15           HA       GLU  15  -3.653  -9.903  -0.736
  128    HB2  GLU  15           1HB      GLU  15  -5.020 -10.545   0.971
  129    HB3  GLU  15           2HB      GLU  15  -6.522 -10.350   0.060
  130    HG2  GLU  15           1HG      GLU  15  -6.099 -12.366  -1.160
  131    HG3  GLU  15           2HG      GLU  15  -4.454 -12.456  -0.550
  132    H    ASN  16           H        ASN  16  -5.896  -8.553  -2.922
  133    HA   ASN  16           HA       ASN  16  -4.807 -10.288  -5.019
  134    HB2  ASN  16           1HB      ASN  16  -7.782  -9.870  -4.678
  135    HB3  ASN  16           2HB      ASN  16  -7.031 -10.536  -6.116
  136   HD21  ASN  16          1HD2      ASN  16  -8.088 -11.088  -2.943
  137   HD22  ASN  16          2HD2      ASN  16  -7.801 -12.784  -2.873
  138    H    LYS  17           H        LYS  17  -3.950  -8.841  -6.400
  139    HA   LYS  17           HA       LYS  17  -4.399  -6.265  -6.893
  140    HB2  LYS  17           1HB      LYS  17  -3.760  -6.556  -9.278
  141    HB3  LYS  17           2HB      LYS  17  -2.687  -7.318  -8.134
  142    HG2  LYS  17           1HG      LYS  17  -4.763  -8.749  -9.775
  143    HG3  LYS  17           2HG      LYS  17  -3.065  -8.628 -10.218
  144    HD2  LYS  17           1HD      LYS  17  -2.690  -9.708  -7.838
  145    HD3  LYS  17           2HD      LYS  17  -4.366 -10.191  -8.016
  146    HE2  LYS  17           1HE      LYS  17  -2.991 -11.986  -8.789
  147    HE3  LYS  17           2HE      LYS  17  -3.784 -11.251 -10.181
  148    HZ1  LYS  17           3HZ      LYS  17  -1.416 -11.726 -10.560
  149    HZ2  LYS  17           1HZ      LYS  17  -1.007 -10.694  -9.304
  150    HZ3  LYS  17           2HZ      LYS  17  -1.723 -10.071 -10.684
  151    H    ARG  18           H        ARG  18  -6.536  -8.695  -8.176
  152    HA   ARG  18           HA       ARG  18  -8.129  -6.869  -9.638
  153    HE   ARG  18           HE       ARG  18  -7.851 -12.272  -7.336
  154    HB2  ARG  18           1HB      ARG  18 -10.003  -8.667  -9.443
  155    HB3  ARG  18           2HB      ARG  18  -8.559  -9.049 -10.349
  156    HG2  ARG  18           1HG      ARG  18  -8.751  -9.884  -7.480
  157    HG3  ARG  18           2HG      ARG  18  -9.618 -10.800  -8.714
  158    HD2  ARG  18           1HD      ARG  18  -7.488 -11.112  -9.935
  159    HD3  ARG  18           2HD      ARG  18  -6.619 -10.273  -8.654
  160   HH11  ARG  18          1HH1      ARG  18  -5.976 -12.371 -10.357
  161   HH12  ARG  18          2HH1      ARG  18  -5.237 -13.862  -9.978
  162   HH21  ARG  18          1HH2      ARG  18  -6.839 -14.302  -6.872
  163   HH22  ARG  18          2HH2      ARG  18  -5.734 -14.986  -7.976
  164    H    LEU  19           H        LEU  19  -8.138  -7.736  -6.301
  165    HA   LEU  19           HA       LEU  19 -10.563  -6.357  -5.778
  166    HG   LEU  19           HG       LEU  19  -9.797  -9.220  -4.937
  167    HB2  LEU  19           1HB      LEU  19  -8.438  -7.437  -3.944
  168    HB3  LEU  19           2HB      LEU  19  -9.894  -6.634  -3.389
  169   HD11  LEU  19          1HD1      LEU  19  -8.996  -9.339  -2.596
  170   HD12  LEU  19          2HD1      LEU  19 -10.482 -10.253  -2.869
  171   HD13  LEU  19          3HD1      LEU  19 -10.543  -8.685  -2.069
  172   HD21  LEU  19          3HD2      LEU  19 -12.127  -7.719  -3.734
  173   HD22  LEU  19          1HD2      LEU  19 -12.200  -9.340  -4.422
  174   HD23  LEU  19          2HD2      LEU  19 -11.817  -7.965  -5.453
  175    H    LEU  20           H        LEU  20  -7.130  -5.653  -5.850
  176    HA   LEU  20           HA       LEU  20  -7.197  -3.115  -4.585
  177    HG   LEU  20           HG       LEU  20  -4.707  -3.267  -3.918
  178    HB2  LEU  20           1HB      LEU  20  -5.367  -4.286  -6.666
  179    HB3  LEU  20           2HB      LEU  20  -5.235  -2.595  -6.241
  180   HD11  LEU  20          1HD1      LEU  20  -4.924  -6.014  -5.071
  181   HD12  LEU  20          2HD1      LEU  20  -5.711  -5.371  -3.638
  182   HD13  LEU  20          3HD1      LEU  20  -3.953  -5.658  -3.669
  183   HD21  LEU  20          3HD2      LEU  20  -2.946  -2.799  -5.481
  184   HD22  LEU  20          1HD2      LEU  20  -2.984  -4.471  -6.033
  185   HD23  LEU  20          2HD2      LEU  20  -2.476  -4.101  -4.384
  186    H    GLU  21           H        GLU  21  -7.539  -4.137  -7.881
  187    HA   GLU  21           HA       GLU  21  -8.180  -1.783  -9.134
  188    HB2  GLU  21           1HB      GLU  21  -9.080  -4.605  -9.522
  189    HB3  GLU  21           2HB      GLU  21  -9.607  -3.328 -10.599
  190    HG2  GLU  21           1HG      GLU  21  -6.762  -4.066 -10.027
  191    HG3  GLU  21           2HG      GLU  21  -7.643  -4.574 -11.462
  192    H    SER  22           H        SER  22 -10.123  -3.786  -7.070
  193    HA   SER  22           HA       SER  22 -12.564  -2.458  -7.606
  194    HG   SER  22           HG       SER  22 -11.576  -5.223  -7.350
  195    HB2  SER  22           1HB      SER  22 -11.867  -4.241  -5.271
  196    HB3  SER  22           2HB      SER  22 -13.496  -3.793  -5.791
  197    H    TYR  23           H        TYR  23 -10.083  -1.850  -5.025
  198    HA   TYR  23           HA       TYR  23 -11.839   0.417  -4.248
  199    HD1  TYR  23           2HD      TYR  23  -8.278  -1.160  -4.107
  200    HD2  TYR  23           1HD      TYR  23  -9.272   0.580  -0.385
  201    HE1  TYR  23           2HE      TYR  23  -5.906  -1.260  -3.422
  202    HE2  TYR  23           1HE      TYR  23  -6.929   0.518   0.341
  203    HH   TYR  23           HH       TYR  23  -4.386  -0.272  -1.853
  204    HB2  TYR  23           1HB      TYR  23 -10.767   0.719  -2.174
  205    HB3  TYR  23           2HB      TYR  23 -10.980  -0.982  -2.121
  206    H    MET  24           H        MET  24  -9.931  -0.015  -6.470
  207    HA   MET  24           HA       MET  24  -7.793   1.744  -6.243
  208    HB2  MET  24           1HB      MET  24  -8.020  -0.033  -7.979
  209    HB3  MET  24           2HB      MET  24  -9.164   0.995  -8.823
  210    HG2  MET  24           1HG      MET  24  -6.916   1.123  -9.785
  211    HG3  MET  24           2HG      MET  24  -7.460   2.680  -9.154
  212    HE1  MET  24           3HE      MET  24  -6.034  -0.461  -7.195
  213    HE2  MET  24           1HE      MET  24  -5.073  -0.396  -8.671
  214    HE3  MET  24           2HE      MET  24  -4.326  -0.035  -7.114
  215    H    ASP  25           H        ASP  25 -11.113   2.457  -6.829
  216    HA   ASP  25           HA       ASP  25 -10.805   5.062  -7.796
  217    HB2  ASP  25           1HB      ASP  25 -12.985   4.177  -7.751
  218    HB3  ASP  25           2HB      ASP  25 -12.925   3.870  -6.025
  219    H    CYS  26           H        CYS  26 -10.649   3.768  -4.546
  220    HA   CYS  26           HA       CYS  26 -10.314   6.265  -3.254
  221    HB2  CYS  26           1HB      CYS  26  -9.788   3.426  -2.409
  222    HB3  CYS  26           2HB      CYS  26  -9.229   4.747  -1.414
  223    H    VAL  27           H        VAL  27  -8.062   3.900  -4.587
  224    HA   VAL  27           HA       VAL  27  -5.836   5.476  -3.624
  225    HB   VAL  27           HB       VAL  27  -5.785   3.149  -5.556
  226   HG11  VAL  27          1HG1      VAL  27  -3.416   2.951  -4.949
  227   HG12  VAL  27          2HG1      VAL  27  -3.763   4.503  -5.712
  228   HG13  VAL  27          3HG1      VAL  27  -3.553   4.408  -3.963
  229   HG21  VAL  27          3HG2      VAL  27  -5.348   3.217  -2.573
  230   HG22  VAL  27          1HG2      VAL  27  -5.125   1.809  -3.611
  231   HG23  VAL  27          2HG2      VAL  27  -6.731   2.511  -3.406
  232    H    LEU  28           H        LEU  28  -7.018   4.729  -6.985
  233    HA   LEU  28           HA       LEU  28  -5.335   6.943  -7.868
  234    HG   LEU  28           HG       LEU  28  -5.677   6.734 -10.843
  235    HB2  LEU  28           1HB      LEU  28  -4.987   4.622  -8.795
  236    HB3  LEU  28           2HB      LEU  28  -6.544   4.786  -9.571
  237   HD11  LEU  28          1HD1      LEU  28  -3.054   5.966  -9.554
  238   HD12  LEU  28          2HD1      LEU  28  -3.936   7.476  -9.312
  239   HD13  LEU  28          3HD1      LEU  28  -3.246   7.099 -10.894
  240   HD21  LEU  28          3HD2      LEU  28  -5.656   4.501 -11.812
  241   HD22  LEU  28          1HD2      LEU  28  -4.076   4.198 -11.083
  242   HD23  LEU  28          2HD2      LEU  28  -4.250   5.434 -12.337
  243    H    GLY  29           H        GLY  29  -8.591   5.751  -7.815
  244    HA2  GLY  29           1HA      GLY  29 -10.452   7.300  -7.942
  245    HA3  GLY  29           2HA      GLY  29  -9.498   8.281  -9.044
  246    H    LYS  30           H        LYS  30  -9.886   4.791  -9.202
  247    HA   LYS  30           HA       LYS  30 -10.727   5.038 -11.960
  248    HB2  LYS  30           1HB      LYS  30 -10.066   2.656 -10.285
  249    HB3  LYS  30           2HB      LYS  30 -10.697   2.510 -11.914
  250    HG2  LYS  30           1HG      LYS  30  -8.676   3.913 -12.616
  251    HG3  LYS  30           2HG      LYS  30  -8.086   3.621 -10.965
  252    HD2  LYS  30           1HD      LYS  30  -8.242   1.198 -11.325
  253    HD3  LYS  30           2HD      LYS  30  -8.850   1.468 -12.948
  254    HE2  LYS  30           1HE      LYS  30  -6.119   2.294 -11.961
  255    HE3  LYS  30           2HE      LYS  30  -6.468   0.859 -12.918
  256    HZ1  LYS  30           3HZ      LYS  30  -5.658   2.629 -14.301
  257    HZ2  LYS  30           1HZ      LYS  30  -6.881   3.665 -13.797
  258    HZ3  LYS  30           2HZ      LYS  30  -7.255   2.306 -14.704
  259    H    GLY  31           H        GLY  31 -12.038   2.932  -9.364
  260    HA2  GLY  31           1HA      GLY  31 -14.513   2.903 -10.921
  261    HA3  GLY  31           2HA      GLY  31 -14.027   1.681  -9.769
  262    H    LYS  32           H        LYS  32 -14.770   1.808  -7.753
  263    HA   LYS  32           HA       LYS  32 -16.051   4.255  -6.893
  264    HB2  LYS  32           1HB      LYS  32 -17.996   2.924  -6.045
  265    HB3  LYS  32           2HB      LYS  32 -17.902   3.047  -7.792
  266    HG2  LYS  32           1HG      LYS  32 -16.947   0.760  -7.844
  267    HG3  LYS  32           2HG      LYS  32 -17.178   0.662  -6.094
  268    HD2  LYS  32           1HD      LYS  32 -19.554   1.009  -6.357
  269    HD3  LYS  32           2HD      LYS  32 -19.361   1.201  -8.099
  270    HE2  LYS  32           1HE      LYS  32 -18.517  -1.135  -8.201
  271    HE3  LYS  32           2HE      LYS  32 -18.848  -1.294  -6.477
  272    HZ1  LYS  32           3HZ      LYS  32 -21.190  -0.866  -6.929
  273    HZ2  LYS  32           1HZ      LYS  32 -20.651  -2.200  -7.810
  274    HZ3  LYS  32           2HZ      LYS  32 -20.870  -0.707  -8.570
  275    H    CYS  33           H        CYS  33 -16.185   4.481  -4.660
  276    HA   CYS  33           HA       CYS  33 -15.312   2.689  -2.744
  277    HB2  CYS  33           1HB      CYS  33 -13.170   3.207  -4.225
  278    HB3  CYS  33           2HB      CYS  33 -13.203   4.741  -3.334
  279    H    THR  34           H        THR  34 -14.493   4.411  -0.716
  280    HA   THR  34           HA       THR  34 -16.585   6.432  -0.965
  281    HB   THR  34           HB       THR  34 -16.877   4.431   0.769
  282    HG1  THR  34           1HG      THR  34 -18.444   5.695   1.258
  283   HG21  THR  34          3HG2      THR  34 -15.267   6.402   2.403
  284   HG22  THR  34          1HG2      THR  34 -14.744   4.776   1.955
  285   HG23  THR  34          2HG2      THR  34 -16.123   4.992   3.032
  286    HA   PRO  35           HA       PRO  35 -13.713   9.788  -0.628
  287    HB2  PRO  35           1HB      PRO  35 -15.045  11.217   1.414
  288    HB3  PRO  35           2HB      PRO  35 -15.252  11.417  -0.328
  289    HG2  PRO  35           1HG      PRO  35 -16.849   9.778   1.594
  290    HG3  PRO  35           2HG      PRO  35 -17.413  10.736   0.203
  291    HD2  PRO  35           1HD      PRO  35 -17.298   8.119   0.062
  292    HD3  PRO  35           2HD      PRO  35 -16.710   9.086  -1.311
  293    H    GLU  36           H        GLU  36 -14.908   8.894   2.602
  294    HA   GLU  36           HA       GLU  36 -12.696   9.718   4.113
  295    HB2  GLU  36           1HB      GLU  36 -14.854   9.132   5.092
  296    HB3  GLU  36           2HB      GLU  36 -14.635   7.467   4.586
  297    HG2  GLU  36           1HG      GLU  36 -12.863   7.162   6.149
  298    HG3  GLU  36           2HG      GLU  36 -12.874   8.865   6.591
  299    H    GLY  37           H        GLY  37 -13.406   6.710   2.524
  300    HA2  GLY  37           1HA      GLY  37 -11.185   5.243   3.448
  301    HA3  GLY  37           2HA      GLY  37 -12.157   4.880   2.029
  302    H    LYS  38           H        LYS  38 -11.813   7.128   0.496
  303    HA   LYS  38           HA       LYS  38  -9.481   6.631  -0.868
  304    HB2  LYS  38           1HB      LYS  38 -10.812   9.337  -0.842
  305    HB3  LYS  38           2HB      LYS  38  -9.821   8.654  -2.117
  306    HG2  LYS  38           1HG      LYS  38 -11.740   6.827  -2.184
  307    HG3  LYS  38           2HG      LYS  38 -12.635   8.073  -1.359
  308    HD2  LYS  38           1HD      LYS  38 -11.322   8.375  -4.055
  309    HD3  LYS  38           2HD      LYS  38 -13.039   8.224  -3.734
  310    HE2  LYS  38           1HE      LYS  38 -13.021  10.338  -2.513
  311    HE3  LYS  38           2HE      LYS  38 -11.283  10.484  -2.789
  312    HZ1  LYS  38           3HZ      LYS  38 -12.563  11.806  -4.368
  313    HZ2  LYS  38           1HZ      LYS  38 -13.372  10.426  -4.889
  314    HZ3  LYS  38           2HZ      LYS  38 -11.739  10.568  -5.179
  315    H    GLU  39           H        GLU  39  -9.946   8.842   1.842
  316    HA   GLU  39           HA       GLU  39  -7.460  10.147   1.237
  317    HB2  GLU  39           1HB      GLU  39  -9.256  10.481   3.634
  318    HB3  GLU  39           2HB      GLU  39  -7.890  11.508   3.216
  319    HG2  GLU  39           1HG      GLU  39  -9.054  12.026   1.067
  320    HG3  GLU  39           2HG      GLU  39 -10.453  11.166   1.707
  321    H    LEU  40           H        LEU  40  -8.713   7.873   3.605
  322    HA   LEU  40           HA       LEU  40  -6.246   7.849   4.938
  323    HG   LEU  40           HG       LEU  40  -9.521   5.872   4.536
  324    HB2  LEU  40           1HB      LEU  40  -7.037   5.992   6.206
  325    HB3  LEU  40           2HB      LEU  40  -8.187   7.298   6.211
  326   HD11  LEU  40          1HD1      LEU  40  -9.130   3.442   4.544
  327   HD12  LEU  40          2HD1      LEU  40  -7.771   3.636   5.633
  328   HD13  LEU  40          3HD1      LEU  40  -7.663   4.236   3.994
  329   HD21  LEU  40          3HD2      LEU  40  -9.067   5.033   7.380
  330   HD22  LEU  40          1HD2      LEU  40 -10.444   4.533   6.406
  331   HD23  LEU  40          2HD2      LEU  40 -10.210   6.234   6.787
  332    H    LYS  41           H        LYS  41  -7.596   5.862   2.419
  333    HA   LYS  41           HA       LYS  41  -5.549   3.890   2.451
  334    HB2  LYS  41           1HB      LYS  41  -7.518   4.717   0.316
  335    HB3  LYS  41           2HB      LYS  41  -6.351   3.413   0.104
  336    HG2  LYS  41           1HG      LYS  41  -7.438   2.013   1.425
  337    HG3  LYS  41           2HG      LYS  41  -8.132   3.169   2.502
  338    HD2  LYS  41           1HD      LYS  41  -9.601   3.894   0.653
  339    HD3  LYS  41           2HD      LYS  41  -8.963   2.557  -0.302
  340    HE2  LYS  41           1HE      LYS  41  -9.709   1.003   1.456
  341    HE3  LYS  41           2HE      LYS  41 -10.300   2.377   2.363
  342    HZ1  LYS  41           3HZ      LYS  41 -11.988   2.783   0.865
  343    HZ2  LYS  41           1HZ      LYS  41 -11.974   1.120   1.009
  344    HZ3  LYS  41           2HZ      LYS  41 -11.329   1.894  -0.377
  345    H    ASP  42           H        ASP  42  -6.000   6.919   0.730
  346    HA   ASP  42           HA       ASP  42  -3.812   6.962  -0.940
  347    HB2  ASP  42           1HB      ASP  42  -5.303   8.769  -1.085
  348    HB3  ASP  42           2HB      ASP  42  -5.221   9.086   0.642
  349    H    HIS  43           H        HIS  43  -3.966   8.050   2.408
  350    HA   HIS  43           HA       HIS  43  -1.156   8.585   2.464
  351    HD1  HIS  43           1HD      HIS  43  -4.657  10.518   4.006
  352    HD2  HIS  43           2HD      HIS  43  -0.625  11.259   3.381
  353    HE1  HIS  43           1HE      HIS  43  -4.518  12.913   3.314
  354    HE2  HIS  43           2HE      HIS  43  -2.148  13.141   2.529
  355    HB2  HIS  43           1HB      HIS  43  -3.214   8.588   4.651
  356    HB3  HIS  43           2HB      HIS  43  -1.514   8.955   4.935
  357    H    LEU  44           H        LEU  44  -3.096   5.885   3.441
  358    HA   LEU  44           HA       LEU  44  -1.028   4.716   5.028
  359    HG   LEU  44           HG       LEU  44  -1.744   2.425   6.013
  360    HB2  LEU  44           1HB      LEU  44  -3.388   4.449   5.568
  361    HB3  LEU  44           2HB      LEU  44  -3.650   3.629   4.053
  362   HD11  LEU  44          1HD1      LEU  44  -4.754   2.373   6.142
  363   HD12  LEU  44          2HD1      LEU  44  -3.679   3.070   7.356
  364   HD13  LEU  44          3HD1      LEU  44  -3.695   1.327   7.075
  365   HD21  LEU  44          3HD2      LEU  44  -3.781   1.337   4.044
  366   HD22  LEU  44          1HD2      LEU  44  -2.726   0.353   5.060
  367   HD23  LEU  44          2HD2      LEU  44  -2.045   1.390   3.811
  368    H    GLN  45           H        GLN  45  -2.421   3.887   1.826
  369    HA   GLN  45           HA       GLN  45  -0.483   1.871   1.432
  370    HB2  GLN  45           1HB      GLN  45  -2.235   3.294  -0.583
  371    HB3  GLN  45           2HB      GLN  45  -1.212   1.921  -0.970
  372    HG2  GLN  45           1HG      GLN  45  -3.580   1.922   0.911
  373    HG3  GLN  45           2HG      GLN  45  -3.518   1.203  -0.691
  374   HE21  GLN  45          1HE2      GLN  45  -4.258  -0.252   1.677
  375   HE22  GLN  45          2HE2      GLN  45  -3.049  -1.401   2.022
  376    H    GLU  46           H        GLU  46  -0.469   5.296   0.940
  377    HA   GLU  46           HA       GLU  46   1.905   5.491  -0.611
  378    HB2  GLU  46           1HB      GLU  46   0.363   7.365  -0.195
  379    HB3  GLU  46           2HB      GLU  46   0.794   7.342   1.502
  380    HG2  GLU  46           1HG      GLU  46   3.115   7.925   0.847
  381    HG3  GLU  46           2HG      GLU  46   2.557   8.094  -0.818
  382    H    ALA  47           H        ALA  47   1.211   5.296   2.840
  383    HA   ALA  47           HA       ALA  47   3.756   5.663   3.966
  384    HB1  ALA  47           3HB      ALA  47   1.511   3.918   4.953
  385    HB2  ALA  47           1HB      ALA  47   2.867   4.497   5.915
  386    HB3  ALA  47           2HB      ALA  47   1.680   5.647   5.280
  387    H    LEU  48           H        LEU  48   2.233   2.937   2.579
  388    HA   LEU  48           HA       LEU  48   3.881   0.881   3.273
  389    HG   LEU  48           HG       LEU  48   3.875  -0.945   0.927
  390    HB2  LEU  48           1HB      LEU  48   1.941   0.297   2.194
  391    HB3  LEU  48           2HB      LEU  48   2.126   1.513   0.969
  392   HD11  LEU  48          1HD1      LEU  48   2.142  -1.953  -0.520
  393   HD12  LEU  48          2HD1      LEU  48   1.070  -0.598  -0.163
  394   HD13  LEU  48          3HD1      LEU  48   1.561  -1.706   1.123
  395   HD21  LEU  48          3HD2      LEU  48   4.379   0.948  -0.581
  396   HD22  LEU  48          1HD2      LEU  48   2.740   0.870  -1.213
  397   HD23  LEU  48          2HD2      LEU  48   3.851  -0.472  -1.485
  398    H    GLU  49           H        GLU  49   4.628   3.432   0.908
  399    HA   GLU  49           HA       GLU  49   7.274   2.224   0.821
  400    HB2  GLU  49           1HB      GLU  49   6.275   1.550  -1.261
  401    HB3  GLU  49           2HB      GLU  49   5.777   3.194  -1.617
  402    HG2  GLU  49           1HG      GLU  49   7.700   2.415  -2.950
  403    HG3  GLU  49           2HG      GLU  49   8.036   3.856  -2.008
  404    H    THR  50           H        THR  50   6.181   5.208  -0.810
  405    HA   THR  50           HA       THR  50   8.644   6.413   0.248
  406    HB   THR  50           HB       THR  50   6.965   7.512  -2.014
  407    HG1  THR  50           1HG      THR  50   8.819   5.372  -1.964
  408   HG21  THR  50          3HG2      THR  50   9.945   7.614  -1.450
  409   HG22  THR  50          1HG2      THR  50   8.798   8.916  -1.109
  410   HG23  THR  50          2HG2      THR  50   9.095   8.425  -2.771
  411    H    GLY  51           H        GLY  51   5.701   6.229   1.246
  412    HA2  GLY  51           1HA      GLY  51   5.107   9.041   1.683
  413    HA3  GLY  51           2HA      GLY  51   4.197   7.637   2.261
  414    H    CYS  52           H        CYS  52   4.127   7.515   4.202
  415    HA   CYS  52           HA       CYS  52   6.587   7.739   5.635
  416    HB2  CYS  52           1HB      CYS  52   5.672   9.914   5.931
  417    HB3  CYS  52           2HB      CYS  52   4.105   9.266   6.383
  418    H    GLU  53           H        GLU  53   6.697   5.609   6.159
  419    HA   GLU  53           HA       GLU  53   4.422   4.073   7.014
  420    HB2  GLU  53           1HB      GLU  53   6.037   2.231   7.302
  421    HB3  GLU  53           2HB      GLU  53   6.163   2.984   5.723
  422    HG2  GLU  53           1HG      GLU  53   8.124   4.208   6.442
  423    HG3  GLU  53           2HG      GLU  53   7.987   3.515   8.053
  424    H    LYS  54           H        LYS  54   6.875   5.875   8.566
  425    HA   LYS  54           HA       LYS  54   6.291   4.557  11.092
  426    HB2  LYS  54           1HB      LYS  54   8.287   5.760  11.985
  427    HB3  LYS  54           2HB      LYS  54   8.622   4.700  10.646
  428    HG2  LYS  54           1HG      LYS  54   9.953   6.632  10.298
  429    HG3  LYS  54           2HG      LYS  54   8.637   6.736   9.139
  430    HD2  LYS  54           1HD      LYS  54   9.063   8.919  10.130
  431    HD3  LYS  54           2HD      LYS  54   7.482   8.325  10.645
  432    HE2  LYS  54           1HE      LYS  54   8.495   7.562  12.770
  433    HE3  LYS  54           2HE      LYS  54  10.040   8.227  12.243
  434    HZ1  LYS  54           3HZ      LYS  54   9.083  10.410  12.273
  435    HZ2  LYS  54           1HZ      LYS  54   8.828   9.679  13.754
  436    HZ3  LYS  54           2HZ      LYS  54   7.559   9.811  12.649
  437    H    CYS  55           H        CYS  55   4.543   6.560   9.710
  438    HA   CYS  55           HA       CYS  55   4.618   8.843  11.387
  439    HB2  CYS  55           1HB      CYS  55   2.939   8.039   9.138
  440    HB3  CYS  55           2HB      CYS  55   2.204   9.169  10.259
  441    H    THR  56           H        THR  56   1.335   7.684  11.080
  442    HA   THR  56           HA       THR  56   1.229   7.840  13.968
  443    HB   THR  56           HB       THR  56  -1.265   7.857  13.475
  444    HG1  THR  56           1HG      THR  56  -0.779   8.786  10.928
  445   HG21  THR  56          3HG2      THR  56  -0.036   9.907  14.040
  446   HG22  THR  56          1HG2      THR  56  -1.253  10.236  12.807
  447   HG23  THR  56          2HG2      THR  56   0.444  10.090  12.352
  448    H    GLU  57           H        GLU  57  -0.499   6.317  14.889
  449    HA   GLU  57           HA       GLU  57   0.383   3.703  14.715
  450    HB2  GLU  57           1HB      GLU  57  -1.512   3.059  16.084
  451    HB3  GLU  57           2HB      GLU  57  -0.892   4.598  16.644
  452    HG2  GLU  57           1HG      GLU  57  -3.384   4.183  14.983
  453    HG3  GLU  57           2HG      GLU  57  -3.336   4.510  16.709
  454    H    ALA  58           H        ALA  58  -2.405   5.172  13.146
  455    HA   ALA  58           HA       ALA  58  -3.325   2.841  11.874
  456    HB1  ALA  58           3HB      ALA  58  -3.723   5.681  10.951
  457    HB2  ALA  58           1HB      ALA  58  -4.705   4.278  10.535
  458    HB3  ALA  58           2HB      ALA  58  -4.693   4.878  12.190
  459    H    GLN  59           H        GLN  59  -1.063   5.356  10.821
  460    HA   GLN  59           HA       GLN  59  -0.854   4.145   8.255
  461    HB2  GLN  59           1HB      GLN  59   0.767   6.352   9.487
  462    HB3  GLN  59           2HB      GLN  59   1.170   5.642   7.928
  463    HG2  GLN  59           1HG      GLN  59  -1.177   6.210   7.200
  464    HG3  GLN  59           2HG      GLN  59  -1.320   7.142   8.686
  465   HE21  GLN  59          1HE2      GLN  59   1.687   6.925   6.876
  466   HE22  GLN  59          2HE2      GLN  59   1.661   8.530   6.292
  467    H    GLU  60           H        GLU  60   1.183   4.059  11.141
  468    HA   GLU  60           HA       GLU  60   3.118   2.481   9.887
  469    HB2  GLU  60           1HB      GLU  60   3.877   1.750  12.149
  470    HB3  GLU  60           2HB      GLU  60   3.762   3.488  11.953
  471    HG2  GLU  60           1HG      GLU  60   1.765   3.561  13.224
  472    HG3  GLU  60           2HG      GLU  60   1.666   1.800  13.276
  473    H    LYS  61           H        LYS  61   0.373   1.340  11.919
  474    HA   LYS  61           HA       LYS  61   0.951  -1.413  11.507
  475    HB2  LYS  61           1HB      LYS  61  -1.603  -0.027  12.305
  476    HB3  LYS  61           2HB      LYS  61  -1.440  -1.773  12.197
  477    HG2  LYS  61           1HG      LYS  61   0.306  -1.727  13.880
  478    HG3  LYS  61           2HG      LYS  61   0.168   0.027  13.998
  479    HD2  LYS  61           1HD      LYS  61  -1.030  -1.093  15.821
  480    HD3  LYS  61           2HD      LYS  61  -2.138  -0.199  14.784
  481    HE2  LYS  61           1HE      LYS  61  -3.059  -2.381  15.404
  482    HE3  LYS  61           2HE      LYS  61  -2.789  -2.292  13.672
  483    HZ1  LYS  61           3HZ      LYS  61  -0.735  -3.586  13.990
  484    HZ2  LYS  61           1HZ      LYS  61  -2.082  -4.410  14.555
  485    HZ3  LYS  61           2HZ      LYS  61  -1.043  -3.688  15.648
  486    H    GLY  62           H        GLY  62  -0.713   0.921   9.776
  487    HA2  GLY  62           1HA      GLY  62  -2.198  -0.804   8.046
  488    HA3  GLY  62           2HA      GLY  62  -1.876   0.945   7.811
  489    H    ALA  63           H        ALA  63   0.823   0.975   7.878
  490    HA   ALA  63           HA       ALA  63   1.532   0.199   5.302
  491    HB1  ALA  63           3HB      ALA  63   3.338   0.868   7.627
  492    HB2  ALA  63           1HB      ALA  63   3.814   0.824   5.927
  493    HB3  ALA  63           2HB      ALA  63   2.661   2.035   6.492
  494    H    GLU  64           H        GLU  64   2.228  -1.215   8.485
  495    HA   GLU  64           HA       GLU  64   3.903  -3.305   7.793
  496    HB2  GLU  64           1HB      GLU  64   1.597  -3.645   9.711
  497    HB3  GLU  64           2HB      GLU  64   3.103  -4.535   9.709
  498    HG2  GLU  64           1HG      GLU  64   4.180  -2.210  10.181
  499    HG3  GLU  64           2HG      GLU  64   2.564  -1.730  10.513
  500    H    THR  65           H        THR  65   0.397  -3.480   8.002
  501    HA   THR  65           HA       THR  65  -0.060  -6.073   6.981
  502    HB   THR  65           HB       THR  65  -1.920  -3.714   6.650
  503    HG1  THR  65           1HG      THR  65  -1.359  -3.457   8.798
  504   HG21  THR  65          3HG2      THR  65  -2.371  -6.587   7.463
  505   HG22  THR  65          1HG2      THR  65  -2.649  -5.930   5.852
  506   HG23  THR  65          2HG2      THR  65  -3.620  -5.371   7.211
  507    H    SER  66           H        SER  66   0.015  -2.959   5.323
  508    HA   SER  66           HA       SER  66  -0.703  -4.081   2.886
  509    HG   SER  66           HG       SER  66  -1.333  -1.339   4.499
  510    HB2  SER  66           1HB      SER  66   0.513  -1.389   3.468
  511    HB3  SER  66           2HB      SER  66  -0.317  -1.855   1.976
  512    H    ILE  67           H        ILE  67   2.439  -3.128   4.156
  513    HA   ILE  67           HA       ILE  67   3.952  -3.623   1.847
  514    HB   ILE  67           HB       ILE  67   4.733  -3.740   4.782
  515   HG12  ILE  67          1HG1      ILE  67   5.356  -1.546   2.809
  516   HG13  ILE  67          2HG1      ILE  67   3.850  -1.563   3.721
  517   HG21  ILE  67          1HG2      ILE  67   7.046  -3.471   3.992
  518   HG22  ILE  67          2HG2      ILE  67   6.491  -3.626   2.329
  519   HG23  ILE  67          3HG2      ILE  67   6.341  -4.991   3.438
  520   HD11  ILE  67          3HD1      ILE  67   5.660  -0.147   4.679
  521   HD12  ILE  67          1HD1      ILE  67   6.574  -1.630   5.009
  522   HD13  ILE  67          2HD1      ILE  67   5.003  -1.361   5.778
  523    H    ASP  68           H        ASP  68   2.898  -5.684   4.493
  524    HA   ASP  68           HA       ASP  68   4.393  -7.976   4.004
  525    HB2  ASP  68           1HB      ASP  68   3.027  -7.702   6.023
  526    HB3  ASP  68           2HB      ASP  68   1.559  -7.749   5.058
  527    H    TYR  69           H        TYR  69   1.047  -7.284   2.847
  528    HA   TYR  69           HA       TYR  69   1.256  -9.660   1.244
  529    HD1  TYR  69           1HD      TYR  69  -0.975  -9.731  -1.247
  530    HD2  TYR  69           2HD      TYR  69  -1.515 -10.560   2.876
  531    HE1  TYR  69           1HE      TYR  69  -1.823 -11.977  -1.809
  532    HE2  TYR  69           2HE      TYR  69  -2.362 -12.793   2.335
  533    HH   TYR  69           HH       TYR  69  -3.450 -13.850   0.445
  534    HB2  TYR  69           1HB      TYR  69  -1.041  -8.421   2.201
  535    HB3  TYR  69           2HB      TYR  69  -1.019  -7.951   0.500
  536    H    LEU  70           H        LEU  70   1.811  -6.322   0.692
  537    HA   LEU  70           HA       LEU  70   1.650  -6.141  -2.054
  538    HG   LEU  70           HG       LEU  70   3.952  -4.760  -2.725
  539    HB2  LEU  70           1HB      LEU  70   2.043  -4.273  -0.547
  540    HB3  LEU  70           2HB      LEU  70   3.645  -4.895  -0.194
  541   HD11  LEU  70          1HD1      LEU  70   2.812  -2.852  -3.782
  542   HD12  LEU  70          2HD1      LEU  70   1.740  -2.755  -2.385
  543   HD13  LEU  70          3HD1      LEU  70   1.743  -4.194  -3.394
  544   HD21  LEU  70          3HD2      LEU  70   4.078  -2.423  -0.842
  545   HD22  LEU  70          1HD2      LEU  70   4.775  -2.397  -2.468
  546   HD23  LEU  70          2HD2      LEU  70   5.347  -3.561  -1.281
  547    H    ILE  71           H        ILE  71   4.486  -6.874  -0.038
  548    HA   ILE  71           HA       ILE  71   6.161  -7.358  -2.265
  549    HB   ILE  71           HB       ILE  71   6.561  -8.086   0.659
  550   HG12  ILE  71          1HG1      ILE  71   7.467  -5.717  -0.988
  551   HG13  ILE  71          2HG1      ILE  71   6.237  -5.700   0.264
  552   HG21  ILE  71          1HG2      ILE  71   8.598  -7.942  -1.577
  553   HG22  ILE  71          2HG2      ILE  71   8.042  -9.420  -0.801
  554   HG23  ILE  71          3HG2      ILE  71   8.961  -8.230   0.122
  555   HD11  ILE  71          3HD1      ILE  71   7.967  -6.276   1.916
  556   HD12  ILE  71          1HD1      ILE  71   8.288  -4.750   1.071
  557   HD13  ILE  71          2HD1      ILE  71   9.165  -6.213   0.610
  558    H    LYS  72           H        LYS  72   4.101  -9.370  -0.342
  559    HA   LYS  72           HA       LYS  72   5.114 -11.854  -1.241
  560    HB2  LYS  72           1HB      LYS  72   2.482 -11.054  -0.063
  561    HB3  LYS  72           2HB      LYS  72   2.848 -12.716  -0.523
  562    HG2  LYS  72           1HG      LYS  72   4.640 -12.802   1.075
  563    HG3  LYS  72           2HG      LYS  72   4.433 -11.042   1.284
  564    HD2  LYS  72           1HD      LYS  72   2.577 -11.225   2.529
  565    HD3  LYS  72           2HD      LYS  72   2.080 -12.796   1.852
  566    HE2  LYS  72           1HE      LYS  72   3.776 -13.865   3.228
  567    HE3  LYS  72           2HE      LYS  72   4.368 -12.295   3.768
  568    HZ1  LYS  72           3HZ      LYS  72   2.940 -13.242   5.442
  569    HZ2  LYS  72           1HZ      LYS  72   1.685 -13.432   4.318
  570    HZ3  LYS  72           2HZ      LYS  72   2.194 -11.889   4.747
  571    H    ASN  73           H        ASN  73   2.164 -10.098  -2.281
  572    HA   ASN  73           HA       ASN  73   2.167 -11.931  -4.599
  573    HB2  ASN  73           1HB      ASN  73   0.329 -12.193  -2.884
  574    HB3  ASN  73           2HB      ASN  73  -0.268 -10.627  -3.405
  575   HD21  ASN  73          1HD2      ASN  73  -1.534 -10.516  -5.340
  576   HD22  ASN  73          2HD2      ASN  73  -1.880 -11.932  -6.222
  577    H    GLU  74           H        GLU  74   1.857  -8.627  -3.599
  578    HA   GLU  74           HA       GLU  74   0.949  -7.882  -6.302
  579    HB2  GLU  74           1HB      GLU  74   0.857  -6.224  -3.776
  580    HB3  GLU  74           2HB      GLU  74   0.158  -5.805  -5.325
  581    HG2  GLU  74           1HG      GLU  74  -0.704  -8.069  -3.528
  582    HG3  GLU  74           2HG      GLU  74  -1.583  -6.573  -3.844
  583    H    LEU  75           H        LEU  75   3.388  -8.418  -6.567
  584    HA   LEU  75           HA       LEU  75   5.365  -6.556  -5.730
  585    HG   LEU  75           HG       LEU  75   7.291  -6.887  -8.170
  586    HB2  LEU  75           1HB      LEU  75   5.916  -8.842  -6.327
  587    HB3  LEU  75           2HB      LEU  75   5.435  -8.546  -7.985
  588   HD11  LEU  75          1HD1      LEU  75   9.072  -6.925  -6.497
  589   HD12  LEU  75          2HD1      LEU  75   8.076  -7.950  -5.464
  590   HD13  LEU  75          3HD1      LEU  75   7.562  -6.306  -5.839
  591   HD21  LEU  75          3HD2      LEU  75   7.562  -9.155  -8.992
  592   HD22  LEU  75          1HD2      LEU  75   8.079  -9.691  -7.393
  593   HD23  LEU  75          2HD2      LEU  75   9.076  -8.560  -8.310
  594    H    GLU  76           H        GLU  76   3.392  -6.749  -8.641
  595    HA   GLU  76           HA       GLU  76   4.920  -4.727  -9.988
  596    HB2  GLU  76           1HB      GLU  76   3.160  -4.802 -11.746
  597    HB3  GLU  76           2HB      GLU  76   3.836  -6.377 -11.401
  598    HG2  GLU  76           1HG      GLU  76   1.245  -5.434 -10.207
  599    HG3  GLU  76           2HG      GLU  76   1.335  -6.226 -11.776
  600    H    ILE  77           H        ILE  77   2.284  -4.872  -7.868
  601    HA   ILE  77           HA       ILE  77   1.234  -2.293  -8.365
  602    HB   ILE  77           HB       ILE  77   1.187  -3.963  -5.840
  603   HG12  ILE  77          1HG1      ILE  77   0.157  -5.086  -7.773
  604   HG13  ILE  77          2HG1      ILE  77  -1.047  -4.662  -6.553
  605   HG21  ILE  77          1HG2      ILE  77   0.735  -1.624  -5.336
  606   HG22  ILE  77          2HG2      ILE  77  -0.726  -2.593  -5.146
  607   HG23  ILE  77          3HG2      ILE  77  -0.518  -1.582  -6.577
  608   HD11  ILE  77          3HD1      ILE  77  -1.740  -2.764  -7.919
  609   HD12  ILE  77          1HD1      ILE  77  -1.877  -4.283  -8.801
  610   HD13  ILE  77          2HD1      ILE  77  -0.535  -3.190  -9.142
  611    H    TRP  78           H        TRP  78   3.707  -3.609  -6.215
  612    HA   TRP  78           HA       TRP  78   4.470  -1.270  -4.892
  613    HD1  TRP  78           HD       TRP  78   6.470  -1.217  -2.730
  614    HE1  TRP  78           1HE      TRP  78   8.880  -0.359  -2.592
  615    HE3  TRP  78           3HE      TRP  78   8.348  -3.425  -6.956
  616    HZ2  TRP  78           2HZ      TRP  78  11.279  -0.609  -4.066
  617    HZ3  TRP  78           3HZ      TRP  78  10.718  -3.059  -7.509
  618    HH2  TRP  78           HH       TRP  78  12.147  -1.677  -6.093
  619    HB2  TRP  78           1HB      TRP  78   5.439  -3.408  -4.209
  620    HB3  TRP  78           2HB      TRP  78   6.184  -3.611  -5.787
  621    H    LYS  79           H        LYS  79   5.563  -2.606  -7.959
  622    HA   LYS  79           HA       LYS  79   7.480  -0.749  -8.659
  623    HB2  LYS  79           1HB      LYS  79   5.566  -2.236 -10.450
  624    HB3  LYS  79           2HB      LYS  79   6.916  -1.283 -11.049
  625    HG2  LYS  79           1HG      LYS  79   8.490  -2.754  -9.954
  626    HG3  LYS  79           2HG      LYS  79   7.176  -3.651  -9.195
  627    HD2  LYS  79           1HD      LYS  79   8.019  -4.887 -11.120
  628    HD3  LYS  79           2HD      LYS  79   6.379  -4.336 -11.431
  629    HE2  LYS  79           1HE      LYS  79   7.673  -3.996 -13.422
  630    HE3  LYS  79           2HE      LYS  79   7.327  -2.426 -12.724
  631    HZ1  LYS  79           3HZ      LYS  79   9.606  -2.636 -13.505
  632    HZ2  LYS  79           1HZ      LYS  79   9.885  -3.900 -12.439
  633    HZ3  LYS  79           2HZ      LYS  79   9.594  -2.347 -11.845
  634    H    GLU  80           H        GLU  80   3.972  -0.524  -9.200
  635    HA   GLU  80           HA       GLU  80   4.146   1.896 -10.634
  636    HB2  GLU  80           1HB      GLU  80   1.811   0.579  -9.285
  637    HB3  GLU  80           2HB      GLU  80   1.671   2.104 -10.149
  638    HG2  GLU  80           1HG      GLU  80   2.624   0.954 -12.143
  639    HG3  GLU  80           2HG      GLU  80   2.489  -0.560 -11.258
  640    H    LEU  81           H        LEU  81   3.458   1.321  -7.196
  641    HA   LEU  81           HA       LEU  81   2.994   4.071  -6.642
  642    HG   LEU  81           HG       LEU  81   1.709   2.142  -3.688
  643    HB2  LEU  81           1HB      LEU  81   3.769   1.811  -4.768
  644    HB3  LEU  81           2HB      LEU  81   3.621   3.452  -4.248
  645   HD11  LEU  81          1HD1      LEU  81  -0.047   3.687  -4.521
  646   HD12  LEU  81          2HD1      LEU  81   1.102   4.319  -5.698
  647   HD13  LEU  81          3HD1      LEU  81   1.405   4.522  -3.966
  648   HD21  LEU  81          3HD2      LEU  81   0.049   1.452  -5.383
  649   HD22  LEU  81          1HD2      LEU  81   1.578   0.584  -5.539
  650   HD23  LEU  81          2HD2      LEU  81   1.189   1.904  -6.647
  651    H    THR  82           H        THR  82   5.833   2.066  -6.175
  652    HA   THR  82           HA       THR  82   7.572   4.130  -5.373
  653    HB   THR  82           HB       THR  82   8.350   1.643  -6.902
  654    HG1  THR  82           1HG      THR  82   8.418   0.891  -4.506
  655   HG21  THR  82          3HG2      THR  82   9.690   3.165  -4.646
  656   HG22  THR  82          1HG2      THR  82  10.135   3.294  -6.353
  657   HG23  THR  82          2HG2      THR  82  10.349   1.760  -5.496
  658    H    ALA  83           H        ALA  83   6.829   3.022  -8.678
  659    HA   ALA  83           HA       ALA  83   8.742   4.770  -9.826
  660    HB1  ALA  83           3HB      ALA  83   7.812   2.871 -11.075
  661    HB2  ALA  83           1HB      ALA  83   6.235   3.656 -11.088
  662    HB3  ALA  83           2HB      ALA  83   7.588   4.387 -11.951
  663    H    HIS  84           H        HIS  84   5.589   5.271  -8.593
  664    HA   HIS  84           HA       HIS  84   5.208   7.758  -9.995
  665    HD1  HIS  84           1HD      HIS  84   1.293   7.667  -7.296
  666    HD2  HIS  84           2HD      HIS  84   3.480   9.490 -10.328
  667    HE1  HIS  84           1HE      HIS  84   0.163   9.842  -7.722
  668    HE2  HIS  84           2HE      HIS  84   1.403  10.837  -9.692
  669    HB2  HIS  84           1HB      HIS  84   3.291   6.273  -9.491
  670    HB3  HIS  84           2HB      HIS  84   3.562   6.513  -7.773
  671    H    PHE  85           H        PHE  85   6.538   6.754  -6.955
  672    HA   PHE  85           HA       PHE  85   6.530   9.568  -6.136
  673    HD1  PHE  85           2HD      PHE  85   4.919  10.452  -4.562
  674    HD2  PHE  85           1HD      PHE  85   4.517   6.230  -4.237
  675    HE1  PHE  85           2HE      PHE  85   2.490  10.703  -4.382
  676    HE2  PHE  85           1HE      PHE  85   2.079   6.477  -4.058
  677    HZ   PHE  85           HZ       PHE  85   1.062   8.713  -4.130
  678    HB2  PHE  85           1HB      PHE  85   6.625   7.142  -4.353
  679    HB3  PHE  85           2HB      PHE  85   6.837   8.798  -3.793
  680    H    ASP  86           H        ASP  86   8.661   6.696  -5.976
  681    HA   ASP  86           HA       ASP  86  10.879   8.540  -6.312
  682    HB2  ASP  86           1HB      ASP  86  10.808   7.920  -3.870
  683    HB3  ASP  86           2HB      ASP  86  10.992   6.231  -4.343
  684    HA   PRO  87           HA       PRO  87  10.762   5.141  -9.242
  685    HB2  PRO  87           1HB      PRO  87  11.359   6.489 -11.462
  686    HB3  PRO  87           2HB      PRO  87   9.788   6.579 -10.604
  687    HG2  PRO  87           1HG      PRO  87  12.086   8.508 -10.446
  688    HG3  PRO  87           2HG      PRO  87  10.372   8.862 -10.755
  689    HD2  PRO  87           1HD      PRO  87  11.536   9.020  -8.293
  690    HD3  PRO  87           2HD      PRO  87   9.815   8.646  -8.537
  691    H    ASP  88           H        ASP  88  13.259   6.887  -7.977
  692    HA   ASP  88           HA       ASP  88  15.437   5.717  -9.476
  693    HB2  ASP  88           1HB      ASP  88  15.403   7.009  -6.739
  694    HB3  ASP  88           2HB      ASP  88  16.849   6.537  -7.616
  695    H    GLY  89           H        GLY  89  13.346   4.901  -6.867
  696    HA2  GLY  89           1HA      GLY  89  13.117   2.976  -5.644
  697    HA3  GLY  89           2HA      GLY  89  14.346   2.235  -6.673
  698    H    LYS  90           H        LYS  90  14.569   5.175  -4.775
  699    HA   LYS  90           HA       LYS  90  17.162   4.487  -3.904
  700    HB2  LYS  90           1HB      LYS  90  16.463   6.805  -4.318
  701    HB3  LYS  90           2HB      LYS  90  15.314   6.700  -2.997
  702    HG2  LYS  90           1HG      LYS  90  17.315   7.915  -2.345
  703    HG3  LYS  90           2HG      LYS  90  17.134   6.431  -1.407
  704    HD2  LYS  90           1HD      LYS  90  19.421   6.549  -2.011
  705    HD3  LYS  90           2HD      LYS  90  18.702   5.336  -3.014
  706    HE2  LYS  90           1HE      LYS  90  20.174   6.732  -4.353
  707    HE3  LYS  90           2HE      LYS  90  18.509   6.888  -4.901
  708    HZ1  LYS  90           3HZ      LYS  90  19.621   9.006  -4.841
  709    HZ2  LYS  90           1HZ      LYS  90  19.998   8.846  -3.211
  710    HZ3  LYS  90           2HZ      LYS  90  18.399   9.031  -3.706
  711    H    TRP  91           H        TRP  91  14.048   3.989  -2.659
  712    HA   TRP  91           HA       TRP  91  15.071   3.394  -0.015
  713    HD1  TRP  91           HD       TRP  91  12.292   5.945  -1.979
  714    HE1  TRP  91           1HE      TRP  91  12.507   8.239  -0.870
  715    HE3  TRP  91           3HE      TRP  91  13.837   4.457   2.664
  716    HZ2  TRP  91           2HZ      TRP  91  13.227   9.298   1.648
  717    HZ3  TRP  91           3HZ      TRP  91  14.265   6.178   4.366
  718    HH2  TRP  91           HH       TRP  91  13.970   8.549   3.866
  719    HB2  TRP  91           1HB      TRP  91  12.205   3.485  -1.008
  720    HB3  TRP  91           2HB      TRP  91  12.700   3.241   0.661
  721    H    ARG  92           H        ARG  92  15.629   1.825  -2.346
  722    HA   ARG  92           HA       ARG  92  14.234  -0.635  -2.398
  723    HE   ARG  92           HE       ARG  92  19.731   1.183  -2.793
  724    HB2  ARG  92           1HB      ARG  92  16.365  -1.589  -3.315
  725    HB3  ARG  92           2HB      ARG  92  15.892  -0.090  -4.115
  726    HG2  ARG  92           1HG      ARG  92  17.456   1.158  -2.796
  727    HG3  ARG  92           2HG      ARG  92  17.873  -0.278  -1.878
  728    HD2  ARG  92           1HD      ARG  92  18.770  -1.281  -3.918
  729    HD3  ARG  92           2HD      ARG  92  18.410   0.220  -4.795
  730   HH11  ARG  92          1HH1      ARG  92  20.529  -1.634  -4.802
  731   HH12  ARG  92          2HH1      ARG  92  22.202  -1.582  -4.525
  732   HH21  ARG  92          1HH2      ARG  92  22.077   1.282  -2.404
  733   HH22  ARG  92          2HH2      ARG  92  23.124   0.146  -3.116
  734    H    LYS  93           H        LYS  93  16.729   0.623  -0.329
  735    HA   LYS  93           HA       LYS  93  17.197  -1.787   1.096
  736    HB2  LYS  93           1HB      LYS  93  18.978  -0.206   0.951
  737    HB3  LYS  93           2HB      LYS  93  17.965   1.070   1.601
  738    HG2  LYS  93           1HG      LYS  93  18.020   0.143   3.796
  739    HG3  LYS  93           2HG      LYS  93  18.654  -1.386   3.196
  740    HD2  LYS  93           1HD      LYS  93  20.197   1.177   2.965
  741    HD3  LYS  93           2HD      LYS  93  20.279   0.166   4.405
  742    HE2  LYS  93           1HE      LYS  93  20.888  -0.761   1.603
  743    HE3  LYS  93           2HE      LYS  93  22.102  -0.298   2.792
  744    HZ1  LYS  93           3HZ      LYS  93  20.219  -2.640   3.044
  745    HZ2  LYS  93           1HZ      LYS  93  21.326  -2.112   4.214
  746    HZ3  LYS  93           2HZ      LYS  93  21.873  -2.659   2.734
  747    H    LYS  94           H        LYS  94  14.893   0.777   1.351
  748    HA   LYS  94           HA       LYS  94  14.269   0.097   4.056
  749    HB2  LYS  94           1HB      LYS  94  13.927   2.416   2.993
  750    HB3  LYS  94           2HB      LYS  94  12.509   1.722   2.220
  751    HG2  LYS  94           1HG      LYS  94  11.827   2.901   4.206
  752    HG3  LYS  94           2HG      LYS  94  11.604   1.168   4.465
  753    HD2  LYS  94           1HD      LYS  94  13.725   1.084   5.717
  754    HD3  LYS  94           2HD      LYS  94  13.959   2.804   5.426
  755    HE2  LYS  94           1HE      LYS  94  13.134   2.487   7.657
  756    HE3  LYS  94           2HE      LYS  94  11.868   3.239   6.692
  757    HZ1  LYS  94           3HZ      LYS  94  12.005   0.337   7.416
  758    HZ2  LYS  94           1HZ      LYS  94  10.773   1.081   6.501
  759    HZ3  LYS  94           2HZ      LYS  94  10.973   1.507   8.073
  760    H    TYR  95           H        TYR  95  13.042  -0.518   0.822
  761    HA   TYR  95           HA       TYR  95  10.829  -2.140   1.319
  762    HD1  TYR  95           1HD      TYR  95  13.083  -4.827  -0.980
  763    HD2  TYR  95           2HD      TYR  95   9.480  -2.639  -1.562
  764    HE1  TYR  95           1HE      TYR  95  12.117  -6.749  -2.165
  765    HE2  TYR  95           2HE      TYR  95   8.504  -4.565  -2.739
  766    HH   TYR  95           HH       TYR  95   9.289  -6.526  -4.004
  767    HB2  TYR  95           1HB      TYR  95  11.519  -1.496  -0.939
  768    HB3  TYR  95           2HB      TYR  95  13.029  -2.358  -0.759
  769    H    GLU  96           H        GLU  96  14.218  -3.026   1.026
  770    HA   GLU  96           HA       GLU  96  14.326  -5.674   1.781
  771    HB2  GLU  96           1HB      GLU  96  16.204  -4.390   0.935
  772    HB3  GLU  96           2HB      GLU  96  16.165  -3.345   2.334
  773    HG2  GLU  96           1HG      GLU  96  16.873  -5.277   3.723
  774    HG3  GLU  96           2HG      GLU  96  17.019  -6.227   2.239
  775    H    ASP  97           H        ASP  97  14.638  -2.824   3.820
  776    HA   ASP  97           HA       ASP  97  14.891  -3.926   6.346
  777    HB2  ASP  97           1HB      ASP  97  15.324  -1.582   5.924
  778    HB3  ASP  97           2HB      ASP  97  13.644  -1.322   5.493
  779    H    ARG  98           H        ARG  98  11.929  -2.752   4.830
  780    HA   ARG  98           HA       ARG  98  10.146  -3.327   6.934
  781    HE   ARG  98           HE       ARG  98   9.264   1.122   4.185
  782    HB2  ARG  98           1HB      ARG  98   9.512  -3.317   3.979
  783    HB3  ARG  98           2HB      ARG  98   8.395  -3.117   5.325
  784    HG2  ARG  98           1HG      ARG  98   9.147  -0.952   5.784
  785    HG3  ARG  98           2HG      ARG  98  10.629  -1.177   4.845
  786    HD2  ARG  98           1HD      ARG  98   9.203  -1.450   2.818
  787    HD3  ARG  98           2HD      ARG  98   7.811  -0.968   3.762
  788   HH11  ARG  98          1HH1      ARG  98   8.895  -0.723   1.171
  789   HH12  ARG  98          2HH1      ARG  98   9.319   0.573   0.153
  790   HH21  ARG  98          1HH2      ARG  98   9.891   2.918   2.717
  791   HH22  ARG  98          2HH2      ARG  98   9.862   2.615   1.028
  792    H    ALA  99           H        ALA  99  10.869  -5.170   3.952
  793    HA   ALA  99           HA       ALA  99   9.127  -7.288   4.342
  794    HB1  ALA  99           3HB      ALA  99  10.207  -6.757   2.230
  795    HB2  ALA  99           1HB      ALA  99  11.759  -7.229   2.903
  796    HB3  ALA  99           2HB      ALA  99  10.494  -8.439   2.678
  797    H    LYS 100           H        LYS 100  12.547  -6.938   5.201
  798    HA   LYS 100           HA       LYS 100  12.714  -9.606   6.107
  799    HB2  LYS 100           1HB      LYS 100  14.614  -8.079   5.241
  800    HB3  LYS 100           2HB      LYS 100  14.649  -7.429   6.871
  801    HG2  LYS 100           1HG      LYS 100  16.352  -9.134   6.603
  802    HG3  LYS 100           2HG      LYS 100  15.121  -9.679   7.745
  803    HD2  LYS 100           1HD      LYS 100  14.034 -10.971   5.954
  804    HD3  LYS 100           2HD      LYS 100  15.269 -10.428   4.819
  805    HE2  LYS 100           1HE      LYS 100  16.952 -11.612   6.046
  806    HE3  LYS 100           2HE      LYS 100  15.785 -12.031   7.310
  807    HZ1  LYS 100           3HZ      LYS 100  14.582 -13.361   5.711
  808    HZ2  LYS 100           1HZ      LYS 100  16.179 -13.870   5.743
  809    HZ3  LYS 100           2HZ      LYS 100  15.625 -12.934   4.471
  810    H    ALA 101           H        ALA 101  12.032  -6.537   7.642
  811    HA   ALA 101           HA       ALA 101  12.306  -7.449  10.316
  812    HB1  ALA 101           3HB      ALA 101  12.391  -5.055   9.723
  813    HB2  ALA 101           1HB      ALA 101  10.681  -5.117   9.304
  814    HB3  ALA 101           2HB      ALA 101  11.188  -5.396  10.968
  815    H    LYS 102           H        LYS 102   9.481  -7.081   8.192
  816    HA   LYS 102           HA       LYS 102   7.704  -7.975  10.240
  817    HB2  LYS 102           1HB      LYS 102   7.251  -7.651   7.282
  818    HB3  LYS 102           2HB      LYS 102   5.994  -8.085   8.423
  819    HG2  LYS 102           1HG      LYS 102   7.569  -5.516   8.367
  820    HG3  LYS 102           2HG      LYS 102   5.887  -5.731   7.899
  821    HD2  LYS 102           1HD      LYS 102   7.033  -6.076  10.695
  822    HD3  LYS 102           2HD      LYS 102   6.058  -4.725  10.133
  823    HE2  LYS 102           1HE      LYS 102   4.148  -6.242   9.790
  824    HE3  LYS 102           2HE      LYS 102   5.141  -7.597  10.304
  825    HZ1  LYS 102           3HZ      LYS 102   5.348  -6.627  12.479
  826    HZ2  LYS 102           1HZ      LYS 102   3.718  -6.766  12.115
  827    HZ3  LYS 102           2HZ      LYS 102   4.486  -5.265  12.040
  828    H    GLY 103           H        GLY 103   9.424  -9.556   7.706
  829    HA2  GLY 103           1HA      GLY 103   9.983 -11.893   8.169
  830    HA3  GLY 103           2HA      GLY 103   8.349 -12.080   8.791
  831    H    ILE 104           H        ILE 104   9.558 -10.592   5.845
  832    HA   ILE 104           HA       ILE 104   7.859 -12.409   4.300
  833    HB   ILE 104           HB       ILE 104   9.228  -9.811   3.501
  834   HG12  ILE 104          1HG1      ILE 104   7.318  -9.402   5.036
  835   HG13  ILE 104          2HG1      ILE 104   6.969  -8.817   3.410
  836   HG21  ILE 104          1HG2      ILE 104   7.267 -11.468   1.902
  837   HG22  ILE 104          2HG2      ILE 104   9.004 -11.332   1.603
  838   HG23  ILE 104          3HG2      ILE 104   7.967  -9.915   1.437
  839   HD11  ILE 104          3HD1      ILE 104   5.083  -9.891   4.436
  840   HD12  ILE 104          1HD1      ILE 104   6.033 -11.358   4.668
  841   HD13  ILE 104          2HD1      ILE 104   5.650 -10.806   3.036
  842    H    VAL 105           H        VAL 105   8.913 -14.056   3.389
  843    HA   VAL 105           HA       VAL 105  11.709 -14.255   3.507
  844    HB   VAL 105           HB       VAL 105  10.441 -16.303   3.663
  845   HG11  VAL 105          1HG1      VAL 105   9.156 -17.249   1.815
  846   HG12  VAL 105          2HG1      VAL 105   8.482 -15.716   2.373
  847   HG13  VAL 105          3HG1      VAL 105   9.432 -15.776   0.886
  848   HG21  VAL 105          3HG2      VAL 105  11.971 -16.275   1.062
  849   HG22  VAL 105          1HG2      VAL 105  11.532 -17.720   1.974
  850   HG23  VAL 105          2HG2      VAL 105  12.648 -16.546   2.666
  851    H    ILE 106           H        ILE 106  12.999 -13.094   2.406
  852    HA   ILE 106           HA       ILE 106  12.667 -12.924  -0.496
  853    HB   ILE 106           HB       ILE 106  13.330 -10.620  -0.570
  854   HG12  ILE 106          1HG1      ILE 106  14.168 -10.959   2.328
  855   HG13  ILE 106          2HG1      ILE 106  15.084 -10.523   0.949
  856   HG21  ILE 106          1HG2      ILE 106  11.352 -10.826   1.676
  857   HG22  ILE 106          2HG2      ILE 106  10.997 -10.819  -0.051
  858   HG23  ILE 106          3HG2      ILE 106  11.664  -9.379   0.715
  859   HD11  ILE 106          3HD1      ILE 106  14.117  -8.346   0.764
  860   HD12  ILE 106          1HD1      ILE 106  14.728  -8.577   2.405
  861   HD13  ILE 106          2HD1      ILE 106  12.996  -8.696   2.077
  862    HA   PRO 107           HA       PRO 107  16.960 -14.168  -0.725
  863    HB2  PRO 107           1HB      PRO 107  17.458 -11.462  -1.879
  864    HB3  PRO 107           2HB      PRO 107  18.029 -13.053  -2.393
  865    HG2  PRO 107           1HG      PRO 107  16.043 -11.937  -3.699
  866    HG3  PRO 107           2HG      PRO 107  15.947 -13.657  -3.265
  867    HD2  PRO 107           1HD      PRO 107  14.617 -11.311  -1.997
  868    HD3  PRO 107           2HD      PRO 107  13.978 -12.944  -2.286
  869    H    GLU 108           H        GLU 108  18.239 -14.216   1.043
  870    HA   GLU 108           HA       GLU 108  19.091 -11.660   2.105
  871    HB2  GLU 108           1HB      GLU 108  19.556 -12.832   4.285
  872    HB3  GLU 108           2HB      GLU 108  17.861 -12.747   3.870
  873    HG2  GLU 108           1HG      GLU 108  17.879 -15.084   3.206
  874    HG3  GLU 108           2HG      GLU 108  19.612 -15.176   3.519
  Start of MODEL    6
    1    HA   TYR   1           HA       TYR   1 -21.013  -2.926   3.842
    2    HD1  TYR   1           1HD      TYR   1 -23.376  -3.077   2.577
    3    HD2  TYR   1           2HD      TYR   1 -24.045  -2.070   6.653
    4    HE1  TYR   1           1HE      TYR   1 -25.182  -4.737   2.679
    5    HE2  TYR   1           2HE      TYR   1 -25.864  -3.731   6.762
    6    HH   TYR   1           HH       TYR   1 -27.400  -4.862   5.182
    7    H1   TYR   1           1HT      TYR   1 -21.700  -3.440   6.105
    8    H2   TYR   1           2HT      TYR   1 -20.723  -2.177   6.660
    9    H3   TYR   1           3HT      TYR   1 -20.051  -3.479   5.808
   10    HB2  TYR   1           1HB      TYR   1 -22.529  -0.786   5.366
   11    HB3  TYR   1           2HB      TYR   1 -22.518  -0.925   3.609
   12    H    THR   2           H        THR   2 -18.768  -2.053   5.781
   13    HA   THR   2           HA       THR   2 -17.772   0.097   4.102
   14    HB   THR   2           HB       THR   2 -16.124   0.231   6.118
   15    HG1  THR   2           1HG      THR   2 -16.901  -0.611   8.032
   16   HG21  THR   2          3HG2      THR   2 -17.667   1.673   7.390
   17   HG22  THR   2          1HG2      THR   2 -19.028   0.994   6.502
   18   HG23  THR   2          2HG2      THR   2 -17.818   1.955   5.656
   19    H    ASP   3           H        ASP   3 -18.041  -2.859   3.925
   20    HA   ASP   3           HA       ASP   3 -15.440  -4.097   4.183
   21    HB2  ASP   3           1HB      ASP   3 -18.043  -5.245   3.175
   22    HB3  ASP   3           2HB      ASP   3 -16.639  -6.111   3.778
   23    H    LYS   4           H        LYS   4 -14.146  -3.885   2.516
   24    HA   LYS   4           HA       LYS   4 -13.208  -3.822   0.477
   25    HB2  LYS   4           1HB      LYS   4 -15.709  -5.263  -0.395
   26    HB3  LYS   4           2HB      LYS   4 -14.397  -4.911  -1.506
   27    HG2  LYS   4           1HG      LYS   4 -12.873  -6.222  -0.069
   28    HG3  LYS   4           2HG      LYS   4 -14.240  -6.613   0.976
   29    HD2  LYS   4           1HD      LYS   4 -15.365  -7.715  -0.884
   30    HD3  LYS   4           2HD      LYS   4 -14.041  -7.285  -1.961
   31    HE2  LYS   4           1HE      LYS   4 -13.827  -9.598  -1.272
   32    HE3  LYS   4           2HE      LYS   4 -12.511  -8.648  -0.593
   33    HZ1  LYS   4           3HZ      LYS   4 -14.956  -9.503   0.867
   34    HZ2  LYS   4           1HZ      LYS   4 -13.697  -8.625   1.544
   35    HZ3  LYS   4           2HZ      LYS   4 -13.447 -10.192   1.013
   36    H    TYR   5           H        TYR   5 -12.780  -2.342  -0.973
   37    HA   TYR   5           HA       TYR   5 -12.720  -0.296  -1.714
   38    HD1  TYR   5           1HD      TYR   5 -14.501  -3.153  -3.817
   39    HD2  TYR   5           2HD      TYR   5 -16.938   0.224  -2.958
   40    HE1  TYR   5           1HE      TYR   5 -16.501  -4.498  -4.248
   41    HE2  TYR   5           2HE      TYR   5 -18.951  -1.123  -3.382
   42    HH   TYR   5           HH       TYR   5 -18.865  -4.437  -3.528
   43    HB2  TYR   5           1HB      TYR   5 -14.558   0.470  -3.344
   44    HB3  TYR   5           2HB      TYR   5 -13.580  -0.816  -3.835
   45    H    ASP   6           H        ASP   6 -15.196  -0.627   0.427
   46    HA   ASP   6           HA       ASP   6 -15.765   2.165   0.417
   47    HB2  ASP   6           1HB      ASP   6 -16.560  -0.046   2.291
   48    HB3  ASP   6           2HB      ASP   6 -16.941   1.640   2.621
   49    H    LYS   7           H        LYS   7 -13.912   0.043   2.595
   50    HA   LYS   7           HA       LYS   7 -12.418   2.267   3.588
   51    HB2  LYS   7           1HB      LYS   7 -14.648   1.359   5.408
   52    HB3  LYS   7           2HB      LYS   7 -13.208   2.151   6.013
   53    HG2  LYS   7           1HG      LYS   7 -13.755   4.135   4.663
   54    HG3  LYS   7           2HG      LYS   7 -15.207   3.328   4.080
   55    HD2  LYS   7           1HD      LYS   7 -15.719   4.893   5.897
   56    HD3  LYS   7           2HD      LYS   7 -16.078   3.233   6.369
   57    HE2  LYS   7           1HE      LYS   7 -14.011   3.113   7.626
   58    HE3  LYS   7           2HE      LYS   7 -13.555   4.729   7.087
   59    HZ1  LYS   7           3HZ      LYS   7 -15.363   5.649   8.281
   60    HZ2  LYS   7           1HZ      LYS   7 -14.484   4.683   9.337
   61    HZ3  LYS   7           2HZ      LYS   7 -15.960   4.133   8.736
   62    H    ILE   8           H        ILE   8 -13.572  -0.420   5.595
   63    HA   ILE   8           HA       ILE   8 -10.838  -0.951   6.324
   64    HB   ILE   8           HB       ILE   8 -11.889  -2.643   7.908
   65   HG12  ILE   8          1HG1      ILE   8 -14.439  -1.221   7.085
   66   HG13  ILE   8          2HG1      ILE   8 -14.036  -2.876   6.646
   67   HG21  ILE   8          1HG2      ILE   8 -12.624  -0.898   9.475
   68   HG22  ILE   8          2HG2      ILE   8 -12.649   0.258   8.141
   69   HG23  ILE   8          3HG2      ILE   8 -11.126  -0.472   8.647
   70   HD11  ILE   8          3HD1      ILE   8 -14.090  -3.504   8.994
   71   HD12  ILE   8          1HD1      ILE   8 -15.611  -2.761   8.504
   72   HD13  ILE   8          2HD1      ILE   8 -14.439  -1.833   9.445
   73    H    ASN   9           H        ASN   9 -10.493  -1.556   4.136
   74    HA   ASN   9           HA       ASN   9 -10.742  -4.476   3.839
   75    HB2  ASN   9           1HB      ASN   9 -11.342  -4.167   1.510
   76    HB3  ASN   9           2HB      ASN   9 -12.526  -3.464   2.606
   77   HD21  ASN   9          1HD2      ASN   9  -9.739  -2.593   0.686
   78   HD22  ASN   9          2HD2      ASN   9 -10.187  -1.020   0.256
   79    H    LEU  10           H        LEU  10  -8.354  -2.503   4.391
   80    HA   LEU  10           HA       LEU  10  -7.280  -2.135   1.810
   81    HG   LEU  10           HG       LEU  10  -7.738  -0.053   2.882
   82    HB2  LEU  10           1HB      LEU  10  -5.837  -1.719   4.430
   83    HB3  LEU  10           2HB      LEU  10  -5.323  -1.183   2.852
   84   HD11  LEU  10          1HD1      LEU  10  -8.098   1.035   5.051
   85   HD12  LEU  10          2HD1      LEU  10  -6.963  -0.107   5.773
   86   HD13  LEU  10          3HD1      LEU  10  -8.454  -0.681   5.028
   87   HD21  LEU  10          3HD2      LEU  10  -5.680   1.073   2.359
   88   HD22  LEU  10          1HD2      LEU  10  -5.264   1.143   4.079
   89   HD23  LEU  10          2HD2      LEU  10  -6.669   2.027   3.481
   90    H    GLN  11           H        GLN  11  -6.858  -4.532   4.221
   91    HA   GLN  11           HA       GLN  11  -4.827  -5.825   2.591
   92    HB2  GLN  11           1HB      GLN  11  -4.701  -5.814   5.114
   93    HB3  GLN  11           2HB      GLN  11  -6.136  -6.822   5.119
   94    HG2  GLN  11           1HG      GLN  11  -4.490  -8.394   5.343
   95    HG3  GLN  11           2HG      GLN  11  -4.719  -8.381   3.603
   96   HE21  GLN  11          1HE2      GLN  11  -3.109  -5.714   3.346
   97   HE22  GLN  11          2HE2      GLN  11  -1.519  -6.280   3.618
   98    H    GLU  12           H        GLU  12  -8.238  -5.865   3.141
   99    HA   GLU  12           HA       GLU  12  -8.736  -8.585   2.350
  100    HB2  GLU  12           1HB      GLU  12 -10.556  -6.162   2.347
  101    HB3  GLU  12           2HB      GLU  12 -11.091  -7.804   2.047
  102    HG2  GLU  12           1HG      GLU  12  -9.867  -6.813   4.612
  103    HG3  GLU  12           2HG      GLU  12 -11.586  -7.057   4.320
  104    H    ILE  13           H        ILE  13  -8.338  -5.597   0.887
  105    HA   ILE  13           HA       ILE  13  -9.083  -6.461  -1.741
  106    HB   ILE  13           HB       ILE  13  -8.219  -3.902  -0.507
  107   HG12  ILE  13          1HG1      ILE  13 -10.552  -4.444  -0.288
  108   HG13  ILE  13          2HG1      ILE  13 -10.371  -3.089  -1.389
  109   HG21  ILE  13          1HG2      ILE  13  -8.458  -4.412  -3.429
  110   HG22  ILE  13          2HG2      ILE  13  -7.003  -3.976  -2.527
  111   HG23  ILE  13          3HG2      ILE  13  -8.332  -2.826  -2.671
  112   HD11  ILE  13          3HD1      ILE  13 -11.023  -5.944  -2.068
  113   HD12  ILE  13          1HD1      ILE  13 -10.645  -4.692  -3.260
  114   HD13  ILE  13          2HD1      ILE  13 -12.056  -4.523  -2.215
  115    H    LEU  14           H        LEU  14  -6.112  -5.339  -0.021
  116    HA   LEU  14           HA       LEU  14  -4.372  -5.344  -2.143
  117    HG   LEU  14           HG       LEU  14  -1.726  -6.211  -0.738
  118    HB2  LEU  14           1HB      LEU  14  -3.973  -4.366   0.078
  119    HB3  LEU  14           2HB      LEU  14  -3.711  -5.975   0.710
  120   HD11  LEU  14          1HD1      LEU  14  -2.275  -3.334  -1.457
  121   HD12  LEU  14          2HD1      LEU  14  -2.352  -4.717  -2.552
  122   HD13  LEU  14          3HD1      LEU  14  -0.811  -4.232  -1.850
  123   HD21  LEU  14          3HD2      LEU  14  -0.328  -4.651   0.501
  124   HD22  LEU  14          1HD2      LEU  14  -1.518  -5.423   1.550
  125   HD23  LEU  14          2HD2      LEU  14  -1.773  -3.768   0.999
  126    H    GLU  15           H        GLU  15  -5.665  -7.990  -0.532
  127    HA   GLU  15           HA       GLU  15  -3.666  -9.885  -1.056
  128    HB2  GLU  15           1HB      GLU  15  -5.127 -10.242   0.691
  129    HB3  GLU  15           2HB      GLU  15  -6.569 -10.066  -0.304
  130    HG2  GLU  15           1HG      GLU  15  -6.118 -12.196  -1.355
  131    HG3  GLU  15           2HG      GLU  15  -4.582 -12.320  -0.496
  132    H    ASN  16           H        ASN  16  -5.919  -8.431  -3.197
  133    HA   ASN  16           HA       ASN  16  -5.066 -10.262  -5.331
  134    HB2  ASN  16           1HB      ASN  16  -7.966  -9.614  -4.766
  135    HB3  ASN  16           2HB      ASN  16  -7.397 -10.278  -6.285
  136   HD21  ASN  16          1HD2      ASN  16  -8.167 -10.874  -3.017
  137   HD22  ASN  16          2HD2      ASN  16  -8.031 -12.587  -3.059
  138    H    LYS  17           H        LYS  17  -4.101  -8.812  -6.684
  139    HA   LYS  17           HA       LYS  17  -4.483  -6.193  -7.133
  140    HB2  LYS  17           1HB      LYS  17  -3.743  -6.449  -9.474
  141    HB3  LYS  17           2HB      LYS  17  -2.758  -7.311  -8.322
  142    HG2  LYS  17           1HG      LYS  17  -4.859  -8.611 -10.051
  143    HG3  LYS  17           2HG      LYS  17  -3.162  -8.495 -10.496
  144    HD2  LYS  17           1HD      LYS  17  -2.646  -9.707  -8.303
  145    HD3  LYS  17           2HD      LYS  17  -4.371 -10.030  -8.192
  146    HE2  LYS  17           1HE      LYS  17  -3.234 -11.940  -9.144
  147    HE3  LYS  17           2HE      LYS  17  -4.265 -11.197 -10.363
  148    HZ1  LYS  17           3HZ      LYS  17  -2.094 -11.783 -11.242
  149    HZ2  LYS  17           1HZ      LYS  17  -1.336 -10.820 -10.094
  150    HZ3  LYS  17           2HZ      LYS  17  -2.298 -10.105 -11.284
  151    H    ARG  18           H        ARG  18  -6.619  -8.563  -8.440
  152    HA   ARG  18           HA       ARG  18  -8.190  -6.713  -9.931
  153    HE   ARG  18           HE       ARG  18  -7.844 -11.901  -7.311
  154    HB2  ARG  18           1HB      ARG  18 -10.020  -8.497  -9.888
  155    HB3  ARG  18           2HB      ARG  18  -8.502  -8.917 -10.650
  156    HG2  ARG  18           1HG      ARG  18  -8.996  -9.691  -7.801
  157    HG3  ARG  18           2HG      ARG  18  -9.724 -10.617  -9.113
  158    HD2  ARG  18           1HD      ARG  18  -7.485 -11.002 -10.073
  159    HD3  ARG  18           2HD      ARG  18  -6.735 -10.132  -8.745
  160   HH11  ARG  18          1HH1      ARG  18  -6.775 -12.577 -10.631
  161   HH12  ARG  18          2HH1      ARG  18  -6.296 -14.159 -10.263
  162   HH21  ARG  18          1HH2      ARG  18  -7.153 -14.024  -6.847
  163   HH22  ARG  18          2HH2      ARG  18  -6.512 -15.005  -8.077
  164    H    LEU  19           H        LEU  19  -8.214  -7.648  -6.612
  165    HA   LEU  19           HA       LEU  19 -10.659  -6.285  -6.139
  166    HG   LEU  19           HG       LEU  19 -10.014  -9.223  -5.291
  167    HB2  LEU  19           1HB      LEU  19  -8.655  -7.499  -4.254
  168    HB3  LEU  19           2HB      LEU  19 -10.085  -6.650  -3.715
  169   HD11  LEU  19          1HD1      LEU  19  -9.482  -9.393  -2.909
  170   HD12  LEU  19          2HD1      LEU  19 -11.007 -10.183  -3.316
  171   HD13  LEU  19          3HD1      LEU  19 -11.010  -8.607  -2.521
  172   HD21  LEU  19          3HD2      LEU  19 -12.385  -7.576  -4.393
  173   HD22  LEU  19          1HD2      LEU  19 -12.467  -9.214  -5.044
  174   HD23  LEU  19          2HD2      LEU  19 -11.897  -7.899  -6.059
  175    H    LEU  20           H        LEU  20  -7.271  -5.604  -6.230
  176    HA   LEU  20           HA       LEU  20  -7.307  -3.106  -4.879
  177    HG   LEU  20           HG       LEU  20  -4.796  -3.150  -4.313
  178    HB2  LEU  20           1HB      LEU  20  -5.527  -4.259  -7.002
  179    HB3  LEU  20           2HB      LEU  20  -5.406  -2.550  -6.640
  180   HD11  LEU  20          1HD1      LEU  20  -3.982  -5.530  -4.010
  181   HD12  LEU  20          2HD1      LEU  20  -5.023  -5.946  -5.365
  182   HD13  LEU  20          3HD1      LEU  20  -5.715  -5.236  -3.923
  183   HD21  LEU  20          3HD2      LEU  20  -2.558  -3.948  -4.838
  184   HD22  LEU  20          1HD2      LEU  20  -3.093  -2.658  -5.915
  185   HD23  LEU  20          2HD2      LEU  20  -3.103  -4.330  -6.472
  186    H    GLU  21           H        GLU  21  -7.802  -4.098  -8.169
  187    HA   GLU  21           HA       GLU  21  -8.480  -1.712  -9.358
  188    HB2  GLU  21           1HB      GLU  21  -9.541  -4.496  -9.775
  189    HB3  GLU  21           2HB      GLU  21  -9.888  -3.164 -10.861
  190    HG2  GLU  21           1HG      GLU  21  -7.151  -4.199 -10.194
  191    HG3  GLU  21           2HG      GLU  21  -8.029  -4.618 -11.657
  192    H    SER  22           H        SER  22 -10.394  -3.835  -7.317
  193    HA   SER  22           HA       SER  22 -12.843  -2.504  -7.642
  194    HG   SER  22           HG       SER  22 -12.092  -4.950  -7.673
  195    HB2  SER  22           1HB      SER  22 -11.933  -4.105  -5.241
  196    HB3  SER  22           2HB      SER  22 -13.602  -3.735  -5.681
  197    H    TYR  23           H        TYR  23 -10.252  -1.901  -5.139
  198    HA   TYR  23           HA       TYR  23 -11.848   0.472  -4.391
  199    HD1  TYR  23           2HD      TYR  23  -8.266  -1.025  -4.280
  200    HD2  TYR  23           1HD      TYR  23  -9.383   0.365  -0.436
  201    HE1  TYR  23           2HE      TYR  23  -5.909  -1.124  -3.552
  202    HE2  TYR  23           1HE      TYR  23  -7.059   0.285   0.323
  203    HH   TYR  23           HH       TYR  23  -4.466  -0.227  -1.877
  204    HB2  TYR  23           1HB      TYR  23 -10.793   0.694  -2.317
  205    HB3  TYR  23           2HB      TYR  23 -11.037  -0.998  -2.254
  206    H    MET  24           H        MET  24 -10.076   0.043  -6.692
  207    HA   MET  24           HA       MET  24  -7.824   1.698  -6.473
  208    HB2  MET  24           1HB      MET  24  -8.175   0.015  -8.281
  209    HB3  MET  24           2HB      MET  24  -9.329   1.108  -9.029
  210    HG2  MET  24           1HG      MET  24  -7.134   1.225 -10.100
  211    HG3  MET  24           2HG      MET  24  -7.584   2.764  -9.363
  212    HE1  MET  24           3HE      MET  24  -4.455  -0.175  -7.651
  213    HE2  MET  24           1HE      MET  24  -6.182  -0.530  -7.639
  214    HE3  MET  24           2HE      MET  24  -5.312  -0.417  -9.170
  215    H    ASP  25           H        ASP  25 -11.111   2.455  -6.870
  216    HA   ASP  25           HA       ASP  25 -10.839   5.080  -7.823
  217    HB2  ASP  25           1HB      ASP  25 -13.021   4.004  -7.746
  218    HB3  ASP  25           2HB      ASP  25 -12.940   3.948  -5.988
  219    H    CYS  26           H        CYS  26 -10.559   3.648  -4.713
  220    HA   CYS  26           HA       CYS  26 -10.611   6.018  -3.202
  221    HB2  CYS  26           1HB      CYS  26  -9.039   3.590  -2.361
  222    HB3  CYS  26           2HB      CYS  26  -9.917   4.753  -1.398
  223    H    VAL  27           H        VAL  27  -8.141   3.950  -4.592
  224    HA   VAL  27           HA       VAL  27  -6.020   5.548  -3.516
  225    HB   VAL  27           HB       VAL  27  -5.873   3.271  -5.498
  226   HG11  VAL  27          1HG1      VAL  27  -3.874   4.671  -5.575
  227   HG12  VAL  27          2HG1      VAL  27  -3.700   4.541  -3.827
  228   HG13  VAL  27          3HG1      VAL  27  -3.513   3.109  -4.839
  229   HG21  VAL  27          3HG2      VAL  27  -5.509   3.285  -2.501
  230   HG22  VAL  27          1HG2      VAL  27  -5.236   1.901  -3.560
  231   HG23  VAL  27          2HG2      VAL  27  -6.858   2.568  -3.382
  232    H    LEU  28           H        LEU  28  -7.162   4.899  -6.929
  233    HA   LEU  28           HA       LEU  28  -5.460   7.154  -7.592
  234    HG   LEU  28           HG       LEU  28  -5.627   7.023 -10.689
  235    HB2  LEU  28           1HB      LEU  28  -4.873   4.950  -8.615
  236    HB3  LEU  28           2HB      LEU  28  -6.386   5.023  -9.491
  237   HD11  LEU  28          1HD1      LEU  28  -3.078   6.670  -9.101
  238   HD12  LEU  28          2HD1      LEU  28  -4.205   8.033  -8.988
  239   HD13  LEU  28          3HD1      LEU  28  -3.286   7.765 -10.470
  240   HD21  LEU  28          3HD2      LEU  28  -5.136   4.867 -11.656
  241   HD22  LEU  28          1HD2      LEU  28  -3.643   4.758 -10.713
  242   HD23  LEU  28          2HD2      LEU  28  -3.807   5.991 -11.962
  243    H    GLY  29           H        GLY  29  -8.677   6.017  -7.813
  244    HA2  GLY  29           1HA      GLY  29 -10.461   7.614  -8.033
  245    HA3  GLY  29           2HA      GLY  29  -9.370   8.638  -8.979
  246    H    LYS  30           H        LYS  30 -11.418   5.959  -8.964
  247    HA   LYS  30           HA       LYS  30 -11.459   5.758 -11.849
  248    HB2  LYS  30           1HB      LYS  30 -10.439   3.476 -10.185
  249    HB3  LYS  30           2HB      LYS  30 -11.096   3.204 -11.782
  250    HG2  LYS  30           1HG      LYS  30  -9.282   4.884 -12.551
  251    HG3  LYS  30           2HG      LYS  30  -8.603   4.619 -10.935
  252    HD2  LYS  30           1HD      LYS  30  -8.426   2.250 -11.338
  253    HD3  LYS  30           2HD      LYS  30  -9.228   2.415 -12.892
  254    HE2  LYS  30           1HE      LYS  30  -6.581   3.651 -12.170
  255    HE3  LYS  30           2HE      LYS  30  -6.776   2.176 -13.105
  256    HZ1  LYS  30           3HZ      LYS  30  -7.654   4.905 -13.910
  257    HZ2  LYS  30           1HZ      LYS  30  -8.029   3.499 -14.752
  258    HZ3  LYS  30           2HZ      LYS  30  -6.439   3.970 -14.615
  259    H    GLY  31           H        GLY  31 -12.305   3.395  -9.333
  260    HA2  GLY  31           1HA      GLY  31 -14.869   3.087 -10.699
  261    HA3  GLY  31           2HA      GLY  31 -14.160   1.926  -9.604
  262    H    LYS  32           H        LYS  32 -14.888   1.894  -7.501
  263    HA   LYS  32           HA       LYS  32 -16.631   4.082  -6.721
  264    HB2  LYS  32           1HB      LYS  32 -18.360   2.443  -5.938
  265    HB3  LYS  32           2HB      LYS  32 -18.170   2.568  -7.677
  266    HG2  LYS  32           1HG      LYS  32 -16.847   0.495  -7.670
  267    HG3  LYS  32           2HG      LYS  32 -17.073   0.372  -5.923
  268    HD2  LYS  32           1HD      LYS  32 -19.492   0.230  -6.245
  269    HD3  LYS  32           2HD      LYS  32 -19.271   0.377  -7.989
  270    HE2  LYS  32           1HE      LYS  32 -17.976  -1.712  -7.982
  271    HE3  LYS  32           2HE      LYS  32 -18.229  -1.852  -6.244
  272    HZ1  LYS  32           3HZ      LYS  32 -20.651  -1.952  -6.701
  273    HZ2  LYS  32           1HZ      LYS  32 -19.811  -3.223  -7.408
  274    HZ3  LYS  32           2HZ      LYS  32 -20.330  -1.941  -8.346
  275    H    CYS  33           H        CYS  33 -15.519   4.853  -5.083
  276    HA   CYS  33           HA       CYS  33 -15.345   3.212  -2.658
  277    HB2  CYS  33           1HB      CYS  33 -13.439   5.298  -3.680
  278    HB3  CYS  33           2HB      CYS  33 -13.415   4.656  -2.044
  279    H    THR  34           H        THR  34 -15.148   4.779  -0.666
  280    HA   THR  34           HA       THR  34 -17.015   6.967  -1.073
  281    HB   THR  34           HB       THR  34 -17.904   5.170   0.421
  282    HG1  THR  34           1HG      THR  34 -18.747   6.517   1.751
  283   HG21  THR  34          3HG2      THR  34 -16.909   4.772   2.629
  284   HG22  THR  34          1HG2      THR  34 -15.578   5.850   2.217
  285   HG23  THR  34          2HG2      THR  34 -15.793   4.341   1.333
  286    HA   PRO  35           HA       PRO  35 -13.964  10.120  -0.304
  287    HB2  PRO  35           1HB      PRO  35 -15.350  11.273   1.924
  288    HB3  PRO  35           2HB      PRO  35 -15.288  11.859   0.263
  289    HG2  PRO  35           1HG      PRO  35 -17.321  10.157   1.601
  290    HG3  PRO  35           2HG      PRO  35 -17.527  11.289   0.242
  291    HD2  PRO  35           1HD      PRO  35 -17.636   8.669  -0.083
  292    HD3  PRO  35           2HD      PRO  35 -16.802   9.679  -1.286
  293    H    GLU  36           H        GLU  36 -15.252   9.275   2.962
  294    HA   GLU  36           HA       GLU  36 -12.877   9.754   4.332
  295    HB2  GLU  36           1HB      GLU  36 -14.966   9.560   5.521
  296    HB3  GLU  36           2HB      GLU  36 -15.156   7.895   5.009
  297    HG2  GLU  36           1HG      GLU  36 -13.336   7.186   6.381
  298    HG3  GLU  36           2HG      GLU  36 -12.920   8.849   6.780
  299    H    GLY  37           H        GLY  37 -14.013   6.898   2.756
  300    HA2  GLY  37           1HA      GLY  37 -12.063   5.112   3.735
  301    HA3  GLY  37           2HA      GLY  37 -13.031   4.890   2.282
  302    H    LYS  38           H        LYS  38 -12.157   7.323   1.025
  303    HA   LYS  38           HA       LYS  38  -9.880   6.241  -0.290
  304    HB2  LYS  38           1HB      LYS  38 -10.897   9.041  -0.492
  305    HB3  LYS  38           2HB      LYS  38  -9.858   8.215  -1.638
  306    HG2  LYS  38           1HG      LYS  38 -11.861   6.614  -1.942
  307    HG3  LYS  38           2HG      LYS  38 -12.761   7.849  -1.102
  308    HD2  LYS  38           1HD      LYS  38 -11.171   8.387  -3.613
  309    HD3  LYS  38           2HD      LYS  38 -12.894   8.061  -3.582
  310    HE2  LYS  38           1HE      LYS  38 -12.625  10.428  -3.751
  311    HE3  LYS  38           2HE      LYS  38 -13.169  10.080  -2.123
  312    HZ1  LYS  38           3HZ      LYS  38 -10.909  10.541  -1.287
  313    HZ2  LYS  38           1HZ      LYS  38 -11.428  11.778  -2.264
  314    HZ3  LYS  38           2HZ      LYS  38 -10.322  10.682  -2.850
  315    H    GLU  39           H        GLU  39 -10.311   8.659   2.197
  316    HA   GLU  39           HA       GLU  39  -7.650   9.601   1.739
  317    HB2  GLU  39           1HB      GLU  39  -9.798  10.458   3.618
  318    HB3  GLU  39           2HB      GLU  39  -8.136  10.953   3.915
  319    HG2  GLU  39           1HG      GLU  39  -9.122  12.719   2.678
  320    HG3  GLU  39           2HG      GLU  39  -8.080  11.795   1.597
  321    H    LEU  40           H        LEU  40  -9.211   7.461   3.900
  322    HA   LEU  40           HA       LEU  40  -6.941   7.214   5.560
  323    HG   LEU  40           HG       LEU  40  -9.901   5.192   4.210
  324    HB2  LEU  40           1HB      LEU  40  -8.016   5.314   6.538
  325    HB3  LEU  40           2HB      LEU  40  -9.198   6.566   6.325
  326   HD11  LEU  40          1HD1      LEU  40  -7.970   3.638   4.266
  327   HD12  LEU  40          2HD1      LEU  40  -9.505   2.812   4.304
  328   HD13  LEU  40          3HD1      LEU  40  -8.567   2.992   5.790
  329   HD21  LEU  40          3HD2      LEU  40 -11.299   5.498   6.170
  330   HD22  LEU  40          1HD2      LEU  40 -10.434   4.207   7.006
  331   HD23  LEU  40          2HD2      LEU  40 -11.407   3.837   5.584
  332    H    LYS  41           H        LYS  41  -7.961   5.774   2.576
  333    HA   LYS  41           HA       LYS  41  -5.946   3.753   2.540
  334    HB2  LYS  41           1HB      LYS  41  -7.885   4.788   0.498
  335    HB3  LYS  41           2HB      LYS  41  -6.669   3.578   0.099
  336    HG2  LYS  41           1HG      LYS  41  -7.654   1.960   1.307
  337    HG3  LYS  41           2HG      LYS  41  -8.378   3.001   2.489
  338    HD2  LYS  41           1HD      LYS  41  -9.923   3.768   0.719
  339    HD3  LYS  41           2HD      LYS  41  -9.248   2.508  -0.314
  340    HE2  LYS  41           1HE      LYS  41  -9.897   0.821   1.377
  341    HE3  LYS  41           2HE      LYS  41 -10.513   2.113   2.384
  342    HZ1  LYS  41           3HZ      LYS  41 -11.583   1.673  -0.339
  343    HZ2  LYS  41           1HZ      LYS  41 -12.236   2.565   0.912
  344    HZ3  LYS  41           2HZ      LYS  41 -12.205   0.893   1.029
  345    H    ASP  42           H        ASP  42  -6.267   6.981   1.228
  346    HA   ASP  42           HA       ASP  42  -3.994   7.044  -0.392
  347    HB2  ASP  42           1HB      ASP  42  -5.735   8.853  -0.257
  348    HB3  ASP  42           2HB      ASP  42  -5.074   9.320   1.303
  349    H    HIS  43           H        HIS  43  -4.401   7.662   3.040
  350    HA   HIS  43           HA       HIS  43  -1.634   8.286   3.509
  351    HD1  HIS  43           1HD      HIS  43  -5.247   9.787   4.644
  352    HD2  HIS  43           2HD      HIS  43  -1.312  10.646   5.636
  353    HE1  HIS  43           1HE      HIS  43  -5.110  12.285   4.744
  354    HE2  HIS  43           2HE      HIS  43  -2.821  12.726   5.680
  355    HB2  HIS  43           1HB      HIS  43  -3.923   7.763   5.385
  356    HB3  HIS  43           2HB      HIS  43  -2.284   8.012   5.964
  357    H    LEU  44           H        LEU  44  -3.607   5.397   4.047
  358    HA   LEU  44           HA       LEU  44  -1.516   4.033   5.390
  359    HG   LEU  44           HG       LEU  44  -2.215   1.789   6.221
  360    HB2  LEU  44           1HB      LEU  44  -3.981   3.599   5.652
  361    HB3  LEU  44           2HB      LEU  44  -3.972   2.868   4.067
  362   HD11  LEU  44          1HD1      LEU  44  -5.166   1.182   5.936
  363   HD12  LEU  44          2HD1      LEU  44  -4.344   1.899   7.313
  364   HD13  LEU  44          3HD1      LEU  44  -4.015   0.229   6.865
  365   HD21  LEU  44          3HD2      LEU  44  -3.551   0.530   3.798
  366   HD22  LEU  44          1HD2      LEU  44  -2.653  -0.353   5.037
  367   HD23  LEU  44          2HD2      LEU  44  -1.855   0.861   4.052
  368    H    GLN  45           H        GLN  45  -2.676   3.947   2.035
  369    HA   GLN  45           HA       GLN  45  -0.661   2.092   1.366
  370    HB2  GLN  45           1HB      GLN  45  -2.422   3.708  -0.488
  371    HB3  GLN  45           2HB      GLN  45  -1.319   2.451  -1.020
  372    HG2  GLN  45           1HG      GLN  45  -3.829   2.129   0.641
  373    HG3  GLN  45           2HG      GLN  45  -3.494   1.463  -0.951
  374   HE21  GLN  45          1HE2      GLN  45  -4.407  -0.127   1.301
  375   HE22  GLN  45          2HE2      GLN  45  -3.159  -1.200   1.730
  376    H    GLU  46           H        GLU  46  -0.707   5.472   1.616
  377    HA   GLU  46           HA       GLU  46   1.705   6.138   0.310
  378    HB2  GLU  46           1HB      GLU  46   0.355   7.756   1.096
  379    HB3  GLU  46           2HB      GLU  46   0.279   7.166   2.758
  380    HG2  GLU  46           1HG      GLU  46   2.756   7.751   2.824
  381    HG3  GLU  46           2HG      GLU  46   2.467   8.660   1.326
  382    H    ALA  47           H        ALA  47   0.998   4.911   3.532
  383    HA   ALA  47           HA       ALA  47   3.617   4.824   4.569
  384    HB1  ALA  47           3HB      ALA  47   2.648   3.375   6.289
  385    HB2  ALA  47           1HB      ALA  47   1.621   4.779   5.962
  386    HB3  ALA  47           2HB      ALA  47   1.195   3.196   5.303
  387    H    LEU  48           H        LEU  48   1.908   2.854   2.433
  388    HA   LEU  48           HA       LEU  48   3.125   0.391   2.673
  389    HG   LEU  48           HG       LEU  48   3.014  -0.965   0.182
  390    HB2  LEU  48           1HB      LEU  48   1.203   0.560   1.317
  391    HB3  LEU  48           2HB      LEU  48   1.891   1.828   0.348
  392   HD11  LEU  48          1HD1      LEU  48   1.463  -1.341  -1.701
  393   HD12  LEU  48          2HD1      LEU  48   0.661   0.186  -1.344
  394   HD13  LEU  48          3HD1      LEU  48   0.564  -1.147  -0.199
  395   HD21  LEU  48          3HD2      LEU  48   2.766   1.305  -1.790
  396   HD22  LEU  48          1HD2      LEU  48   3.574  -0.235  -2.086
  397   HD23  LEU  48          2HD2      LEU  48   4.210   0.893  -0.877
  398    H    GLU  49           H        GLU  49   4.359   3.228   0.850
  399    HA   GLU  49           HA       GLU  49   6.840   1.685   0.877
  400    HB2  GLU  49           1HB      GLU  49   6.080   1.194  -1.308
  401    HB3  GLU  49           2HB      GLU  49   5.682   2.869  -1.648
  402    HG2  GLU  49           1HG      GLU  49   7.654   1.953  -2.858
  403    HG3  GLU  49           2HG      GLU  49   7.992   3.398  -1.919
  404    H    THR  50           H        THR  50   6.503   4.726  -0.738
  405    HA   THR  50           HA       THR  50   8.741   5.637   0.966
  406    HB   THR  50           HB       THR  50   8.093   6.495  -1.865
  407    HG1  THR  50           1HG      THR  50   9.422   4.232  -0.926
  408   HG21  THR  50          3HG2      THR  50   9.496   8.107  -0.645
  409   HG22  THR  50          1HG2      THR  50  10.408   7.307  -1.927
  410   HG23  THR  50          2HG2      THR  50  10.626   6.813  -0.249
  411    H    GLY  51           H        GLY  51   5.760   5.943   1.204
  412    HA2  GLY  51           1HA      GLY  51   5.432   8.814   1.066
  413    HA3  GLY  51           2HA      GLY  51   4.243   7.632   1.625
  414    H    CYS  52           H        CYS  52   4.380   6.833   3.759
  415    HA   CYS  52           HA       CYS  52   6.499   7.623   5.466
  416    HB2  CYS  52           1HB      CYS  52   5.241   9.746   5.451
  417    HB3  CYS  52           2HB      CYS  52   3.802   8.889   6.000
  418    H    GLU  53           H        GLU  53   6.706   5.535   5.934
  419    HA   GLU  53           HA       GLU  53   4.590   3.792   6.782
  420    HB2  GLU  53           1HB      GLU  53   6.416   2.240   7.264
  421    HB3  GLU  53           2HB      GLU  53   6.618   2.962   5.674
  422    HG2  GLU  53           1HG      GLU  53   8.262   4.515   6.578
  423    HG3  GLU  53           2HG      GLU  53   8.034   3.838   8.180
  424    H    LYS  54           H        LYS  54   6.687   6.027   8.389
  425    HA   LYS  54           HA       LYS  54   6.197   4.717  10.958
  426    HB2  LYS  54           1HB      LYS  54   8.195   6.035  11.753
  427    HB3  LYS  54           2HB      LYS  54   8.513   4.810  10.550
  428    HG2  LYS  54           1HG      LYS  54   9.863   6.649   9.951
  429    HG3  LYS  54           2HG      LYS  54   8.518   6.683   8.821
  430    HD2  LYS  54           1HD      LYS  54   9.011   8.935   9.559
  431    HD3  LYS  54           2HD      LYS  54   7.454   8.448  10.231
  432    HE2  LYS  54           1HE      LYS  54   8.546   7.926  12.363
  433    HE3  LYS  54           2HE      LYS  54  10.104   8.394  11.686
  434    HZ1  LYS  54           3HZ      LYS  54   9.103  10.135  13.047
  435    HZ2  LYS  54           1HZ      LYS  54   7.766  10.184  12.047
  436    HZ3  LYS  54           2HZ      LYS  54   9.254  10.665  11.460
  437    H    CYS  55           H        CYS  55   4.463   6.727   9.509
  438    HA   CYS  55           HA       CYS  55   4.589   9.116  11.002
  439    HB2  CYS  55           1HB      CYS  55   2.756   8.047   8.986
  440    HB3  CYS  55           2HB      CYS  55   2.090   9.281  10.029
  441    H    THR  56           H        THR  56   1.375   7.719  10.975
  442    HA   THR  56           HA       THR  56   1.235   8.196  13.825
  443    HB   THR  56           HB       THR  56  -1.224   7.955  13.309
  444    HG1  THR  56           1HG      THR  56  -1.680   8.132  10.981
  445   HG21  THR  56          3HG2      THR  56  -0.147  10.177  13.420
  446   HG22  THR  56          1HG2      THR  56  -1.407  10.148  12.186
  447   HG23  THR  56          2HG2      THR  56   0.292  10.043  11.718
  448    H    GLU  57           H        GLU  57  -0.323   6.556  14.885
  449    HA   GLU  57           HA       GLU  57   0.692   3.965  14.719
  450    HB2  GLU  57           1HB      GLU  57  -1.122   3.280  16.203
  451    HB3  GLU  57           2HB      GLU  57  -0.500   4.827  16.728
  452    HG2  GLU  57           1HG      GLU  57  -3.077   4.392  15.200
  453    HG3  GLU  57           2HG      GLU  57  -2.944   4.686  16.928
  454    H    ALA  58           H        ALA  58  -2.111   5.459  13.295
  455    HA   ALA  58           HA       ALA  58  -3.213   3.208  12.039
  456    HB1  ALA  58           3HB      ALA  58  -4.420   5.329  12.309
  457    HB2  ALA  58           1HB      ALA  58  -3.343   6.075  11.127
  458    HB3  ALA  58           2HB      ALA  58  -4.430   4.779  10.630
  459    H    GLN  59           H        GLN  59  -0.776   5.525  10.899
  460    HA   GLN  59           HA       GLN  59  -0.653   4.174   8.374
  461    HB2  GLN  59           1HB      GLN  59   1.112   6.373   9.425
  462    HB3  GLN  59           2HB      GLN  59   1.251   5.679   7.817
  463    HG2  GLN  59           1HG      GLN  59  -1.176   6.324   7.487
  464    HG3  GLN  59           2HG      GLN  59  -1.026   7.261   8.966
  465   HE21  GLN  59          1HE2      GLN  59   1.536   6.906   6.555
  466   HE22  GLN  59          2HE2      GLN  59   1.454   8.524   5.982
  467    H    GLU  60           H        GLU  60   1.404   4.187  11.256
  468    HA   GLU  60           HA       GLU  60   3.253   2.509   9.980
  469    HB2  GLU  60           1HB      GLU  60   4.152   1.875  12.211
  470    HB3  GLU  60           2HB      GLU  60   4.066   3.599  11.926
  471    HG2  GLU  60           1HG      GLU  60   2.243   3.831  13.366
  472    HG3  GLU  60           2HG      GLU  60   2.003   2.090  13.515
  473    H    LYS  61           H        LYS  61   0.365   1.667  11.816
  474    HA   LYS  61           HA       LYS  61   0.739  -1.149  11.541
  475    HB2  LYS  61           1HB      LYS  61  -1.809   0.466  11.834
  476    HB3  LYS  61           2HB      LYS  61  -1.741  -1.289  11.878
  477    HG2  LYS  61           1HG      LYS  61  -0.369  -1.216  13.869
  478    HG3  LYS  61           2HG      LYS  61  -0.326   0.543  13.803
  479    HD2  LYS  61           1HD      LYS  61  -1.958  -0.183  15.455
  480    HD3  LYS  61           2HD      LYS  61  -2.773   0.605  14.110
  481    HE2  LYS  61           1HE      LYS  61  -3.966  -1.412  14.848
  482    HE3  LYS  61           2HE      LYS  61  -3.398  -1.573  13.189
  483    HZ1  LYS  61           3HZ      LYS  61  -2.070  -2.751  15.589
  484    HZ2  LYS  61           1HZ      LYS  61  -1.556  -2.921  13.998
  485    HZ3  LYS  61           2HZ      LYS  61  -3.014  -3.575  14.493
  486    H    GLY  62           H        GLY  62  -0.413   1.375   9.534
  487    HA2  GLY  62           1HA      GLY  62  -1.653  -0.051   7.479
  488    HA3  GLY  62           2HA      GLY  62  -0.814   1.536   7.391
  489    H    ALA  63           H        ALA  63   1.668   1.022   7.933
  490    HA   ALA  63           HA       ALA  63   2.808   0.048   5.599
  491    HB1  ALA  63           3HB      ALA  63   4.939   0.114   6.809
  492    HB2  ALA  63           1HB      ALA  63   3.970   1.545   7.159
  493    HB3  ALA  63           2HB      ALA  63   4.068   0.236   8.337
  494    H    GLU  64           H        GLU  64   2.527  -1.470   8.751
  495    HA   GLU  64           HA       GLU  64   3.651  -3.988   8.376
  496    HB2  GLU  64           1HB      GLU  64   0.981  -3.589   9.753
  497    HB3  GLU  64           2HB      GLU  64   2.151  -4.856  10.061
  498    HG2  GLU  64           1HG      GLU  64   2.530  -1.934  10.658
  499    HG3  GLU  64           2HG      GLU  64   2.083  -3.173  11.828
  500    H    THR  65           H        THR  65   0.385  -2.981   7.699
  501    HA   THR  65           HA       THR  65  -0.687  -5.417   6.750
  502    HB   THR  65           HB       THR  65  -1.568  -2.562   6.263
  503    HG1  THR  65           1HG      THR  65  -1.432  -2.817   8.461
  504   HG21  THR  65          3HG2      THR  65  -2.761  -4.223   4.892
  505   HG22  THR  65          1HG2      THR  65  -3.819  -3.523   6.120
  506   HG23  THR  65          2HG2      THR  65  -3.142  -5.134   6.355
  507    H    SER  66           H        SER  66   0.126  -2.418   4.973
  508    HA   SER  66           HA       SER  66  -0.347  -3.426   2.462
  509    HG   SER  66           HG       SER  66  -0.864  -0.452   2.181
  510    HB2  SER  66           1HB      SER  66   1.324  -1.127   3.385
  511    HB3  SER  66           2HB      SER  66   0.852  -1.433   1.711
  512    H    ILE  67           H        ILE  67   2.748  -2.990   4.148
  513    HA   ILE  67           HA       ILE  67   4.298  -3.746   1.968
  514    HB   ILE  67           HB       ILE  67   4.929  -3.698   4.930
  515   HG12  ILE  67          1HG1      ILE  67   5.587  -1.786   2.680
  516   HG13  ILE  67          2HG1      ILE  67   4.310  -1.567   3.865
  517   HG21  ILE  67          1HG2      ILE  67   6.849  -3.998   2.613
  518   HG22  ILE  67          2HG2      ILE  67   6.482  -5.237   3.814
  519   HG23  ILE  67          3HG2      ILE  67   7.303  -3.753   4.299
  520   HD11  ILE  67          3HD1      ILE  67   6.220  -0.209   4.395
  521   HD12  ILE  67          1HD1      ILE  67   7.259  -1.644   4.394
  522   HD13  ILE  67          2HD1      ILE  67   6.000  -1.464   5.628
  523    H    ASP  68           H        ASP  68   2.803  -5.672   4.545
  524    HA   ASP  68           HA       ASP  68   4.179  -8.064   4.013
  525    HB2  ASP  68           1HB      ASP  68   2.758  -7.778   6.005
  526    HB3  ASP  68           2HB      ASP  68   1.331  -7.734   4.979
  527    H    TYR  69           H        TYR  69   0.926  -7.069   2.789
  528    HA   TYR  69           HA       TYR  69   1.104  -9.461   1.213
  529    HD1  TYR  69           1HD      TYR  69  -1.243  -9.469  -1.311
  530    HD2  TYR  69           2HD      TYR  69  -1.478 -10.520   2.788
  531    HE1  TYR  69           1HE      TYR  69  -2.030 -11.714  -1.929
  532    HE2  TYR  69           2HE      TYR  69  -2.271 -12.765   2.173
  533    HH   TYR  69           HH       TYR  69  -3.287 -13.869   0.420
  534    HB2  TYR  69           1HB      TYR  69  -1.180  -8.272   2.165
  535    HB3  TYR  69           2HB      TYR  69  -1.187  -7.771   0.473
  536    H    LEU  70           H        LEU  70   1.749  -6.177   0.593
  537    HA   LEU  70           HA       LEU  70   1.539  -6.129  -2.184
  538    HG   LEU  70           HG       LEU  70   3.953  -4.710  -2.832
  539    HB2  LEU  70           1HB      LEU  70   1.874  -4.164  -0.798
  540    HB3  LEU  70           2HB      LEU  70   3.475  -4.732  -0.370
  541   HD11  LEU  70          1HD1      LEU  70   1.481  -2.993  -2.837
  542   HD12  LEU  70          2HD1      LEU  70   1.750  -4.492  -3.721
  543   HD13  LEU  70          3HD1      LEU  70   2.665  -3.047  -4.138
  544   HD21  LEU  70          3HD2      LEU  70   4.491  -2.293  -2.765
  545   HD22  LEU  70          1HD2      LEU  70   4.981  -3.184  -1.319
  546   HD23  LEU  70          2HD2      LEU  70   3.530  -2.183  -1.291
  547    H    ILE  71           H        ILE  71   4.394  -6.762  -0.116
  548    HA   ILE  71           HA       ILE  71   6.010  -7.292  -2.400
  549    HB   ILE  71           HB       ILE  71   6.607  -7.961   0.509
  550   HG12  ILE  71          1HG1      ILE  71   7.323  -5.522  -1.140
  551   HG13  ILE  71          2HG1      ILE  71   6.145  -5.570   0.160
  552   HG21  ILE  71          1HG2      ILE  71   8.470  -7.683  -1.868
  553   HG22  ILE  71          2HG2      ILE  71   8.064  -9.191  -1.052
  554   HG23  ILE  71          3HG2      ILE  71   8.982  -7.950  -0.203
  555   HD11  ILE  71          3HD1      ILE  71   7.919  -6.052   1.763
  556   HD12  ILE  71          1HD1      ILE  71   8.244  -4.557   0.871
  557   HD13  ILE  71          2HD1      ILE  71   9.105  -6.037   0.445
  558    H    LYS  72           H        LYS  72   3.983  -9.223  -0.384
  559    HA   LYS  72           HA       LYS  72   5.156 -11.668  -1.235
  560    HB2  LYS  72           1HB      LYS  72   2.685 -11.095   0.369
  561    HB3  LYS  72           2HB      LYS  72   3.260 -12.731   0.008
  562    HG2  LYS  72           1HG      LYS  72   5.290 -12.393   1.178
  563    HG3  LYS  72           2HG      LYS  72   4.994 -10.646   1.102
  564    HD2  LYS  72           1HD      LYS  72   4.715 -11.623   3.400
  565    HD3  LYS  72           2HD      LYS  72   3.308 -10.776   2.784
  566    HE2  LYS  72           1HE      LYS  72   2.295 -12.919   2.214
  567    HE3  LYS  72           2HE      LYS  72   3.705 -13.760   2.872
  568    HZ1  LYS  72           3HZ      LYS  72   2.011 -11.874   4.400
  569    HZ2  LYS  72           1HZ      LYS  72   3.244 -12.826   5.026
  570    HZ3  LYS  72           2HZ      LYS  72   1.820 -13.554   4.473
  571    H    ASN  73           H        ASN  73   2.082 -10.061  -2.196
  572    HA   ASN  73           HA       ASN  73   2.035 -12.110  -4.339
  573    HB2  ASN  73           1HB      ASN  73   0.138 -12.265  -2.687
  574    HB3  ASN  73           2HB      ASN  73  -0.410 -10.700  -3.266
  575   HD21  ASN  73          1HD2      ASN  73  -1.646 -10.603  -5.317
  576   HD22  ASN  73          2HD2      ASN  73  -2.000 -12.028  -6.124
  577    H    GLU  74           H        GLU  74   1.836  -8.724  -3.659
  578    HA   GLU  74           HA       GLU  74   1.096  -8.288  -6.488
  579    HB2  GLU  74           1HB      GLU  74   0.620  -6.430  -4.157
  580    HB3  GLU  74           2HB      GLU  74   0.181  -6.108  -5.826
  581    HG2  GLU  74           1HG      GLU  74  -0.961  -8.245  -4.032
  582    HG3  GLU  74           2HG      GLU  74  -1.771  -6.786  -4.588
  583    H    LEU  75           H        LEU  75   3.516  -8.740  -6.475
  584    HA   LEU  75           HA       LEU  75   5.323  -6.763  -5.550
  585    HG   LEU  75           HG       LEU  75   7.615  -7.245  -7.660
  586    HB2  LEU  75           1HB      LEU  75   5.964  -9.098  -5.935
  587    HB3  LEU  75           2HB      LEU  75   5.757  -8.872  -7.656
  588   HD11  LEU  75          1HD1      LEU  75   9.053  -7.054  -5.686
  589   HD12  LEU  75          2HD1      LEU  75   7.906  -8.014  -4.754
  590   HD13  LEU  75          3HD1      LEU  75   7.436  -6.430  -5.373
  591   HD21  LEU  75          3HD2      LEU  75   8.278  -9.919  -6.433
  592   HD22  LEU  75          1HD2      LEU  75   9.405  -8.868  -7.290
  593   HD23  LEU  75          2HD2      LEU  75   8.047  -9.589  -8.150
  594    H    GLU  76           H        GLU  76   3.679  -7.174  -8.627
  595    HA   GLU  76           HA       GLU  76   5.274  -5.102  -9.775
  596    HB2  GLU  76           1HB      GLU  76   3.738  -5.226 -11.787
  597    HB3  GLU  76           2HB      GLU  76   4.628  -6.687 -11.417
  598    HG2  GLU  76           1HG      GLU  76   1.754  -6.212 -10.680
  599    HG3  GLU  76           2HG      GLU  76   2.276  -7.034 -12.145
  600    H    ILE  77           H        ILE  77   2.364  -5.199  -8.013
  601    HA   ILE  77           HA       ILE  77   1.430  -2.588  -8.678
  602    HB   ILE  77           HB       ILE  77   1.149  -4.130  -6.074
  603   HG12  ILE  77          1HG1      ILE  77   0.154  -5.232  -8.033
  604   HG13  ILE  77          2HG1      ILE  77  -1.060  -4.762  -6.835
  605   HG21  ILE  77          1HG2      ILE  77  -0.373  -1.686  -6.985
  606   HG22  ILE  77          2HG2      ILE  77   0.808  -1.752  -5.678
  607   HG23  ILE  77          3HG2      ILE  77  -0.715  -2.627  -5.532
  608   HD11  ILE  77          3HD1      ILE  77  -1.672  -2.861  -8.210
  609   HD12  ILE  77          1HD1      ILE  77  -1.838  -4.368  -9.104
  610   HD13  ILE  77          2HD1      ILE  77  -0.455  -3.309  -9.414
  611    H    TRP  78           H        TRP  78   3.695  -3.902  -6.338
  612    HA   TRP  78           HA       TRP  78   4.433  -1.587  -4.990
  613    HD1  TRP  78           HD       TRP  78   6.345  -1.336  -2.906
  614    HE1  TRP  78           1HE      TRP  78   8.787  -0.654  -2.646
  615    HE3  TRP  78           3HE      TRP  78   8.345  -4.189  -6.654
  616    HZ2  TRP  78           2HZ      TRP  78  11.278  -1.251  -3.890
  617    HZ3  TRP  78           3HZ      TRP  78  10.770  -4.078  -7.046
  618    HH2  TRP  78           HH       TRP  78  12.205  -2.641  -5.692
  619    HB2  TRP  78           1HB      TRP  78   5.317  -3.700  -4.213
  620    HB3  TRP  78           2HB      TRP  78   6.111  -3.994  -5.754
  621    H    LYS  79           H        LYS  79   5.701  -2.948  -7.960
  622    HA   LYS  79           HA       LYS  79   7.654  -1.060  -8.539
  623    HB2  LYS  79           1HB      LYS  79   5.936  -2.633 -10.444
  624    HB3  LYS  79           2HB      LYS  79   7.382  -1.752 -10.911
  625    HG2  LYS  79           1HG      LYS  79   8.723  -3.174  -9.440
  626    HG3  LYS  79           2HG      LYS  79   7.269  -4.046  -8.961
  627    HD2  LYS  79           1HD      LYS  79   8.460  -5.315 -10.640
  628    HD3  LYS  79           2HD      LYS  79   6.941  -4.730 -11.304
  629    HE2  LYS  79           1HE      LYS  79   8.789  -4.498 -12.903
  630    HE3  LYS  79           2HE      LYS  79   8.100  -2.934 -12.479
  631    HZ1  LYS  79           3HZ      LYS  79  10.524  -2.928 -12.558
  632    HZ2  LYS  79           1HZ      LYS  79  10.598  -4.074 -11.334
  633    HZ3  LYS  79           2HZ      LYS  79   9.989  -2.533 -11.023
  634    H    GLU  80           H        GLU  80   4.208  -0.953  -9.283
  635    HA   GLU  80           HA       GLU  80   4.374   1.403 -10.860
  636    HB2  GLU  80           1HB      GLU  80   1.970   0.327  -9.378
  637    HB3  GLU  80           2HB      GLU  80   1.950   1.519 -10.669
  638    HG2  GLU  80           1HG      GLU  80   2.945  -0.231 -12.170
  639    HG3  GLU  80           2HG      GLU  80   2.692  -1.388 -10.869
  640    H    LEU  81           H        LEU  81   3.852   0.787  -7.457
  641    HA   LEU  81           HA       LEU  81   3.363   3.549  -6.954
  642    HG   LEU  81           HG       LEU  81   1.776   0.949  -6.143
  643    HB2  LEU  81           1HB      LEU  81   3.882   1.418  -4.833
  644    HB3  LEU  81           2HB      LEU  81   3.305   3.035  -4.599
  645   HD11  LEU  81          1HD1      LEU  81   0.224   0.987  -4.273
  646   HD12  LEU  81          2HD1      LEU  81   1.309   2.074  -3.400
  647   HD13  LEU  81          3HD1      LEU  81   1.829   0.428  -3.789
  648   HD21  LEU  81          3HD2      LEU  81   1.038   3.771  -5.345
  649   HD22  LEU  81          1HD2      LEU  81  -0.066   2.593  -6.055
  650   HD23  LEU  81          2HD2      LEU  81   1.304   3.178  -6.985
  651    H    THR  82           H        THR  82   6.187   1.523  -6.944
  652    HA   THR  82           HA       THR  82   8.045   3.273  -5.740
  653    HB   THR  82           HB       THR  82   8.547   1.682  -8.284
  654    HG1  THR  82           1HG      THR  82   8.136   0.780  -5.657
  655   HG21  THR  82          3HG2      THR  82  10.353   2.426  -5.977
  656   HG22  THR  82          1HG2      THR  82  10.346   3.181  -7.575
  657   HG23  THR  82          2HG2      THR  82  10.827   1.490  -7.400
  658    H    ALA  83           H        ALA  83   6.949   3.076  -9.079
  659    HA   ALA  83           HA       ALA  83   8.282   5.286 -10.097
  660    HB1  ALA  83           3HB      ALA  83   7.133   3.589 -11.451
  661    HB2  ALA  83           1HB      ALA  83   5.587   4.232 -10.911
  662    HB3  ALA  83           2HB      ALA  83   6.650   5.229 -11.901
  663    H    HIS  84           H        HIS  84   5.302   5.049  -8.344
  664    HA   HIS  84           HA       HIS  84   4.338   7.688  -8.804
  665    HD1  HIS  84           1HD      HIS  84   0.958   7.400  -8.455
  666    HD2  HIS  84           2HD      HIS  84   2.942   7.945  -4.850
  667    HE1  HIS  84           1HE      HIS  84  -0.495   8.938  -7.113
  668    HE2  HIS  84           2HE      HIS  84   0.559   8.870  -4.826
  669    HB2  HIS  84           1HB      HIS  84   2.867   5.804  -8.161
  670    HB3  HIS  84           2HB      HIS  84   3.651   5.737  -6.594
  671    H    PHE  85           H        PHE  85   6.472   6.312  -6.373
  672    HA   PHE  85           HA       PHE  85   6.442   8.892  -4.969
  673    HD1  PHE  85           2HD      PHE  85   5.267   8.932  -2.581
  674    HD2  PHE  85           1HD      PHE  85   5.545   4.850  -3.730
  675    HE1  PHE  85           2HE      PHE  85   3.046   8.511  -1.617
  676    HE2  PHE  85           1HE      PHE  85   3.324   4.421  -2.769
  677    HZ   PHE  85           HZ       PHE  85   2.070   6.252  -1.716
  678    HB2  PHE  85           1HB      PHE  85   7.416   6.220  -3.951
  679    HB3  PHE  85           2HB      PHE  85   7.494   7.760  -3.097
  680    H    ASP  86           H        ASP  86   8.923   6.343  -5.462
  681    HA   ASP  86           HA       ASP  86  10.844   8.418  -6.157
  682    HB2  ASP  86           1HB      ASP  86  11.322   7.722  -3.816
  683    HB3  ASP  86           2HB      ASP  86  11.362   6.038  -4.324
  684    HA   PRO  87           HA       PRO  87  10.438   5.219  -9.336
  685    HB2  PRO  87           1HB      PRO  87  10.979   6.777 -11.444
  686    HB3  PRO  87           2HB      PRO  87   9.430   6.818 -10.565
  687    HG2  PRO  87           1HG      PRO  87  11.817   8.586 -10.174
  688    HG3  PRO  87           2HG      PRO  87  10.141   9.101 -10.515
  689    HD2  PRO  87           1HD      PRO  87  11.155   9.044  -8.057
  690    HD3  PRO  87           2HD      PRO  87   9.472   8.545  -8.348
  691    H    ASP  88           H        ASP  88  13.077   6.815  -8.119
  692    HA   ASP  88           HA       ASP  88  15.086   5.758  -9.923
  693    HB2  ASP  88           1HB      ASP  88  15.260   7.050  -7.193
  694    HB3  ASP  88           2HB      ASP  88  16.662   6.473  -8.075
  695    H    GLY  89           H        GLY  89  13.292   4.787  -7.154
  696    HA2  GLY  89           1HA      GLY  89  13.197   2.802  -6.021
  697    HA3  GLY  89           2HA      GLY  89  14.321   2.123  -7.203
  698    H    LYS  90           H        LYS  90  14.902   5.019  -5.376
  699    HA   LYS  90           HA       LYS  90  17.475   3.993  -4.627
  700    HB2  LYS  90           1HB      LYS  90  17.107   6.344  -5.374
  701    HB3  LYS  90           2HB      LYS  90  16.195   6.630  -3.902
  702    HG2  LYS  90           1HG      LYS  90  18.403   7.488  -3.576
  703    HG3  LYS  90           2HG      LYS  90  18.194   6.039  -2.598
  704    HD2  LYS  90           1HD      LYS  90  20.351   5.904  -3.573
  705    HD3  LYS  90           2HD      LYS  90  19.345   4.746  -4.421
  706    HE2  LYS  90           1HE      LYS  90  20.724   5.950  -6.001
  707    HE3  LYS  90           2HE      LYS  90  19.036   6.386  -6.250
  708    HZ1  LYS  90           3HZ      LYS  90  20.497   8.293  -6.321
  709    HZ2  LYS  90           1HZ      LYS  90  21.035   8.014  -4.751
  710    HZ3  LYS  90           2HZ      LYS  90  19.427   8.450  -5.044
  711    H    TRP  91           H        TRP  91  14.427   4.094  -3.228
  712    HA   TRP  91           HA       TRP  91  15.345   3.923  -0.513
  713    HD1  TRP  91           HD       TRP  91  13.787   6.350  -2.551
  714    HE1  TRP  91           1HE      TRP  91  13.616   8.587  -1.317
  715    HE3  TRP  91           3HE      TRP  91  12.508   4.614   2.086
  716    HZ2  TRP  91           2HZ      TRP  91  13.001   9.511   1.283
  717    HZ3  TRP  91           3HZ      TRP  91  12.139   6.242   3.887
  718    HH2  TRP  91           HH       TRP  91  12.380   8.642   3.492
  719    HB2  TRP  91           1HB      TRP  91  12.607   3.838  -1.757
  720    HB3  TRP  91           2HB      TRP  91  12.860   3.514  -0.042
  721    H    ARG  92           H        ARG  92  15.945   1.988  -2.651
  722    HA   ARG  92           HA       ARG  92  15.112  -0.602  -2.344
  723    HE   ARG  92           HE       ARG  92  20.284   2.271  -2.722
  724    HB2  ARG  92           1HB      ARG  92  17.502  -1.218  -2.894
  725    HB3  ARG  92           2HB      ARG  92  16.781  -0.032  -3.977
  726    HG2  ARG  92           1HG      ARG  92  17.951   1.773  -2.811
  727    HG3  ARG  92           2HG      ARG  92  18.628   0.617  -1.677
  728    HD2  ARG  92           1HD      ARG  92  19.889  -0.428  -3.473
  729    HD3  ARG  92           2HD      ARG  92  19.158   0.668  -4.649
  730   HH11  ARG  92          1HH1      ARG  92  21.527  -0.173  -4.962
  731   HH12  ARG  92          2HH1      ARG  92  23.046   0.563  -5.156
  732   HH21  ARG  92          1HH2      ARG  92  22.386   3.289  -2.975
  733   HH22  ARG  92          2HH2      ARG  92  23.545   2.585  -3.993
  734    H    LYS  93           H        LYS  93  17.253   1.230  -0.239
  735    HA   LYS  93           HA       LYS  93  18.123  -0.927   1.356
  736    HB2  LYS  93           1HB      LYS  93  19.294   1.267   1.050
  737    HB3  LYS  93           2HB      LYS  93  18.015   2.000   1.980
  738    HG2  LYS  93           1HG      LYS  93  19.700   1.781   3.569
  739    HG3  LYS  93           2HG      LYS  93  18.706   0.362   3.863
  740    HD2  LYS  93           1HD      LYS  93  21.226   0.341   2.181
  741    HD3  LYS  93           2HD      LYS  93  21.204  -0.015   3.895
  742    HE2  LYS  93           1HE      LYS  93  19.796  -1.623   1.730
  743    HE3  LYS  93           2HE      LYS  93  21.285  -2.029   2.533
  744    HZ1  LYS  93           3HZ      LYS  93  19.493  -3.241   3.535
  745    HZ2  LYS  93           1HZ      LYS  93  18.649  -1.834   3.937
  746    HZ3  LYS  93           2HZ      LYS  93  20.126  -2.167   4.643
  747    H    LYS  94           H        LYS  94  15.519   1.431   1.567
  748    HA   LYS  94           HA       LYS  94  14.840   0.629   4.227
  749    HB2  LYS  94           1HB      LYS  94  14.508   2.975   3.187
  750    HB3  LYS  94           2HB      LYS  94  13.081   2.288   2.426
  751    HG2  LYS  94           1HG      LYS  94  12.434   3.457   4.442
  752    HG3  LYS  94           2HG      LYS  94  12.195   1.723   4.677
  753    HD2  LYS  94           1HD      LYS  94  14.294   1.574   5.912
  754    HD3  LYS  94           2HD      LYS  94  14.616   3.278   5.606
  755    HE2  LYS  94           1HE      LYS  94  13.813   2.983   7.866
  756    HE3  LYS  94           2HE      LYS  94  12.604   3.842   6.921
  757    HZ1  LYS  94           3HZ      LYS  94  11.762   2.080   8.404
  758    HZ2  LYS  94           1HZ      LYS  94  12.505   0.920   7.451
  759    HZ3  LYS  94           2HZ      LYS  94  11.245   1.916   6.829
  760    H    TYR  95           H        TYR  95  13.735   0.027   0.966
  761    HA   TYR  95           HA       TYR  95  11.439  -1.468   1.427
  762    HD1  TYR  95           2HD      TYR  95   9.921  -2.326  -0.692
  763    HD2  TYR  95           1HD      TYR  95  13.800  -3.844  -1.552
  764    HE1  TYR  95           2HE      TYR  95   8.915  -4.288  -1.773
  765    HE2  TYR  95           1HE      TYR  95  12.801  -5.813  -2.632
  766    HH   TYR  95           HH       TYR  95   9.530  -5.934  -3.458
  767    HB2  TYR  95           1HB      TYR  95  12.035  -0.869  -0.806
  768    HB3  TYR  95           2HB      TYR  95  13.591  -1.683  -0.689
  769    H    GLU  96           H        GLU  96  14.779  -2.585   1.130
  770    HA   GLU  96           HA       GLU  96  14.458  -5.273   1.837
  771    HB2  GLU  96           1HB      GLU  96  16.501  -4.285   0.863
  772    HB3  GLU  96           2HB      GLU  96  16.790  -3.423   2.363
  773    HG2  GLU  96           1HG      GLU  96  16.915  -5.649   3.499
  774    HG3  GLU  96           2HG      GLU  96  16.893  -6.383   1.897
  775    H    ASP  97           H        ASP  97  15.019  -2.393   3.747
  776    HA   ASP  97           HA       ASP  97  15.418  -3.388   6.287
  777    HB2  ASP  97           1HB      ASP  97  15.731  -1.046   5.836
  778    HB3  ASP  97           2HB      ASP  97  14.058  -0.888   5.335
  779    H    ARG  98           H        ARG  98  12.267  -2.395   4.889
  780    HA   ARG  98           HA       ARG  98  10.891  -3.427   7.165
  781    HE   ARG  98           HE       ARG  98   9.709  -1.317   3.376
  782    HB2  ARG  98           1HB      ARG  98   9.724  -2.747   4.460
  783    HB3  ARG  98           2HB      ARG  98   8.779  -3.325   5.812
  784    HG2  ARG  98           1HG      ARG  98   8.416  -1.080   6.004
  785    HG3  ARG  98           2HG      ARG  98   9.835  -1.249   7.025
  786    HD2  ARG  98           1HD      ARG  98   9.980   0.672   5.516
  787    HD3  ARG  98           2HD      ARG  98  11.263  -0.503   5.236
  788   HH11  ARG  98          1HH1      ARG  98   9.712   2.129   4.334
  789   HH12  ARG  98          2HH1      ARG  98   9.499   2.658   2.721
  790   HH21  ARG  98          1HH2      ARG  98   9.489  -0.458   1.137
  791   HH22  ARG  98          2HH2      ARG  98   9.478   1.194   0.920
  792    H    ALA  99           H        ALA  99  11.317  -4.687   3.880
  793    HA   ALA  99           HA       ALA  99   9.673  -6.875   4.048
  794    HB1  ALA  99           3HB      ALA  99  10.927  -7.810   2.210
  795    HB2  ALA  99           1HB      ALA  99  10.741  -6.069   1.994
  796    HB3  ALA  99           2HB      ALA  99  12.279  -6.726   2.551
  797    H    LYS 100           H        LYS 100  13.166  -6.812   4.852
  798    HA   LYS 100           HA       LYS 100  12.934  -9.536   5.545
  799    HB2  LYS 100           1HB      LYS 100  15.028  -8.472   4.579
  800    HB3  LYS 100           2HB      LYS 100  15.309  -7.795   6.175
  801    HG2  LYS 100           1HG      LYS 100  16.598  -9.860   5.776
  802    HG3  LYS 100           2HG      LYS 100  15.487  -9.998   7.140
  803    HD2  LYS 100           1HD      LYS 100  13.867 -11.165   5.716
  804    HD3  LYS 100           2HD      LYS 100  14.952 -10.999   4.338
  805    HE2  LYS 100           1HE      LYS 100  16.559 -12.406   5.368
  806    HE3  LYS 100           2HE      LYS 100  15.639 -12.467   6.875
  807    HZ1  LYS 100           3HZ      LYS 100  14.780 -13.627   4.246
  808    HZ2  LYS 100           1HZ      LYS 100  13.866 -13.622   5.672
  809    HZ3  LYS 100           2HZ      LYS 100  15.294 -14.469   5.608
  810    H    ALA 101           H        ALA 101  12.612  -6.552   7.320
  811    HA   ALA 101           HA       ALA 101  13.037  -7.724   9.877
  812    HB1  ALA 101           3HB      ALA 101  12.062  -5.707  10.779
  813    HB2  ALA 101           1HB      ALA 101  13.198  -5.326   9.485
  814    HB3  ALA 101           2HB      ALA 101  11.461  -5.256   9.180
  815    H    LYS 102           H        LYS 102  10.181  -7.242   7.854
  816    HA   LYS 102           HA       LYS 102   8.348  -7.996   9.936
  817    HB2  LYS 102           1HB      LYS 102   7.668  -8.117   6.999
  818    HB3  LYS 102           2HB      LYS 102   6.591  -7.834   8.349
  819    HG2  LYS 102           1HG      LYS 102   8.554  -5.937   7.094
  820    HG3  LYS 102           2HG      LYS 102   6.806  -5.783   7.209
  821    HD2  LYS 102           1HD      LYS 102   8.721  -5.704   9.536
  822    HD3  LYS 102           2HD      LYS 102   8.057  -4.283   8.745
  823    HE2  LYS 102           1HE      LYS 102   5.803  -5.011   9.385
  824    HE3  LYS 102           2HE      LYS 102   6.496  -6.420  10.185
  825    HZ1  LYS 102           3HZ      LYS 102   7.675  -4.947  11.699
  826    HZ2  LYS 102           1HZ      LYS 102   6.008  -4.574  11.701
  827    HZ3  LYS 102           2HZ      LYS 102   7.065  -3.606  10.856
  828    H    GLY 103           H        GLY 103  10.221  -9.674   7.671
  829    HA2  GLY 103           1HA      GLY 103  10.620 -12.015   7.923
  830    HA3  GLY 103           2HA      GLY 103   8.995 -12.181   8.579
  831    H    ILE 104           H        ILE 104   9.622 -10.270   5.753
  832    HA   ILE 104           HA       ILE 104   7.877 -11.854   4.149
  833    HB   ILE 104           HB       ILE 104   9.819  -9.645   3.367
  834   HG12  ILE 104          1HG1      ILE 104   8.261  -8.773   5.007
  835   HG13  ILE 104          2HG1      ILE 104   7.881  -8.112   3.425
  836   HG21  ILE 104          1HG2      ILE 104   7.437 -10.709   1.872
  837   HG22  ILE 104          2HG2      ILE 104   9.140 -10.928   1.448
  838   HG23  ILE 104          3HG2      ILE 104   8.420  -9.319   1.409
  839   HD11  ILE 104          3HD1      ILE 104   5.912  -8.690   4.726
  840   HD12  ILE 104          1HD1      ILE 104   6.418 -10.372   4.766
  841   HD13  ILE 104          2HD1      ILE 104   5.993  -9.619   3.223
  842    H    VAL 105           H        VAL 105   8.533 -13.512   2.772
  843    HA   VAL 105           HA       VAL 105  11.187 -14.368   3.284
  844    HB   VAL 105           HB       VAL 105   9.507 -16.104   3.256
  845   HG11  VAL 105          1HG1      VAL 105   8.410 -16.883   1.208
  846   HG12  VAL 105          2HG1      VAL 105   7.922 -15.251   1.673
  847   HG13  VAL 105          3HG1      VAL 105   9.064 -15.488   0.350
  848   HG21  VAL 105          3HG2      VAL 105  11.751 -16.795   2.680
  849   HG22  VAL 105          1HG2      VAL 105  11.454 -16.439   0.977
  850   HG23  VAL 105          2HG2      VAL 105  10.583 -17.753   1.770
  851    H    ILE 106           H        ILE 106  12.624 -13.266   2.518
  852    HA   ILE 106           HA       ILE 106  13.228 -13.460  -0.308
  853    HB   ILE 106           HB       ILE 106  14.139 -11.198  -0.402
  854   HG12  ILE 106          1HG1      ILE 106  13.635 -11.197   2.549
  855   HG13  ILE 106          2HG1      ILE 106  15.099 -10.944   1.686
  856   HG21  ILE 106          1HG2      ILE 106  11.392 -11.016   0.807
  857   HG22  ILE 106          2HG2      ILE 106  11.787 -11.245  -0.897
  858   HG23  ILE 106          3HG2      ILE 106  12.202  -9.730  -0.091
  859   HD11  ILE 106          3HD1      ILE 106  14.455  -8.777   0.868
  860   HD12  ILE 106          1HD1      ILE 106  14.315  -8.806   2.625
  861   HD13  ILE 106          2HD1      ILE 106  12.870  -8.924   1.616
  862    HA   PRO 107           HA       PRO 107  16.619 -15.275   1.533
  863    HB2  PRO 107           1HB      PRO 107  18.688 -14.862  -0.069
  864    HB3  PRO 107           2HB      PRO 107  17.159 -15.668  -0.539
  865    HG2  PRO 107           1HG      PRO 107  17.876 -12.797  -1.009
  866    HG3  PRO 107           2HG      PRO 107  17.433 -14.019  -2.220
  867    HD2  PRO 107           1HD      PRO 107  15.607 -12.371  -1.158
  868    HD3  PRO 107           2HD      PRO 107  15.216 -14.063  -1.545
  869    H    GLU 108           H        GLU 108  17.846 -15.063   3.150
  870    HA   GLU 108           HA       GLU 108  18.956 -12.519   3.893
  871    HB2  GLU 108           1HB      GLU 108  19.774 -13.956   5.927
  872    HB3  GLU 108           2HB      GLU 108  18.085 -13.525   5.833
  873    HG2  GLU 108           1HG      GLU 108  19.134 -16.190   4.874
  874    HG3  GLU 108           2HG      GLU 108  18.653 -15.905   6.545
  Start of MODEL    7
    1    HA   TYR   1           HA       TYR   1 -20.295  -1.240  -0.972
    2    HD1  TYR   1           1HD      TYR   1 -24.547  -1.489  -1.183
    3    HD2  TYR   1           2HD      TYR   1 -22.670   1.945   0.481
    4    HE1  TYR   1           1HE      TYR   1 -26.634  -0.908  -0.023
    5    HE2  TYR   1           2HE      TYR   1 -24.746   2.521   1.643
    6    HH   TYR   1           HH       TYR   1 -27.254   0.409   2.040
    7    H1   TYR   1           1HT      TYR   1 -21.159  -3.026   0.412
    8    H2   TYR   1           2HT      TYR   1 -21.967  -2.875  -1.035
    9    H3   TYR   1           3HT      TYR   1 -22.688  -2.301   0.378
   10    HB2  TYR   1           1HB      TYR   1 -21.652   0.772  -1.375
   11    HB3  TYR   1           2HB      TYR   1 -22.413  -0.638  -2.087
   12    H    THR   2           H        THR   2 -21.404  -2.045   1.956
   13    HA   THR   2           HA       THR   2 -19.881   0.058   3.260
   14    HB   THR   2           HB       THR   2 -22.324  -1.389   4.399
   15    HG1  THR   2           1HG      THR   2 -23.472   0.529   3.932
   16   HG21  THR   2          3HG2      THR   2 -20.760  -0.407   6.047
   17   HG22  THR   2          1HG2      THR   2 -22.305   0.444   6.044
   18   HG23  THR   2          2HG2      THR   2 -20.906   1.156   5.246
   19    H    ASP   3           H        ASP   3 -18.675  -1.852   2.228
   20    HA   ASP   3           HA       ASP   3 -17.537  -3.676   3.889
   21    HB2  ASP   3           1HB      ASP   3 -18.574  -5.830   3.196
   22    HB3  ASP   3           2HB      ASP   3 -19.730  -4.846   4.079
   23    H    LYS   4           H        LYS   4 -15.785  -4.110   2.823
   24    HA   LYS   4           HA       LYS   4 -14.230  -4.299   1.289
   25    HB2  LYS   4           1HB      LYS   4 -16.467  -5.024  -0.607
   26    HB3  LYS   4           2HB      LYS   4 -14.767  -5.131  -1.025
   27    HG2  LYS   4           1HG      LYS   4 -14.495  -6.785   0.813
   28    HG3  LYS   4           2HG      LYS   4 -16.246  -6.741   1.044
   29    HD2  LYS   4           1HD      LYS   4 -14.846  -7.463  -1.532
   30    HD3  LYS   4           2HD      LYS   4 -15.526  -8.621  -0.392
   31    HE2  LYS   4           1HE      LYS   4 -17.760  -7.700  -0.781
   32    HE3  LYS   4           2HE      LYS   4 -17.086  -6.502  -1.882
   33    HZ1  LYS   4           3HZ      LYS   4 -16.371  -8.263  -3.326
   34    HZ2  LYS   4           1HZ      LYS   4 -18.027  -8.378  -3.077
   35    HZ3  LYS   4           2HZ      LYS   4 -16.970  -9.443  -2.294
   36    H    TYR   5           H        TYR   5 -13.335  -3.381  -0.695
   37    HA   TYR   5           HA       TYR   5 -12.509  -1.608  -1.618
   38    HD1  TYR   5           1HD      TYR   5 -15.314  -3.615  -3.474
   39    HD2  TYR   5           2HD      TYR   5 -16.410   0.388  -2.527
   40    HE1  TYR   5           1HE      TYR   5 -17.681  -4.233  -3.648
   41    HE2  TYR   5           2HE      TYR   5 -18.787  -0.217  -2.697
   42    HH   TYR   5           HH       TYR   5 -19.846  -3.410  -2.770
   43    HB2  TYR   5           1HB      TYR   5 -14.176  -0.130  -3.029
   44    HB3  TYR   5           2HB      TYR   5 -13.658  -1.592  -3.703
   45    H    ASP   6           H        ASP   6 -15.424  -0.396  -0.261
   46    HA   ASP   6           HA       ASP   6 -14.531   2.282  -0.252
   47    HB2  ASP   6           1HB      ASP   6 -16.661   2.820   0.307
   48    HB3  ASP   6           2HB      ASP   6 -16.954   1.225  -0.365
   49    H    LYS   7           H        LYS   7 -14.521  -0.330   2.040
   50    HA   LYS   7           HA       LYS   7 -13.884   1.671   4.108
   51    HB2  LYS   7           1HB      LYS   7 -16.070   0.173   4.189
   52    HB3  LYS   7           2HB      LYS   7 -14.975  -0.997   4.905
   53    HG2  LYS   7           1HG      LYS   7 -15.999   0.156   6.709
   54    HG3  LYS   7           2HG      LYS   7 -14.360   0.786   6.610
   55    HD2  LYS   7           1HD      LYS   7 -15.527   2.754   6.817
   56    HD3  LYS   7           2HD      LYS   7 -15.496   2.602   5.064
   57    HE2  LYS   7           1HE      LYS   7 -17.784   1.912   6.923
   58    HE3  LYS   7           2HE      LYS   7 -17.711   3.233   5.771
   59    HZ1  LYS   7           3HZ      LYS   7 -19.053   1.471   4.915
   60    HZ2  LYS   7           1HZ      LYS   7 -17.813   0.338   5.097
   61    HZ3  LYS   7           2HZ      LYS   7 -17.685   1.594   3.973
   62    H    ILE   8           H        ILE   8 -13.275  -0.383   6.056
   63    HA   ILE   8           HA       ILE   8 -10.432  -0.316   5.956
   64    HB   ILE   8           HB       ILE   8 -10.671  -1.588   8.099
   65   HG12  ILE   8          1HG1      ILE   8 -13.639  -1.183   7.713
   66   HG13  ILE   8          2HG1      ILE   8 -12.868  -2.712   7.316
   67   HG21  ILE   8          1HG2      ILE   8 -10.601   0.848   8.074
   68   HG22  ILE   8          2HG2      ILE   8 -11.717   0.280   9.318
   69   HG23  ILE   8          3HG2      ILE   8 -12.342   0.912   7.795
   70   HD11  ILE   8          3HD1      ILE   8 -13.014  -1.341  10.014
   71   HD12  ILE   8          1HD1      ILE   8 -12.175  -2.860   9.707
   72   HD13  ILE   8          2HD1      ILE   8 -13.926  -2.763   9.510
   73    H    ASN   9           H        ASN   9 -11.347  -1.904   3.848
   74    HA   ASN   9           HA       ASN   9 -10.758  -4.679   4.660
   75    HB2  ASN   9           1HB      ASN   9 -11.944  -5.401   2.733
   76    HB3  ASN   9           2HB      ASN   9 -12.844  -4.008   3.284
   77   HD21  ASN   9          1HD2      ASN   9 -11.206  -1.812   2.084
   78   HD22  ASN   9          2HD2      ASN   9 -11.348  -2.171   0.407
   79    H    LEU  10           H        LEU  10  -8.541  -3.001   4.591
   80    HA   LEU  10           HA       LEU  10  -7.449  -2.559   1.987
   81    HG   LEU  10           HG       LEU  10  -7.723  -0.473   3.576
   82    HB2  LEU  10           1HB      LEU  10  -5.737  -2.517   4.503
   83    HB3  LEU  10           2HB      LEU  10  -5.471  -1.730   2.993
   84   HD11  LEU  10          1HD1      LEU  10  -6.600  -1.218   6.249
   85   HD12  LEU  10          2HD1      LEU  10  -8.264  -1.479   5.689
   86   HD13  LEU  10          3HD1      LEU  10  -7.660   0.147   5.975
   87   HD21  LEU  10          3HD2      LEU  10  -4.987   0.106   4.593
   88   HD22  LEU  10          1HD2      LEU  10  -6.320   1.283   4.593
   89   HD23  LEU  10          2HD2      LEU  10  -5.732   0.629   3.060
   90    H    GLN  11           H        GLN  11  -6.987  -4.963   4.388
   91    HA   GLN  11           HA       GLN  11  -4.890  -6.300   2.980
   92    HB2  GLN  11           1HB      GLN  11  -6.346  -6.754   5.521
   93    HB3  GLN  11           2HB      GLN  11  -5.485  -8.097   4.798
   94    HG2  GLN  11           1HG      GLN  11  -4.214  -6.803   6.523
   95    HG3  GLN  11           2HG      GLN  11  -3.409  -6.975   4.971
   96   HE21  GLN  11          1HE2      GLN  11  -3.032  -5.173   3.738
   97   HE22  GLN  11          2HE2      GLN  11  -3.254  -3.561   4.335
   98    H    GLU  12           H        GLU  12  -8.345  -6.473   3.037
   99    HA   GLU  12           HA       GLU  12  -8.456  -9.163   2.023
  100    HB2  GLU  12           1HB      GLU  12 -10.591  -7.022   1.959
  101    HB3  GLU  12           2HB      GLU  12 -10.828  -8.759   1.827
  102    HG2  GLU  12           1HG      GLU  12  -9.965  -7.223   4.266
  103    HG3  GLU  12           2HG      GLU  12 -11.494  -8.063   4.017
  104    H    ILE  13           H        ILE  13  -8.308  -5.925   1.011
  105    HA   ILE  13           HA       ILE  13  -8.698  -6.336  -1.732
  106    HB   ILE  13           HB       ILE  13  -7.197  -4.171  -0.283
  107   HG12  ILE  13          1HG1      ILE  13  -9.574  -4.015   0.199
  108   HG13  ILE  13          2HG1      ILE  13  -9.096  -2.738  -0.917
  109   HG21  ILE  13          1HG2      ILE  13  -7.279  -2.940  -2.375
  110   HG22  ILE  13          2HG2      ILE  13  -7.958  -4.375  -3.149
  111   HG23  ILE  13          3HG2      ILE  13  -6.324  -4.423  -2.476
  112   HD11  ILE  13          3HD1      ILE  13 -11.199  -3.574  -1.590
  113   HD12  ILE  13          1HD1      ILE  13 -10.595  -5.233  -1.572
  114   HD13  ILE  13          2HD1      ILE  13  -9.987  -4.087  -2.769
  115    H    LEU  14           H        LEU  14  -5.792  -5.554   0.102
  116    HA   LEU  14           HA       LEU  14  -3.822  -5.736  -1.699
  117    HG   LEU  14           HG       LEU  14  -1.463  -6.677  -0.091
  118    HB2  LEU  14           1HB      LEU  14  -3.871  -5.077   0.729
  119    HB3  LEU  14           2HB      LEU  14  -3.625  -6.765   1.092
  120   HD11  LEU  14          1HD1      LEU  14  -0.564  -4.475  -0.687
  121   HD12  LEU  14          2HD1      LEU  14  -2.130  -3.744  -0.340
  122   HD13  LEU  14          3HD1      LEU  14  -1.963  -4.894  -1.668
  123   HD21  LEU  14          3HD2      LEU  14  -1.601  -6.305   2.345
  124   HD22  LEU  14          1HD2      LEU  14  -1.892  -4.598   2.036
  125   HD23  LEU  14          2HD2      LEU  14  -0.348  -5.323   1.604
  126    H    GLU  15           H        GLU  15  -5.416  -8.387  -0.195
  127    HA   GLU  15           HA       GLU  15  -3.553 -10.420  -0.813
  128    HB2  GLU  15           1HB      GLU  15  -4.913 -10.617   1.045
  129    HB3  GLU  15           2HB      GLU  15  -6.390 -10.328   0.139
  130    HG2  GLU  15           1HG      GLU  15  -6.166 -12.509  -0.917
  131    HG3  GLU  15           2HG      GLU  15  -4.646 -12.771  -0.058
  132    H    ASN  16           H        ASN  16  -6.092  -8.930  -2.657
  133    HA   ASN  16           HA       ASN  16  -6.007 -11.105  -4.668
  134    HB2  ASN  16           1HB      ASN  16  -8.479  -9.630  -3.759
  135    HB3  ASN  16           2HB      ASN  16  -8.410 -10.882  -4.985
  136   HD21  ASN  16          1HD2      ASN  16  -8.487 -10.172  -1.579
  137   HD22  ASN  16          2HD2      ASN  16  -8.676 -11.795  -1.061
  138    H    LYS  17           H        LYS  17  -5.217 -10.084  -6.550
  139    HA   LYS  17           HA       LYS  17  -5.138  -7.351  -6.935
  140    HB2  LYS  17           1HB      LYS  17  -4.506  -7.666  -9.231
  141    HB3  LYS  17           2HB      LYS  17  -3.736  -8.896  -8.259
  142    HG2  LYS  17           1HG      LYS  17  -6.230  -9.391  -9.871
  143    HG3  LYS  17           2HG      LYS  17  -4.611  -9.591 -10.529
  144    HD2  LYS  17           1HD      LYS  17  -4.153 -11.297  -8.816
  145    HD3  LYS  17           2HD      LYS  17  -5.789 -11.062  -8.177
  146    HE2  LYS  17           1HE      LYS  17  -6.739 -11.767 -10.289
  147    HE3  LYS  17           2HE      LYS  17  -5.139 -11.928 -10.986
  148    HZ1  LYS  17           3HZ      LYS  17  -6.087 -13.553  -8.677
  149    HZ2  LYS  17           1HZ      LYS  17  -4.662 -13.764  -9.548
  150    HZ3  LYS  17           2HZ      LYS  17  -6.157 -14.059 -10.260
  151    H    ARG  18           H        ARG  18  -7.731  -9.464  -7.811
  152    HA   ARG  18           HA       ARG  18  -9.182  -7.540  -9.297
  153    HE   ARG  18           HE       ARG  18  -9.683 -12.000  -5.617
  154    HB2  ARG  18           1HB      ARG  18 -11.262  -8.903  -8.842
  155    HB3  ARG  18           2HB      ARG  18  -9.935  -9.804  -9.533
  156    HG2  ARG  18           1HG      ARG  18 -10.280  -9.845  -6.571
  157    HG3  ARG  18           2HG      ARG  18 -11.395 -10.782  -7.566
  158    HD2  ARG  18           1HD      ARG  18  -9.547 -12.013  -8.524
  159    HD3  ARG  18           2HD      ARG  18  -8.374 -11.016  -7.676
  160   HH11  ARG  18          1HH1      ARG  18  -8.967 -13.824  -8.545
  161   HH12  ARG  18          2HH1      ARG  18  -8.477 -15.224  -7.727
  162   HH21  ARG  18          1HH2      ARG  18  -8.952 -13.946  -4.475
  163   HH22  ARG  18          2HH2      ARG  18  -8.484 -15.297  -5.380
  164    H    LEU  19           H        LEU  19  -8.885  -8.090  -5.896
  165    HA   LEU  19           HA       LEU  19 -10.924  -6.193  -5.289
  166    HG   LEU  19           HG       LEU  19 -10.880  -8.508  -2.312
  167    HB2  LEU  19           1HB      LEU  19  -8.979  -7.704  -3.532
  168    HB3  LEU  19           2HB      LEU  19  -9.929  -6.325  -3.016
  169   HD11  LEU  19          1HD1      LEU  19 -12.207  -6.529  -2.332
  170   HD12  LEU  19          2HD1      LEU  19 -13.176  -7.911  -2.833
  171   HD13  LEU  19          3HD1      LEU  19 -12.603  -6.757  -4.037
  172   HD21  LEU  19          3HD2      LEU  19 -10.454  -9.828  -4.332
  173   HD22  LEU  19          1HD2      LEU  19 -11.559  -8.794  -5.236
  174   HD23  LEU  19          2HD2      LEU  19 -12.170  -9.810  -3.928
  175    H    LEU  20           H        LEU  20  -7.458  -6.180  -5.805
  176    HA   LEU  20           HA       LEU  20  -6.964  -3.609  -4.726
  177    HG   LEU  20           HG       LEU  20  -4.575  -3.955  -4.298
  178    HB2  LEU  20           1HB      LEU  20  -5.583  -5.281  -6.791
  179    HB3  LEU  20           2HB      LEU  20  -5.196  -3.563  -6.747
  180   HD11  LEU  20          1HD1      LEU  20  -3.936  -6.184  -3.673
  181   HD12  LEU  20          2HD1      LEU  20  -4.587  -6.817  -5.172
  182   HD13  LEU  20          3HD1      LEU  20  -5.666  -6.075  -3.984
  183   HD21  LEU  20          3HD2      LEU  20  -2.974  -5.310  -6.438
  184   HD22  LEU  20          1HD2      LEU  20  -2.371  -4.810  -4.858
  185   HD23  LEU  20          2HD2      LEU  20  -2.928  -3.598  -6.014
  186    H    GLU  21           H        GLU  21  -7.944  -4.719  -7.851
  187    HA   GLU  21           HA       GLU  21  -8.407  -2.255  -9.025
  188    HB2  GLU  21           1HB      GLU  21  -9.468  -4.998  -9.460
  189    HB3  GLU  21           2HB      GLU  21 -10.088  -3.653 -10.397
  190    HG2  GLU  21           1HG      GLU  21  -7.207  -4.526 -10.241
  191    HG3  GLU  21           2HG      GLU  21  -8.312  -4.827 -11.583
  192    H    SER  22           H        SER  22 -10.274  -4.005  -6.668
  193    HA   SER  22           HA       SER  22 -12.687  -2.576  -7.125
  194    HG   SER  22           HG       SER  22 -12.056  -5.066  -6.948
  195    HB2  SER  22           1HB      SER  22 -11.872  -4.081  -4.623
  196    HB3  SER  22           2HB      SER  22 -13.508  -3.610  -5.087
  197    H    TYR  23           H        TYR  23 -10.073  -2.126  -4.616
  198    HA   TYR  23           HA       TYR  23 -11.452   0.396  -4.006
  199    HD1  TYR  23           2HD      TYR  23  -7.914  -1.024  -4.044
  200    HD2  TYR  23           1HD      TYR  23  -8.892  -0.005  -0.035
  201    HE1  TYR  23           2HE      TYR  23  -5.550  -1.285  -3.405
  202    HE2  TYR  23           1HE      TYR  23  -6.537  -0.237   0.632
  203    HH   TYR  23           HH       TYR  23  -4.044  -0.597  -1.741
  204    HB2  TYR  23           1HB      TYR  23 -10.333   0.647  -1.979
  205    HB3  TYR  23           2HB      TYR  23 -10.678  -1.038  -1.936
  206    H    MET  24           H        MET  24  -9.652  -0.390  -6.274
  207    HA   MET  24           HA       MET  24  -7.417   1.218  -6.306
  208    HB2  MET  24           1HB      MET  24  -8.219  -0.566  -7.970
  209    HB3  MET  24           2HB      MET  24  -9.036   0.759  -8.789
  210    HG2  MET  24           1HG      MET  24  -6.891   0.306  -9.819
  211    HG3  MET  24           2HG      MET  24  -6.885   1.898  -9.060
  212    HE1  MET  24           3HE      MET  24  -4.302   0.084 -10.017
  213    HE2  MET  24           1HE      MET  24  -4.173   1.740  -9.436
  214    HE3  MET  24           2HE      MET  24  -3.182   0.468  -8.713
  215    H    ASP  25           H        ASP  25 -10.717   2.162  -6.564
  216    HA   ASP  25           HA       ASP  25 -10.520   4.765  -7.604
  217    HB2  ASP  25           1HB      ASP  25 -12.677   4.030  -7.150
  218    HB3  ASP  25           2HB      ASP  25 -12.298   3.609  -5.487
  219    H    CYS  26           H        CYS  26 -10.290   3.731  -4.245
  220    HA   CYS  26           HA       CYS  26  -9.653   6.347  -3.508
  221    HB2  CYS  26           1HB      CYS  26  -9.078   5.055  -1.256
  222    HB3  CYS  26           2HB      CYS  26 -10.722   5.398  -1.744
  223    H    VAL  27           H        VAL  27  -7.727   3.587  -4.307
  224    HA   VAL  27           HA       VAL  27  -5.349   4.967  -3.465
  225    HB   VAL  27           HB       VAL  27  -5.613   2.391  -5.022
  226   HG11  VAL  27          1HG1      VAL  27  -3.169   3.621  -3.731
  227   HG12  VAL  27          2HG1      VAL  27  -3.247   2.022  -4.470
  228   HG13  VAL  27          3HG1      VAL  27  -3.442   3.466  -5.466
  229   HG21  VAL  27          3HG2      VAL  27  -4.992   1.384  -2.855
  230   HG22  VAL  27          1HG2      VAL  27  -6.519   2.265  -2.790
  231   HG23  VAL  27          2HG2      VAL  27  -5.068   2.997  -2.129
  232    H    LEU  28           H        LEU  28  -6.599   4.113  -6.813
  233    HA   LEU  28           HA       LEU  28  -4.560   5.982  -7.794
  234    HG   LEU  28           HG       LEU  28  -4.092   3.767 -10.849
  235    HB2  LEU  28           1HB      LEU  28  -4.563   3.562  -8.526
  236    HB3  LEU  28           2HB      LEU  28  -6.073   3.874  -9.341
  237   HD11  LEU  28          1HD1      LEU  28  -5.457   6.436 -10.833
  238   HD12  LEU  28          2HD1      LEU  28  -6.026   4.963 -11.623
  239   HD13  LEU  28          3HD1      LEU  28  -4.542   5.748 -12.178
  240   HD21  LEU  28          3HD2      LEU  28  -3.249   6.298  -9.451
  241   HD22  LEU  28          1HD2      LEU  28  -2.511   5.620 -10.905
  242   HD23  LEU  28          2HD2      LEU  28  -2.431   4.732  -9.377
  243    H    GLY  29           H        GLY  29  -7.963   5.255  -7.792
  244    HA2  GLY  29           1HA      GLY  29  -9.542   7.092  -7.982
  245    HA3  GLY  29           2HA      GLY  29  -8.462   7.818  -9.167
  246    H    LYS  30           H        LYS  30  -9.592   4.451  -8.953
  247    HA   LYS  30           HA       LYS  30 -10.507   4.700 -11.703
  248    HB2  LYS  30           1HB      LYS  30 -10.108   2.252 -10.006
  249    HB3  LYS  30           2HB      LYS  30 -10.744   2.198 -11.640
  250    HG2  LYS  30           1HG      LYS  30  -8.542   3.351 -12.309
  251    HG3  LYS  30           2HG      LYS  30  -7.991   2.904 -10.687
  252    HD2  LYS  30           1HD      LYS  30  -8.498   0.548 -11.155
  253    HD3  LYS  30           2HD      LYS  30  -9.085   0.986 -12.752
  254    HE2  LYS  30           1HE      LYS  30  -6.832   1.796 -13.346
  255    HE3  LYS  30           2HE      LYS  30  -6.251   1.307 -11.755
  256    HZ1  LYS  30           3HZ      LYS  30  -7.398  -0.509 -13.804
  257    HZ2  LYS  30           1HZ      LYS  30  -6.834  -1.005 -12.305
  258    HZ3  LYS  30           2HZ      LYS  30  -5.766  -0.383 -13.459
  259    H    GLY  31           H        GLY  31 -11.878   2.871  -8.950
  260    HA2  GLY  31           1HA      GLY  31 -14.507   3.159 -10.228
  261    HA3  GLY  31           2HA      GLY  31 -14.088   1.972  -9.012
  262    H    LYS  32           H        LYS  32 -15.054   2.312  -7.059
  263    HA   LYS  32           HA       LYS  32 -15.081   4.982  -6.029
  264    HB2  LYS  32           1HB      LYS  32 -17.515   5.096  -5.562
  265    HB3  LYS  32           2HB      LYS  32 -17.123   5.155  -7.269
  266    HG2  LYS  32           1HG      LYS  32 -17.790   2.820  -7.506
  267    HG3  LYS  32           2HG      LYS  32 -18.108   2.750  -5.770
  268    HD2  LYS  32           1HD      LYS  32 -19.836   4.475  -6.026
  269    HD3  LYS  32           2HD      LYS  32 -19.536   4.495  -7.767
  270    HE2  LYS  32           1HE      LYS  32 -21.490   3.130  -7.204
  271    HE3  LYS  32           2HE      LYS  32 -20.211   2.160  -7.929
  272    HZ1  LYS  32           3HZ      LYS  32 -21.165   1.026  -6.012
  273    HZ2  LYS  32           1HZ      LYS  32 -20.818   2.337  -5.019
  274    HZ3  LYS  32           2HZ      LYS  32 -19.582   1.416  -5.694
  275    H    CYS  33           H        CYS  33 -14.000   4.539  -4.239
  276    HA   CYS  33           HA       CYS  33 -15.130   2.787  -2.198
  277    HB2  CYS  33           1HB      CYS  33 -12.853   4.806  -1.923
  278    HB3  CYS  33           2HB      CYS  33 -13.147   3.405  -0.904
  279    H    THR  34           H        THR  34 -15.355   4.188   0.102
  280    HA   THR  34           HA       THR  34 -16.900   6.546  -0.553
  281    HB   THR  34           HB       THR  34 -17.385   6.393   1.950
  282    HG1  THR  34           1HG      THR  34 -16.928   3.812   2.300
  283   HG21  THR  34          3HG2      THR  34 -18.209   4.090   0.157
  284   HG22  THR  34          1HG2      THR  34 -19.015   5.650   0.286
  285   HG23  THR  34          2HG2      THR  34 -19.018   4.542   1.656
  286    HA   PRO  35           HA       PRO  35 -13.835   9.546   0.644
  287    HB2  PRO  35           1HB      PRO  35 -15.328  10.842   2.705
  288    HB3  PRO  35           2HB      PRO  35 -15.107  11.367   1.038
  289    HG2  PRO  35           1HG      PRO  35 -17.393   9.980   2.277
  290    HG3  PRO  35           2HG      PRO  35 -17.329  10.970   0.815
  291    HD2  PRO  35           1HD      PRO  35 -17.636   8.274   0.761
  292    HD3  PRO  35           2HD      PRO  35 -16.837   9.183  -0.534
  293    H    GLU  36           H        GLU  36 -15.513   7.992   3.371
  294    HA   GLU  36           HA       GLU  36 -13.699   8.406   5.457
  295    HB2  GLU  36           1HB      GLU  36 -15.942   7.274   5.584
  296    HB3  GLU  36           2HB      GLU  36 -15.219   5.852   4.847
  297    HG2  GLU  36           1HG      GLU  36 -15.355   5.460   7.172
  298    HG3  GLU  36           2HG      GLU  36 -13.658   5.786   6.815
  299    H    GLY  37           H        GLY  37 -13.846   5.870   3.031
  300    HA2  GLY  37           1HA      GLY  37 -11.484   4.523   3.837
  301    HA3  GLY  37           2HA      GLY  37 -12.381   4.275   2.350
  302    H    LYS  38           H        LYS  38 -12.270   6.900   1.397
  303    HA   LYS  38           HA       LYS  38  -9.830   6.778  -0.026
  304    HB2  LYS  38           1HB      LYS  38 -11.606   9.233   0.186
  305    HB3  LYS  38           2HB      LYS  38 -10.440   8.886  -1.085
  306    HG2  LYS  38           1HG      LYS  38 -11.815   6.847  -1.616
  307    HG3  LYS  38           2HG      LYS  38 -13.026   7.468  -0.520
  308    HD2  LYS  38           1HD      LYS  38 -13.691   8.061  -2.737
  309    HD3  LYS  38           2HD      LYS  38 -13.136   9.534  -1.943
  310    HE2  LYS  38           1HE      LYS  38 -11.071   9.490  -3.127
  311    HE3  LYS  38           2HE      LYS  38 -11.374   7.859  -3.725
  312    HZ1  LYS  38           3HZ      LYS  38 -11.739   9.587  -5.387
  313    HZ2  LYS  38           1HZ      LYS  38 -12.966  10.265  -4.471
  314    HZ3  LYS  38           2HZ      LYS  38 -13.129   8.701  -5.112
  315    H    GLU  39           H        GLU  39 -10.647   8.280   2.942
  316    HA   GLU  39           HA       GLU  39  -8.440  10.101   2.962
  317    HB2  GLU  39           1HB      GLU  39 -10.550  10.578   4.151
  318    HB3  GLU  39           2HB      GLU  39 -10.262   9.160   5.156
  319    HG2  GLU  39           1HG      GLU  39  -8.249  10.131   6.015
  320    HG3  GLU  39           2HG      GLU  39  -8.478  11.524   4.961
  321    H    LEU  40           H        LEU  40  -9.396   7.114   4.592
  322    HA   LEU  40           HA       LEU  40  -7.018   6.923   6.063
  323    HG   LEU  40           HG       LEU  40  -9.391   4.495   4.368
  324    HB2  LEU  40           1HB      LEU  40  -7.765   4.842   6.834
  325    HB3  LEU  40           2HB      LEU  40  -9.195   5.800   6.686
  326   HD11  LEU  40          1HD1      LEU  40  -7.258   3.310   4.645
  327   HD12  LEU  40          2HD1      LEU  40  -8.606   2.188   4.562
  328   HD13  LEU  40          3HD1      LEU  40  -7.868   2.563   6.115
  329   HD21  LEU  40          3HD2      LEU  40 -11.067   4.487   6.144
  330   HD22  LEU  40          1HD2      LEU  40 -10.104   3.326   7.059
  331   HD23  LEU  40          2HD2      LEU  40 -10.813   2.858   5.515
  332    H    LYS  41           H        LYS  41  -7.932   5.759   2.953
  333    HA   LYS  41           HA       LYS  41  -5.596   4.152   2.676
  334    HB2  LYS  41           1HB      LYS  41  -7.756   4.911   0.749
  335    HB3  LYS  41           2HB      LYS  41  -6.368   3.927   0.279
  336    HG2  LYS  41           1HG      LYS  41  -7.065   2.127   1.434
  337    HG3  LYS  41           2HG      LYS  41  -7.776   3.062   2.734
  338    HD2  LYS  41           1HD      LYS  41  -9.569   3.697   1.115
  339    HD3  LYS  41           2HD      LYS  41  -8.910   2.448   0.054
  340    HE2  LYS  41           1HE      LYS  41  -9.259   0.774   1.766
  341    HE3  LYS  41           2HE      LYS  41  -9.750   2.024   2.898
  342    HZ1  LYS  41           3HZ      LYS  41 -11.681   2.485   1.568
  343    HZ2  LYS  41           1HZ      LYS  41 -11.612   0.871   1.990
  344    HZ3  LYS  41           2HZ      LYS  41 -11.241   1.343   0.420
  345    H    ASP  42           H        ASP  42  -6.407   7.438   1.865
  346    HA   ASP  42           HA       ASP  42  -4.185   7.918   0.203
  347    HB2  ASP  42           1HB      ASP  42  -5.790   9.668   0.352
  348    HB3  ASP  42           2HB      ASP  42  -5.674   9.737   2.108
  349    H    HIS  43           H        HIS  43  -4.597   7.895   3.642
  350    HA   HIS  43           HA       HIS  43  -1.925   8.815   4.144
  351    HD1  HIS  43           1HD      HIS  43  -5.703   9.383   6.723
  352    HD2  HIS  43           2HD      HIS  43  -2.457  11.192   4.889
  353    HE1  HIS  43           1HE      HIS  43  -6.304  11.790   6.544
  354    HE2  HIS  43           2HE      HIS  43  -4.538  12.712   5.055
  355    HB2  HIS  43           1HB      HIS  43  -4.004   7.728   6.045
  356    HB3  HIS  43           2HB      HIS  43  -2.465   8.424   6.532
  357    H    LEU  44           H        LEU  44  -3.586   5.686   4.597
  358    HA   LEU  44           HA       LEU  44  -1.236   4.432   5.587
  359    HG   LEU  44           HG       LEU  44  -1.691   2.034   6.384
  360    HB2  LEU  44           1HB      LEU  44  -3.592   3.780   6.167
  361    HB3  LEU  44           2HB      LEU  44  -3.779   3.177   4.544
  362   HD11  LEU  44          1HD1      LEU  44  -3.362   0.306   6.985
  363   HD12  LEU  44          2HD1      LEU  44  -4.609   1.286   6.201
  364   HD13  LEU  44          3HD1      LEU  44  -3.754   1.904   7.608
  365   HD21  LEU  44          3HD2      LEU  44  -2.067   0.006   5.000
  366   HD22  LEU  44          1HD2      LEU  44  -1.526   1.383   4.038
  367   HD23  LEU  44          2HD2      LEU  44  -3.216   0.918   4.013
  368    H    GLN  45           H        GLN  45  -2.908   4.343   2.430
  369    HA   GLN  45           HA       GLN  45  -0.957   2.635   1.383
  370    HB2  GLN  45           1HB      GLN  45  -3.222   4.106   0.124
  371    HB3  GLN  45           2HB      GLN  45  -1.934   3.524  -0.915
  372    HG2  GLN  45           1HG      GLN  45  -3.843   1.959  -0.803
  373    HG3  GLN  45           2HG      GLN  45  -2.348   1.246  -0.231
  374   HE21  GLN  45          1HE2      GLN  45  -3.599  -0.367   0.789
  375   HE22  GLN  45          2HE2      GLN  45  -4.365  -0.028   2.297
  376    H    GLU  46           H        GLU  46  -0.999   6.134   1.695
  377    HA   GLU  46           HA       GLU  46   1.162   6.424  -0.097
  378    HB2  GLU  46           1HB      GLU  46  -0.125   8.396   0.680
  379    HB3  GLU  46           2HB      GLU  46   0.517   8.169   2.295
  380    HG2  GLU  46           1HG      GLU  46   2.485   8.568   0.086
  381    HG3  GLU  46           2HG      GLU  46   1.542   9.968   0.612
  382    H    ALA  47           H        ALA  47   0.956   5.574   3.284
  383    HA   ALA  47           HA       ALA  47   3.730   5.601   3.831
  384    HB1  ALA  47           3HB      ALA  47   1.666   3.803   5.090
  385    HB2  ALA  47           1HB      ALA  47   3.239   4.276   5.743
  386    HB3  ALA  47           2HB      ALA  47   1.963   5.486   5.566
  387    H    LEU  48           H        LEU  48   1.749   3.428   2.171
  388    HA   LEU  48           HA       LEU  48   3.685   1.288   1.948
  389    HG   LEU  48           HG       LEU  48   2.492   0.210  -0.723
  390    HB2  LEU  48           1HB      LEU  48   1.252   0.899   1.925
  391    HB3  LEU  48           2HB      LEU  48   1.117   1.884   0.487
  392   HD11  LEU  48          1HD1      LEU  48   2.752  -2.015   0.300
  393   HD12  LEU  48          2HD1      LEU  48   2.154  -1.355   1.818
  394   HD13  LEU  48          3HD1      LEU  48   3.662  -0.759   1.133
  395   HD21  LEU  48          3HD2      LEU  48   0.088   0.206  -0.934
  396   HD22  LEU  48          1HD2      LEU  48  -0.081  -0.740   0.541
  397   HD23  LEU  48          2HD2      LEU  48   0.664  -1.458  -0.881
  398    H    GLU  49           H        GLU  49   2.242   3.698  -0.188
  399    HA   GLU  49           HA       GLU  49   3.563   3.185  -2.595
  400    HB2  GLU  49           1HB      GLU  49   1.447   4.386  -2.393
  401    HB3  GLU  49           2HB      GLU  49   2.257   5.665  -1.517
  402    HG2  GLU  49           1HG      GLU  49   3.557   6.166  -3.571
  403    HG3  GLU  49           2HG      GLU  49   2.563   4.985  -4.428
  404    H    THR  50           H        THR  50   4.044   5.756  -0.286
  405    HA   THR  50           HA       THR  50   6.590   6.495  -1.555
  406    HB   THR  50           HB       THR  50   4.785   8.147   0.219
  407    HG1  THR  50           1HG      THR  50   4.264   7.421  -2.087
  408   HG21  THR  50          3HG2      THR  50   6.141  10.026  -0.578
  409   HG22  THR  50          1HG2      THR  50   7.174   8.913  -1.472
  410   HG23  THR  50          2HG2      THR  50   7.128   8.850   0.290
  411    H    GLY  51           H        GLY  51   5.035   6.502   1.678
  412    HA2  GLY  51           1HA      GLY  51   6.210   4.835   3.170
  413    HA3  GLY  51           2HA      GLY  51   7.665   5.691   2.720
  414    H    CYS  52           H        CYS  52   4.565   7.269   3.545
  415    HA   CYS  52           HA       CYS  52   5.585   8.791   5.596
  416    HB2  CYS  52           1HB      CYS  52   3.352   8.916   4.291
  417    HB3  CYS  52           2HB      CYS  52   2.730   7.826   5.510
  418    H    GLU  53           H        GLU  53   6.791   6.633   6.466
  419    HA   GLU  53           HA       GLU  53   5.232   4.963   8.301
  420    HB2  GLU  53           1HB      GLU  53   7.354   3.761   8.614
  421    HB3  GLU  53           2HB      GLU  53   6.885   3.872   6.925
  422    HG2  GLU  53           1HG      GLU  53   8.483   5.662   6.574
  423    HG3  GLU  53           2HG      GLU  53   8.926   5.620   8.278
  424    H    LYS  54           H        LYS  54   7.112   7.763   8.343
  425    HA   LYS  54           HA       LYS  54   7.979   7.705  11.126
  426    HB2  LYS  54           1HB      LYS  54   8.701  10.014  10.630
  427    HB3  LYS  54           2HB      LYS  54   9.288   8.873   9.426
  428    HG2  LYS  54           1HG      LYS  54   7.613   9.566   7.846
  429    HG3  LYS  54           2HG      LYS  54   6.808  10.544   9.061
  430    HD2  LYS  54           1HD      LYS  54   8.642  12.018   9.176
  431    HD3  LYS  54           2HD      LYS  54   9.604  11.036   8.049
  432    HE2  LYS  54           1HE      LYS  54   7.871  11.464   6.319
  433    HE3  LYS  54           2HE      LYS  54   7.003  12.464   7.469
  434    HZ1  LYS  54           3HZ      LYS  54   9.752  12.998   6.515
  435    HZ2  LYS  54           1HZ      LYS  54   8.828  13.984   7.530
  436    HZ3  LYS  54           2HZ      LYS  54   8.356  13.756   5.932
  437    H    CYS  55           H        CYS  55   5.131   7.886   9.825
  438    HA   CYS  55           HA       CYS  55   4.214  10.386  10.832
  439    HB2  CYS  55           1HB      CYS  55   2.932   8.299   9.097
  440    HB3  CYS  55           2HB      CYS  55   2.255   9.903   9.401
  441    H    THR  56           H        THR  56   1.371   8.782  10.904
  442    HA   THR  56           HA       THR  56   1.451   8.689  13.792
  443    HB   THR  56           HB       THR  56  -1.063   8.491  13.496
  444    HG1  THR  56           1HG      THR  56  -1.620   9.253  11.250
  445   HG21  THR  56          3HG2      THR  56   0.285  10.859  12.179
  446   HG22  THR  56          1HG2      THR  56   0.016  10.668  13.909
  447   HG23  THR  56          2HG2      THR  56  -1.358  10.838  12.818
  448    H    GLU  57           H        GLU  57   0.057   6.885  14.818
  449    HA   GLU  57           HA       GLU  57   1.310   4.460  14.457
  450    HB2  GLU  57           1HB      GLU  57   0.028   5.057  16.475
  451    HB3  GLU  57           2HB      GLU  57  -1.461   4.880  15.552
  452    HG2  GLU  57           1HG      GLU  57  -0.787   2.515  15.082
  453    HG3  GLU  57           2HG      GLU  57   0.528   2.772  16.235
  454    H    ALA  58           H        ALA  58  -1.898   5.380  13.306
  455    HA   ALA  58           HA       ALA  58  -2.592   2.970  12.077
  456    HB1  ALA  58           3HB      ALA  58  -4.255   4.245  10.817
  457    HB2  ALA  58           1HB      ALA  58  -4.236   4.724  12.511
  458    HB3  ALA  58           2HB      ALA  58  -3.470   5.749  11.292
  459    H    GLN  59           H        GLN  59  -0.690   5.648  10.878
  460    HA   GLN  59           HA       GLN  59  -0.679   4.561   8.221
  461    HB2  GLN  59           1HB      GLN  59   0.962   6.829   9.330
  462    HB3  GLN  59           2HB      GLN  59   0.784   6.397   7.634
  463    HG2  GLN  59           1HG      GLN  59  -1.664   6.825   7.862
  464    HG3  GLN  59           2HG      GLN  59  -1.347   7.436   9.480
  465   HE21  GLN  59          1HE2      GLN  59   0.725   7.900   6.708
  466   HE22  GLN  59          2HE2      GLN  59   0.487   9.583   6.557
  467    H    GLU  60           H        GLU  60   1.670   4.900  10.860
  468    HA   GLU  60           HA       GLU  60   3.720   3.769   9.423
  469    HB2  GLU  60           1HB      GLU  60   4.892   3.357  11.626
  470    HB3  GLU  60           2HB      GLU  60   4.347   4.999  11.356
  471    HG2  GLU  60           1HG      GLU  60   2.518   4.698  12.828
  472    HG3  GLU  60           2HG      GLU  60   2.852   2.987  13.037
  473    H    LYS  61           H        LYS  61   1.518   2.260  11.773
  474    HA   LYS  61           HA       LYS  61   2.556  -0.382  11.396
  475    HB2  LYS  61           1HB      LYS  61   0.213   0.738  12.917
  476    HB3  LYS  61           2HB      LYS  61   0.487  -0.993  12.793
  477    HG2  LYS  61           1HG      LYS  61   2.552  -0.855  13.943
  478    HG3  LYS  61           2HG      LYS  61   2.590   0.897  13.803
  479    HD2  LYS  61           1HD      LYS  61   1.998   0.119  16.083
  480    HD3  LYS  61           2HD      LYS  61   0.752   1.104  15.325
  481    HE2  LYS  61           1HE      LYS  61  -0.551  -0.860  14.822
  482    HE3  LYS  61           2HE      LYS  61   0.719  -1.904  15.448
  483    HZ1  LYS  61           3HZ      LYS  61  -1.112  -1.530  17.030
  484    HZ2  LYS  61           1HZ      LYS  61  -0.752   0.113  17.105
  485    HZ3  LYS  61           2HZ      LYS  61   0.363  -1.025  17.643
  486    H    GLY  62           H        GLY  62   0.006   1.530  10.053
  487    HA2  GLY  62           1HA      GLY  62  -1.380  -0.559   8.765
  488    HA3  GLY  62           2HA      GLY  62  -1.353   1.160   8.268
  489    H    ALA  63           H        ALA  63   1.402   1.408   7.907
  490    HA   ALA  63           HA       ALA  63   1.830   0.393   5.326
  491    HB1  ALA  63           3HB      ALA  63   3.854   1.397   7.320
  492    HB2  ALA  63           1HB      ALA  63   4.119   1.205   5.584
  493    HB3  ALA  63           2HB      ALA  63   2.947   2.386   6.181
  494    H    GLU  64           H        GLU  64   2.968  -0.604   8.485
  495    HA   GLU  64           HA       GLU  64   4.556  -2.801   7.780
  496    HB2  GLU  64           1HB      GLU  64   2.709  -2.532  10.165
  497    HB3  GLU  64           2HB      GLU  64   3.947  -3.765   9.986
  498    HG2  GLU  64           1HG      GLU  64   4.482  -0.796  10.077
  499    HG3  GLU  64           2HG      GLU  64   4.642  -1.896  11.444
  500    H    THR  65           H        THR  65   1.036  -2.910   8.297
  501    HA   THR  65           HA       THR  65   0.896  -5.663   7.434
  502    HB   THR  65           HB       THR  65  -1.360  -3.656   7.682
  503    HG1  THR  65           1HG      THR  65   0.120  -5.154   9.557
  504   HG21  THR  65          3HG2      THR  65  -1.906  -5.802   6.629
  505   HG22  THR  65          1HG2      THR  65  -2.678  -5.634   8.194
  506   HG23  THR  65          2HG2      THR  65  -1.251  -6.664   8.031
  507    H    SER  66           H        SER  66   0.208  -2.596   5.707
  508    HA   SER  66           HA       SER  66  -0.624  -3.907   3.410
  509    HG   SER  66           HG       SER  66   0.247  -0.653   4.826
  510    HB2  SER  66           1HB      SER  66  -0.092  -1.709   2.269
  511    HB3  SER  66           2HB      SER  66  -1.219  -1.636   3.624
  512    H    ILE  67           H        ILE  67   2.639  -2.859   4.324
  513    HA   ILE  67           HA       ILE  67   3.890  -3.627   1.928
  514    HB   ILE  67           HB       ILE  67   4.958  -3.368   4.757
  515   HG12  ILE  67          1HG1      ILE  67   5.513  -1.686   2.321
  516   HG13  ILE  67          2HG1      ILE  67   4.236  -1.310   3.486
  517   HG21  ILE  67          1HG2      ILE  67   6.371  -5.015   3.615
  518   HG22  ILE  67          2HG2      ILE  67   7.243  -3.502   3.865
  519   HG23  ILE  67          3HG2      ILE  67   6.599  -3.893   2.272
  520   HD11  ILE  67          3HD1      ILE  67   6.182   0.043   3.854
  521   HD12  ILE  67          1HD1      ILE  67   7.211  -1.400   3.958
  522   HD13  ILE  67          2HD1      ILE  67   5.983  -1.086   5.197
  523    H    ASP  68           H        ASP  68   2.999  -5.427   4.788
  524    HA   ASP  68           HA       ASP  68   4.425  -7.772   4.381
  525    HB2  ASP  68           1HB      ASP  68   3.307  -7.408   6.461
  526    HB3  ASP  68           2HB      ASP  68   1.741  -7.318   5.676
  527    H    TYR  69           H        TYR  69   0.988  -7.186   3.324
  528    HA   TYR  69           HA       TYR  69   1.273  -9.708   1.933
  529    HD1  TYR  69           2HD      TYR  69  -0.845  -9.717  -0.710
  530    HD2  TYR  69           1HD      TYR  69  -1.769 -10.924   3.255
  531    HE1  TYR  69           2HE      TYR  69  -1.654 -11.881  -1.561
  532    HE2  TYR  69           1HE      TYR  69  -2.577 -13.079   2.416
  533    HH   TYR  69           HH       TYR  69  -3.447 -14.035   0.346
  534    HB2  TYR  69           1HB      TYR  69  -1.073  -8.777   2.905
  535    HB3  TYR  69           2HB      TYR  69  -1.156  -8.058   1.302
  536    H    LEU  70           H        LEU  70   1.583  -6.350   1.042
  537    HA   LEU  70           HA       LEU  70   1.206  -6.622  -1.702
  538    HG   LEU  70           HG       LEU  70   3.265  -4.902  -2.713
  539    HB2  LEU  70           1HB      LEU  70   1.364  -4.434  -0.486
  540    HB3  LEU  70           2HB      LEU  70   3.072  -4.732  -0.280
  541   HD11  LEU  70          1HD1      LEU  70   0.504  -3.704  -2.683
  542   HD12  LEU  70          2HD1      LEU  70   0.993  -5.255  -3.372
  543   HD13  LEU  70          3HD1      LEU  70   1.551  -3.752  -4.101
  544   HD21  LEU  70          3HD2      LEU  70   2.397  -2.232  -1.643
  545   HD22  LEU  70          1HD2      LEU  70   3.342  -2.483  -3.101
  546   HD23  LEU  70          2HD2      LEU  70   4.018  -2.924  -1.529
  547    H    ILE  71           H        ILE  71   4.155  -6.729   0.289
  548    HA   ILE  71           HA       ILE  71   5.805  -7.211  -1.941
  549    HB   ILE  71           HB       ILE  71   6.428  -7.706   0.986
  550   HG12  ILE  71          1HG1      ILE  71   5.861  -5.365   0.521
  551   HG13  ILE  71          2HG1      ILE  71   7.565  -5.534   0.910
  552   HG21  ILE  71          1HG2      ILE  71   8.793  -7.608   0.308
  553   HG22  ILE  71          2HG2      ILE  71   8.300  -7.461  -1.378
  554   HG23  ILE  71          3HG2      ILE  71   7.953  -8.942  -0.490
  555   HD11  ILE  71          3HD1      ILE  71   8.092  -5.402  -1.479
  556   HD12  ILE  71          1HD1      ILE  71   7.240  -3.971  -0.885
  557   HD13  ILE  71          2HD1      ILE  71   6.369  -5.183  -1.827
  558    H    LYS  72           H        LYS  72   4.143  -9.427   0.304
  559    HA   LYS  72           HA       LYS  72   5.652 -11.547  -0.895
  560    HB2  LYS  72           1HB      LYS  72   4.497 -13.149   0.503
  561    HB3  LYS  72           2HB      LYS  72   5.113 -11.828   1.457
  562    HG2  LYS  72           1HG      LYS  72   2.789 -10.892   1.462
  563    HG3  LYS  72           2HG      LYS  72   2.248 -12.399   0.707
  564    HD2  LYS  72           1HD      LYS  72   3.274 -13.648   2.612
  565    HD3  LYS  72           2HD      LYS  72   3.652 -12.110   3.374
  566    HE2  LYS  72           1HE      LYS  72   1.681 -12.879   4.409
  567    HE3  LYS  72           2HE      LYS  72   1.156 -11.624   3.290
  568    HZ1  LYS  72           3HZ      LYS  72  -0.287 -13.575   3.180
  569    HZ2  LYS  72           1HZ      LYS  72   1.028 -14.545   2.850
  570    HZ3  LYS  72           2HZ      LYS  72   0.554 -13.443   1.706
  571    H    ASN  73           H        ASN  73   2.954  -9.933  -2.033
  572    HA   ASN  73           HA       ASN  73   2.610 -12.221  -3.831
  573    HB2  ASN  73           1HB      ASN  73   0.846 -12.318  -2.048
  574    HB3  ASN  73           2HB      ASN  73   0.194 -10.822  -2.703
  575   HD21  ASN  73          1HD2      ASN  73  -1.045 -10.909  -4.619
  576   HD22  ASN  73          2HD2      ASN  73  -1.434 -12.398  -5.360
  577    H    GLU  74           H        GLU  74   1.452  -8.837  -3.426
  578    HA   GLU  74           HA       GLU  74   1.287  -8.653  -6.354
  579    HB2  GLU  74           1HB      GLU  74   0.175  -6.906  -4.161
  580    HB3  GLU  74           2HB      GLU  74   0.063  -6.499  -5.867
  581    HG2  GLU  74           1HG      GLU  74  -1.154  -8.890  -4.496
  582    HG3  GLU  74           2HG      GLU  74  -2.004  -7.456  -5.066
  583    H    LEU  75           H        LEU  75   3.865  -8.639  -5.314
  584    HA   LEU  75           HA       LEU  75   4.809  -6.076  -4.694
  585    HG   LEU  75           HG       LEU  75   7.626  -9.291  -5.041
  586    HB2  LEU  75           1HB      LEU  75   7.103  -6.916  -4.817
  587    HB3  LEU  75           2HB      LEU  75   6.063  -7.952  -3.885
  588   HD11  LEU  75          1HD1      LEU  75   6.303 -10.801  -6.377
  589   HD12  LEU  75          2HD1      LEU  75   5.010  -9.604  -6.449
  590   HD13  LEU  75          3HD1      LEU  75   5.478 -10.307  -4.898
  591   HD21  LEU  75          3HD2      LEU  75   6.777  -7.991  -7.619
  592   HD22  LEU  75          1HD2      LEU  75   7.883  -9.357  -7.475
  593   HD23  LEU  75          2HD2      LEU  75   8.322  -7.791  -6.796
  594    H    GLU  76           H        GLU  76   4.005  -7.192  -7.753
  595    HA   GLU  76           HA       GLU  76   5.849  -5.708  -9.299
  596    HB2  GLU  76           1HB      GLU  76   2.996  -6.466  -9.924
  597    HB3  GLU  76           2HB      GLU  76   4.115  -5.780 -11.089
  598    HG2  GLU  76           1HG      GLU  76   4.368  -8.433  -9.695
  599    HG3  GLU  76           2HG      GLU  76   3.929  -8.170 -11.381
  600    H    ILE  77           H        ILE  77   2.779  -4.913  -7.801
  601    HA   ILE  77           HA       ILE  77   2.680  -2.309  -8.923
  602    HB   ILE  77           HB       ILE  77   1.104  -3.520  -6.619
  603   HG12  ILE  77          1HG1      ILE  77   0.446  -2.982  -9.521
  604   HG13  ILE  77          2HG1      ILE  77   0.740  -4.554  -8.767
  605   HG21  ILE  77          1HG2      ILE  77   0.632  -0.882  -8.045
  606   HG22  ILE  77          2HG2      ILE  77   1.173  -1.060  -6.376
  607   HG23  ILE  77          3HG2      ILE  77  -0.435  -1.610  -6.844
  608   HD11  ILE  77          3HD1      ILE  77  -1.552  -2.703  -8.168
  609   HD12  ILE  77          1HD1      ILE  77  -1.281  -4.291  -7.455
  610   HD13  ILE  77          2HD1      ILE  77  -1.621  -4.145  -9.181
  611    H    TRP  78           H        TRP  78   4.175  -3.689  -6.167
  612    HA   TRP  78           HA       TRP  78   4.706  -1.320  -4.725
  613    HD1  TRP  78           HD       TRP  78   5.969  -1.158  -2.198
  614    HE1  TRP  78           1HE      TRP  78   8.319  -0.653  -1.335
  615    HE3  TRP  78           3HE      TRP  78   8.625  -4.253  -5.281
  616    HZ2  TRP  78           2HZ      TRP  78  10.986  -1.477  -1.888
  617    HZ3  TRP  78           3HZ      TRP  78  11.070  -4.338  -5.044
  618    HH2  TRP  78           HH       TRP  78  12.221  -2.977  -3.383
  619    HB2  TRP  78           1HB      TRP  78   5.143  -3.455  -3.669
  620    HB3  TRP  78           2HB      TRP  78   6.282  -3.894  -4.936
  621    H    LYS  79           H        LYS  79   6.399  -2.954  -7.342
  622    HA   LYS  79           HA       LYS  79   8.648  -1.302  -7.662
  623    HB2  LYS  79           1HB      LYS  79   6.965  -2.634  -9.780
  624    HB3  LYS  79           2HB      LYS  79   8.589  -2.018 -10.025
  625    HG2  LYS  79           1HG      LYS  79   9.512  -3.693  -8.535
  626    HG3  LYS  79           2HG      LYS  79   7.889  -4.261  -8.124
  627    HD2  LYS  79           1HD      LYS  79   7.516  -4.918 -10.441
  628    HD3  LYS  79           2HD      LYS  79   9.100  -4.308 -10.886
  629    HE2  LYS  79           1HE      LYS  79   8.616  -6.542  -8.916
  630    HE3  LYS  79           2HE      LYS  79   8.970  -6.782 -10.620
  631    HZ1  LYS  79           3HZ      LYS  79  10.794  -5.505  -8.629
  632    HZ2  LYS  79           1HZ      LYS  79  11.104  -5.677 -10.272
  633    HZ3  LYS  79           2HZ      LYS  79  10.954  -7.032  -9.303
  634    H    GLU  80           H        GLU  80   5.436  -1.128  -8.948
  635    HA   GLU  80           HA       GLU  80   5.703   1.155 -10.563
  636    HB2  GLU  80           1HB      GLU  80   3.252  -0.043  -9.279
  637    HB3  GLU  80           2HB      GLU  80   3.267   1.048 -10.663
  638    HG2  GLU  80           1HG      GLU  80   4.766  -1.522 -10.703
  639    HG3  GLU  80           2HG      GLU  80   3.073  -1.537 -11.098
  640    H    LEU  81           H        LEU  81   4.671   0.728  -7.186
  641    HA   LEU  81           HA       LEU  81   4.019   3.488  -6.818
  642    HG   LEU  81           HG       LEU  81   2.814   0.612  -5.863
  643    HB2  LEU  81           1HB      LEU  81   4.740   1.624  -4.512
  644    HB3  LEU  81           2HB      LEU  81   3.844   3.093  -4.524
  645   HD11  LEU  81          1HD1      LEU  81   1.314   0.399  -3.965
  646   HD12  LEU  81          2HD1      LEU  81   2.094   1.772  -3.175
  647   HD13  LEU  81          3HD1      LEU  81   3.001   0.279  -3.454
  648   HD21  LEU  81          3HD2      LEU  81   0.689   1.823  -5.878
  649   HD22  LEU  81          1HD2      LEU  81   1.924   2.696  -6.783
  650   HD23  LEU  81          2HD2      LEU  81   1.476   3.230  -5.163
  651    H    THR  82           H        THR  82   6.901   1.574  -6.482
  652    HA   THR  82           HA       THR  82   8.465   3.516  -5.163
  653    HB   THR  82           HB       THR  82   9.467   1.474  -7.183
  654    HG1  THR  82           1HG      THR  82   8.167   0.802  -5.128
  655   HG21  THR  82          3HG2      THR  82  10.836   2.842  -4.855
  656   HG22  THR  82          1HG2      THR  82  11.118   3.184  -6.566
  657   HG23  THR  82          2HG2      THR  82  11.567   1.610  -5.893
  658    H    ALA  83           H        ALA  83   7.763   2.868  -8.544
  659    HA   ALA  83           HA       ALA  83   9.387   4.916  -9.631
  660    HB1  ALA  83           3HB      ALA  83   8.566   3.021 -10.966
  661    HB2  ALA  83           1HB      ALA  83   6.920   3.626 -10.793
  662    HB3  ALA  83           2HB      ALA  83   8.114   4.565 -11.687
  663    H    HIS  84           H        HIS  84   6.273   4.868  -8.206
  664    HA   HIS  84           HA       HIS  84   5.336   7.342  -9.216
  665    HD1  HIS  84           1HD      HIS  84   1.624   6.863  -8.542
  666    HD2  HIS  84           2HD      HIS  84   4.077   8.678  -5.724
  667    HE1  HIS  84           1HE      HIS  84   0.251   8.682  -7.526
  668    HE2  HIS  84           2HE      HIS  84   1.623   9.404  -5.564
  669    HB2  HIS  84           1HB      HIS  84   3.790   5.654  -8.290
  670    HB3  HIS  84           2HB      HIS  84   4.525   5.833  -6.711
  671    H    PHE  85           H        PHE  85   7.191   6.465  -6.284
  672    HA   PHE  85           HA       PHE  85   7.129   9.298  -5.676
  673    HD1  PHE  85           2HD      PHE  85   7.385   5.296  -4.070
  674    HD2  PHE  85           1HD      PHE  85  10.120   8.332  -2.913
  675    HE1  PHE  85           2HE      PHE  85   8.955   3.577  -3.235
  676    HE2  PHE  85           1HE      PHE  85  11.681   6.627  -2.081
  677    HZ   PHE  85           HZ       PHE  85  11.098   4.246  -2.248
  678    HB2  PHE  85           1HB      PHE  85   7.892   8.885  -3.453
  679    HB3  PHE  85           2HB      PHE  85   6.676   7.680  -3.794
  680    H    ASP  86           H        ASP  86   9.572   6.798  -6.314
  681    HA   ASP  86           HA       ASP  86  11.296   8.585  -7.579
  682    HB2  ASP  86           1HB      ASP  86  11.722   9.524  -5.391
  683    HB3  ASP  86           2HB      ASP  86  12.003   7.929  -4.713
  684    HA   PRO  87           HA       PRO  87  12.120   4.210  -8.485
  685    HB2  PRO  87           1HB      PRO  87  12.715   4.592 -11.101
  686    HB3  PRO  87           2HB      PRO  87  11.064   4.403 -10.522
  687    HG2  PRO  87           1HG      PRO  87  12.542   6.866 -11.312
  688    HG3  PRO  87           2HG      PRO  87  10.824   6.479 -11.504
  689    HD2  PRO  87           1HD      PRO  87  11.849   8.139  -9.563
  690    HD3  PRO  87           2HD      PRO  87  10.298   7.295  -9.436
  691    H    ASP  88           H        ASP  88  14.120   6.973  -8.522
  692    HA   ASP  88           HA       ASP  88  16.425   5.442  -9.475
  693    HB2  ASP  88           1HB      ASP  88  16.070   7.774 -10.307
  694    HB3  ASP  88           2HB      ASP  88  16.312   8.347  -8.663
  695    H    GLY  89           H        GLY  89  14.946   6.502  -6.617
  696    HA2  GLY  89           1HA      GLY  89  17.237   6.568  -4.953
  697    HA3  GLY  89           2HA      GLY  89  15.558   6.522  -4.440
  698    H    LYS  90           H        LYS  90  18.124   5.070  -3.724
  699    HA   LYS  90           HA       LYS  90  17.679   2.299  -4.259
  700    HB2  LYS  90           1HB      LYS  90  19.437   1.907  -2.629
  701    HB3  LYS  90           2HB      LYS  90  19.909   3.138  -3.792
  702    HG2  LYS  90           1HG      LYS  90  19.688   4.868  -2.229
  703    HG3  LYS  90           2HG      LYS  90  18.718   3.871  -1.145
  704    HD2  LYS  90           1HD      LYS  90  20.536   2.492  -0.697
  705    HD3  LYS  90           2HD      LYS  90  21.603   3.362  -1.813
  706    HE2  LYS  90           1HE      LYS  90  21.316   5.394  -0.450
  707    HE3  LYS  90           2HE      LYS  90  20.300   4.496   0.677
  708    HZ1  LYS  90           3HZ      LYS  90  22.163   3.097   1.206
  709    HZ2  LYS  90           1HZ      LYS  90  22.576   4.704   1.455
  710    HZ3  LYS  90           2HZ      LYS  90  23.147   3.878   0.094
  711    H    TRP  91           H        TRP  91  16.050   4.389  -2.290
  712    HA   TRP  91           HA       TRP  91  15.883   2.914   0.085
  713    HD1  TRP  91           HD       TRP  91  15.879   4.881   2.427
  714    HE1  TRP  91           1HE      TRP  91  17.697   6.676   2.567
  715    HE3  TRP  91           3HE      TRP  91  15.667   6.608  -2.369
  716    HZ2  TRP  91           2HZ      TRP  91  18.902   8.591   0.862
  717    HZ3  TRP  91           3HZ      TRP  91  17.187   8.425  -3.041
  718    HH2  TRP  91           HH       TRP  91  18.770   9.394  -1.456
  719    HB2  TRP  91           1HB      TRP  91  14.120   5.125  -0.955
  720    HB3  TRP  91           2HB      TRP  91  13.938   4.415   0.651
  721    H    ARG  92           H        ARG  92  14.836   2.054  -2.702
  722    HA   ARG  92           HA       ARG  92  12.336   0.783  -2.171
  723    HE   ARG  92           HE       ARG  92  15.251   1.854  -5.565
  724    HB2  ARG  92           1HB      ARG  92  12.730  -0.425  -4.220
  725    HB3  ARG  92           2HB      ARG  92  13.375   1.191  -4.464
  726    HG2  ARG  92           1HG      ARG  92  15.635   0.201  -3.811
  727    HG3  ARG  92           2HG      ARG  92  14.877  -1.372  -4.029
  728    HD2  ARG  92           1HD      ARG  92  15.915  -0.905  -6.065
  729    HD3  ARG  92           2HD      ARG  92  14.211  -0.527  -6.330
  730   HH11  ARG  92          1HH1      ARG  92  15.996  -0.423  -8.164
  731   HH12  ARG  92          2HH1      ARG  92  16.830   0.718  -9.108
  732   HH21  ARG  92          1HH2      ARG  92  16.379   3.396  -6.854
  733   HH22  ARG  92          2HH2      ARG  92  17.062   2.946  -8.352
  734    H    LYS  93           H        LYS  93  15.733   0.091  -1.605
  735    HA   LYS  93           HA       LYS  93  15.344  -2.623  -0.860
  736    HB2  LYS  93           1HB      LYS  93  17.464  -1.667  -1.842
  737    HB3  LYS  93           2HB      LYS  93  17.746  -0.886  -0.291
  738    HG2  LYS  93           1HG      LYS  93  17.867  -3.011   0.814
  739    HG3  LYS  93           2HG      LYS  93  17.435  -3.851  -0.674
  740    HD2  LYS  93           1HD      LYS  93  19.503  -2.857  -1.701
  741    HD3  LYS  93           2HD      LYS  93  19.941  -2.306  -0.079
  742    HE2  LYS  93           1HE      LYS  93  21.032  -4.417  -0.577
  743    HE3  LYS  93           2HE      LYS  93  19.849  -4.607   0.718
  744    HZ1  LYS  93           3HZ      LYS  93  18.296  -5.600  -0.874
  745    HZ2  LYS  93           1HZ      LYS  93  19.780  -6.411  -0.945
  746    HZ3  LYS  93           2HZ      LYS  93  19.372  -5.295  -2.126
  747    H    LYS  94           H        LYS  94  15.277   0.465   0.699
  748    HA   LYS  94           HA       LYS  94  15.477  -0.306   3.384
  749    HB2  LYS  94           1HB      LYS  94  15.492   2.014   2.596
  750    HB3  LYS  94           2HB      LYS  94  13.835   1.845   2.049
  751    HG2  LYS  94           1HG      LYS  94  13.389   1.255   4.552
  752    HG3  LYS  94           2HG      LYS  94  14.910   2.123   4.800
  753    HD2  LYS  94           1HD      LYS  94  14.005   3.975   3.469
  754    HD3  LYS  94           2HD      LYS  94  12.456   3.144   3.406
  755    HE2  LYS  94           1HE      LYS  94  12.532   3.081   5.941
  756    HE3  LYS  94           2HE      LYS  94  13.848   4.252   5.822
  757    HZ1  LYS  94           3HZ      LYS  94  12.185   5.631   4.444
  758    HZ2  LYS  94           1HZ      LYS  94  11.880   5.465   6.101
  759    HZ3  LYS  94           2HZ      LYS  94  11.032   4.534   5.065
  760    H    TYR  95           H        TYR  95  12.785  -0.110   1.084
  761    HA   TYR  95           HA       TYR  95  10.910  -1.062   3.005
  762    HD1  TYR  95           1HD      TYR  95   9.043   0.426   3.176
  763    HD2  TYR  95           2HD      TYR  95  10.890   1.499  -0.490
  764    HE1  TYR  95           1HE      TYR  95   8.748   2.802   3.731
  765    HE2  TYR  95           2HE      TYR  95  10.595   3.879   0.054
  766    HH   TYR  95           HH       TYR  95   9.078   5.216   1.498
  767    HB2  TYR  95           1HB      TYR  95  10.600  -0.759   0.013
  768    HB3  TYR  95           2HB      TYR  95   9.280  -1.180   1.114
  769    H    GLU  96           H        GLU  96  12.939  -2.558   0.680
  770    HA   GLU  96           HA       GLU  96  11.897  -5.176   0.761
  771    HB2  GLU  96           1HB      GLU  96  13.571  -4.453  -0.888
  772    HB3  GLU  96           2HB      GLU  96  14.722  -4.149   0.397
  773    HG2  GLU  96           1HG      GLU  96  14.922  -6.509   0.837
  774    HG3  GLU  96           2HG      GLU  96  13.646  -6.863  -0.330
  775    H    ASP  97           H        ASP  97  14.329  -3.509   2.702
  776    HA   ASP  97           HA       ASP  97  14.953  -5.479   4.591
  777    HB2  ASP  97           1HB      ASP  97  16.221  -3.395   4.381
  778    HB3  ASP  97           2HB      ASP  97  14.821  -2.471   4.896
  779    H    ARG  98           H        ARG  98  12.570  -2.865   4.727
  780    HA   ARG  98           HA       ARG  98  11.398  -3.563   7.159
  781    HE   ARG  98           HE       ARG  98   8.817  -0.504   7.657
  782    HB2  ARG  98           1HB      ARG  98  10.018  -2.181   4.823
  783    HB3  ARG  98           2HB      ARG  98   9.353  -2.357   6.424
  784    HG2  ARG  98           1HG      ARG  98  11.204  -1.049   7.363
  785    HG3  ARG  98           2HG      ARG  98  11.852  -0.825   5.737
  786    HD2  ARG  98           1HD      ARG  98  10.562   1.144   6.398
  787    HD3  ARG  98           2HD      ARG  98   9.767   0.305   5.076
  788   HH11  ARG  98          1HH1      ARG  98   8.487   2.130   5.344
  789   HH12  ARG  98          2HH1      ARG  98   6.824   2.377   5.584
  790   HH21  ARG  98          1HH2      ARG  98   6.565  -0.148   8.113
  791   HH22  ARG  98          2HH2      ARG  98   5.692   1.067   7.296
  792    H    ALA  99           H        ALA  99  10.705  -4.794   3.931
  793    HA   ALA  99           HA       ALA  99   8.425  -6.301   4.666
  794    HB1  ALA  99           3HB      ALA  99   8.994  -5.692   2.346
  795    HB2  ALA  99           1HB      ALA  99  10.378  -6.783   2.427
  796    HB3  ALA  99           2HB      ALA  99   8.744  -7.431   2.548
  797    H    LYS 100           H        LYS 100  11.827  -7.147   4.247
  798    HA   LYS 100           HA       LYS 100  11.649  -9.847   4.812
  799    HB2  LYS 100           1HB      LYS 100  13.609  -8.591   3.852
  800    HB3  LYS 100           2HB      LYS 100  13.969  -8.031   5.474
  801    HG2  LYS 100           1HG      LYS 100  15.400  -9.878   4.904
  802    HG3  LYS 100           2HG      LYS 100  14.279 -10.367   6.179
  803    HD2  LYS 100           1HD      LYS 100  12.870 -11.478   4.528
  804    HD3  LYS 100           2HD      LYS 100  13.949 -10.946   3.240
  805    HE2  LYS 100           1HE      LYS 100  14.820 -12.685   5.538
  806    HE3  LYS 100           2HE      LYS 100  14.274 -13.310   3.985
  807    HZ1  LYS 100           3HZ      LYS 100  16.060 -12.380   2.906
  808    HZ2  LYS 100           1HZ      LYS 100  16.727 -13.061   4.269
  809    HZ3  LYS 100           2HZ      LYS 100  16.526 -11.371   4.156
  810    H    ALA 101           H        ALA 101  11.917  -7.108   6.977
  811    HA   ALA 101           HA       ALA 101  12.359  -8.582   9.364
  812    HB1  ALA 101           3HB      ALA 101  13.009  -6.257   9.127
  813    HB2  ALA 101           1HB      ALA 101  11.318  -5.783   8.998
  814    HB3  ALA 101           2HB      ALA 101  11.929  -6.472  10.505
  815    H    LYS 102           H        LYS 102   9.568  -8.190   7.513
  816    HA   LYS 102           HA       LYS 102   7.696  -8.508   9.762
  817    HB2  LYS 102           1HB      LYS 102   7.246  -8.122   6.793
  818    HB3  LYS 102           2HB      LYS 102   5.945  -8.242   7.968
  819    HG2  LYS 102           1HG      LYS 102   6.516  -6.300   8.992
  820    HG3  LYS 102           2HG      LYS 102   8.067  -6.219   8.151
  821    HD2  LYS 102           1HD      LYS 102   6.987  -5.864   6.065
  822    HD3  LYS 102           2HD      LYS 102   5.399  -6.156   6.786
  823    HE2  LYS 102           1HE      LYS 102   5.969  -3.750   6.494
  824    HE3  LYS 102           2HE      LYS 102   5.563  -4.298   8.131
  825    HZ1  LYS 102           3HZ      LYS 102   7.753  -4.289   8.756
  826    HZ2  LYS 102           1HZ      LYS 102   7.439  -2.800   8.089
  827    HZ3  LYS 102           2HZ      LYS 102   8.376  -4.009   7.245
  828    H    GLY 103           H        GLY 103   9.664 -10.465   8.250
  829    HA2  GLY 103           1HA      GLY 103   9.648 -12.784   8.330
  830    HA3  GLY 103           2HA      GLY 103   7.904 -12.745   8.559
  831    H    ILE 104           H        ILE 104   8.747 -10.679   6.105
  832    HA   ILE 104           HA       ILE 104   7.643 -12.414   4.104
  833    HB   ILE 104           HB       ILE 104   8.974  -9.705   3.778
  834   HG12  ILE 104          1HG1      ILE 104   7.073  -9.526   5.294
  835   HG13  ILE 104          2HG1      ILE 104   6.703  -8.748   3.758
  836   HG21  ILE 104          1HG2      ILE 104   7.746  -9.555   1.673
  837   HG22  ILE 104          2HG2      ILE 104   7.124 -11.191   1.919
  838   HG23  ILE 104          3HG2      ILE 104   8.856 -10.927   1.694
  839   HD11  ILE 104          3HD1      ILE 104   4.848 -10.010   4.693
  840   HD12  ILE 104          1HD1      ILE 104   5.800 -11.489   4.585
  841   HD13  ILE 104          2HD1      ILE 104   5.348 -10.601   3.116
  842    H    VAL 105           H        VAL 105   8.809 -13.808   2.979
  843    HA   VAL 105           HA       VAL 105  11.680 -13.513   3.135
  844    HB   VAL 105           HB       VAL 105  10.907 -15.653   3.935
  845   HG11  VAL 105          1HG1      VAL 105   9.756 -17.293   2.548
  846   HG12  VAL 105          2HG1      VAL 105   8.796 -15.836   2.780
  847   HG13  VAL 105          3HG1      VAL 105   9.632 -16.105   1.249
  848   HG21  VAL 105          3HG2      VAL 105  12.200 -17.197   2.507
  849   HG22  VAL 105          1HG2      VAL 105  13.052 -15.679   2.801
  850   HG23  VAL 105          2HG2      VAL 105  12.258 -15.959   1.254
  851    H    ILE 106           H        ILE 106  12.464 -12.298   1.635
  852    HA   ILE 106           HA       ILE 106  11.925 -13.112  -1.087
  853    HB   ILE 106           HB       ILE 106  12.317 -10.848  -1.933
  854   HG12  ILE 106          1HG1      ILE 106  13.699 -10.042  -0.019
  855   HG13  ILE 106          2HG1      ILE 106  12.543  -8.855  -0.607
  856   HG21  ILE 106          1HG2      ILE 106  10.065 -10.919   0.028
  857   HG22  ILE 106          2HG2      ILE 106  10.057 -11.490  -1.640
  858   HG23  ILE 106          3HG2      ILE 106  10.227  -9.766  -1.301
  859   HD11  ILE 106          3HD1      ILE 106  12.672  -8.804   1.821
  860   HD12  ILE 106          1HD1      ILE 106  12.285 -10.522   1.905
  861   HD13  ILE 106          2HD1      ILE 106  11.082  -9.373   1.319
  862    HA   PRO 107           HA       PRO 107  16.258 -13.870  -0.914
  863    HB2  PRO 107           1HB      PRO 107  16.319 -13.484  -3.826
  864    HB3  PRO 107           2HB      PRO 107  16.711 -14.903  -2.844
  865    HG2  PRO 107           1HG      PRO 107  14.476 -14.785  -4.362
  866    HG3  PRO 107           2HG      PRO 107  14.547 -15.668  -2.827
  867    HD2  PRO 107           1HD      PRO 107  13.368 -12.993  -3.419
  868    HD3  PRO 107           2HD      PRO 107  12.794 -14.289  -2.341
  869    H    GLU 108           H        GLU 108  17.225 -12.187  -0.041
  870    HA   GLU 108           HA       GLU 108  17.675  -9.821  -1.640
  871    HB2  GLU 108           1HB      GLU 108  18.549  -8.810   0.478
  872    HB3  GLU 108           2HB      GLU 108  16.877  -9.321   0.594
  873    HG2  GLU 108           1HG      GLU 108  17.557 -11.311   1.817
  874    HG3  GLU 108           2HG      GLU 108  19.248 -10.842   1.655
  Start of MODEL    8
    1    HA   TYR   1           HA       TYR   1 -22.092   0.303   1.707
    2    HD1  TYR   1           2HD      TYR   1 -24.598  -1.192   1.865
    3    HD2  TYR   1           1HD      TYR   1 -22.424  -2.248  -1.627
    4    HE1  TYR   1           2HE      TYR   1 -26.685  -1.168   0.564
    5    HE2  TYR   1           1HE      TYR   1 -24.508  -2.230  -2.938
    6    HH   TYR   1           HH       TYR   1 -26.880  -2.465  -2.576
    7    H1   TYR   1           1HT      TYR   1 -21.879   0.335  -0.701
    8    H2   TYR   1           2HT      TYR   1 -20.380  -0.453  -0.566
    9    H3   TYR   1           3HT      TYR   1 -20.581   1.100   0.074
   10    HB2  TYR   1           1HB      TYR   1 -21.403  -2.409   0.523
   11    HB3  TYR   1           2HB      TYR   1 -22.320  -2.144   1.998
   12    H    THR   2           H        THR   2 -21.172  -1.331   3.519
   13    HA   THR   2           HA       THR   2 -18.381  -0.668   3.811
   14    HB   THR   2           HB       THR   2 -20.284  -2.222   5.612
   15    HG1  THR   2           1HG      THR   2 -19.463   0.486   5.860
   16   HG21  THR   2          3HG2      THR   2 -18.685  -1.579   7.406
   17   HG22  THR   2          1HG2      THR   2 -17.623  -0.902   6.178
   18   HG23  THR   2          2HG2      THR   2 -17.950  -2.635   6.198
   19    H    ASP   3           H        ASP   3 -16.767  -2.334   4.073
   20    HA   ASP   3           HA       ASP   3 -15.686  -4.224   3.660
   21    HB2  ASP   3           1HB      ASP   3 -17.222  -5.723   4.674
   22    HB3  ASP   3           2HB      ASP   3 -18.443  -5.450   3.448
   23    H    LYS   4           H        LYS   4 -14.631  -3.437   2.181
   24    HA   LYS   4           HA       LYS   4 -13.519  -3.520   0.251
   25    HB2  LYS   4           1HB      LYS   4 -15.967  -4.687  -1.111
   26    HB3  LYS   4           2HB      LYS   4 -14.595  -4.095  -2.016
   27    HG2  LYS   4           1HG      LYS   4 -14.299  -6.410  -1.934
   28    HG3  LYS   4           2HG      LYS   4 -13.221  -5.800  -0.674
   29    HD2  LYS   4           1HD      LYS   4 -14.830  -6.272   0.991
   30    HD3  LYS   4           2HD      LYS   4 -15.994  -6.730  -0.261
   31    HE2  LYS   4           1HE      LYS   4 -14.534  -8.618  -0.887
   32    HE3  LYS   4           2HE      LYS   4 -13.415  -8.166   0.398
   33    HZ1  LYS   4           3HZ      LYS   4 -14.814  -9.899   1.257
   34    HZ2  LYS   4           1HZ      LYS   4 -16.204  -9.115   0.712
   35    HZ3  LYS   4           2HZ      LYS   4 -15.350  -8.436   1.951
   36    H    TYR   5           H        TYR   5 -12.953  -1.950  -0.809
   37    HA   TYR   5           HA       TYR   5 -12.720   0.047  -1.621
   38    HD1  TYR   5           2HD      TYR   5 -16.514   1.760  -1.922
   39    HD2  TYR   5           1HD      TYR   5 -15.917  -2.074  -3.678
   40    HE1  TYR   5           2HE      TYR   5 -18.938   1.361  -1.869
   41    HE2  TYR   5           1HE      TYR   5 -18.332  -2.486  -3.629
   42    HH   TYR   5           HH       TYR   5 -20.583  -0.089  -3.185
   43    HB2  TYR   5           1HB      TYR   5 -14.313   1.082  -3.198
   44    HB3  TYR   5           2HB      TYR   5 -14.100  -0.588  -3.525
   45    H    ASP   6           H        ASP   6 -14.747  -0.415   0.834
   46    HA   ASP   6           HA       ASP   6 -15.550   2.259   1.250
   47    HB2  ASP   6           1HB      ASP   6 -16.470   1.406   3.346
   48    HB3  ASP   6           2HB      ASP   6 -16.907   0.360   2.010
   49    H    LYS   7           H        LYS   7 -13.417   0.168   3.111
   50    HA   LYS   7           HA       LYS   7 -11.590   2.213   3.896
   51    HB2  LYS   7           1HB      LYS   7 -13.576   3.149   5.011
   52    HB3  LYS   7           2HB      LYS   7 -13.854   1.596   5.780
   53    HG2  LYS   7           1HG      LYS   7 -11.687   1.871   7.025
   54    HG3  LYS   7           2HG      LYS   7 -11.559   3.485   6.318
   55    HD2  LYS   7           1HD      LYS   7 -13.564   4.203   7.428
   56    HD3  LYS   7           2HD      LYS   7 -13.876   2.573   8.011
   57    HE2  LYS   7           1HE      LYS   7 -12.962   3.983   9.790
   58    HE3  LYS   7           2HE      LYS   7 -11.865   2.669   9.397
   59    HZ1  LYS   7           3HZ      LYS   7 -11.553   5.486   8.430
   60    HZ2  LYS   7           1HZ      LYS   7 -10.467   4.204   8.194
   61    HZ3  LYS   7           2HZ      LYS   7 -10.724   4.777   9.730
   62    H    ILE   8           H        ILE   8 -13.491  -0.263   5.627
   63    HA   ILE   8           HA       ILE   8 -11.094  -1.431   6.678
   64    HB   ILE   8           HB       ILE   8 -12.677  -2.920   7.967
   65   HG12  ILE   8          1HG1      ILE   8 -14.794  -1.041   6.883
   66   HG13  ILE   8          2HG1      ILE   8 -14.605  -2.720   6.387
   67   HG21  ILE   8          1HG2      ILE   8 -12.995   0.061   8.290
   68   HG22  ILE   8          2HG2      ILE   8 -11.712  -0.937   8.973
   69   HG23  ILE   8          3HG2      ILE   8 -13.376  -1.142   9.520
   70   HD11  ILE   8          3HD1      ILE   8 -15.093  -3.414   8.701
   71   HD12  ILE   8          1HD1      ILE   8 -16.411  -2.473   8.001
   72   HD13  ILE   8          2HD1      ILE   8 -15.301  -1.723   9.150
   73    H    ASN   9           H        ASN   9 -10.435  -1.952   4.665
   74    HA   ASN   9           HA       ASN   9 -11.128  -4.643   3.807
   75    HB2  ASN   9           1HB      ASN   9 -11.870  -4.067   1.627
   76    HB3  ASN   9           2HB      ASN   9 -12.735  -2.974   2.697
   77   HD21  ASN   9          1HD2      ASN   9 -10.548  -1.068   3.099
   78   HD22  ASN   9          2HD2      ASN   9 -10.077  -0.489   1.569
   79    H    LEU  10           H        LEU  10  -8.716  -2.657   4.640
   80    HA   LEU  10           HA       LEU  10  -7.164  -2.014   2.378
   81    HG   LEU  10           HG       LEU  10  -7.970  -0.677   4.862
   82    HB2  LEU  10           1HB      LEU  10  -6.129  -2.564   5.169
   83    HB3  LEU  10           2HB      LEU  10  -5.347  -1.688   3.890
   84   HD11  LEU  10          1HD1      LEU  10  -6.565  -1.015   6.844
   85   HD12  LEU  10          2HD1      LEU  10  -6.731   0.697   6.458
   86   HD13  LEU  10          3HD1      LEU  10  -5.249  -0.174   6.039
   87   HD21  LEU  10          3HD2      LEU  10  -6.912   1.432   4.139
   88   HD22  LEU  10          1HD2      LEU  10  -7.071   0.231   2.842
   89   HD23  LEU  10          2HD2      LEU  10  -5.504   0.491   3.616
   90    H    GLN  11           H        GLN  11  -7.015  -4.713   4.549
   91    HA   GLN  11           HA       GLN  11  -4.865  -5.962   3.066
   92    HB2  GLN  11           1HB      GLN  11  -4.999  -5.849   5.588
   93    HB3  GLN  11           2HB      GLN  11  -6.366  -6.941   5.481
   94    HG2  GLN  11           1HG      GLN  11  -4.318  -8.094   6.075
   95    HG3  GLN  11           2HG      GLN  11  -4.963  -8.660   4.538
   96   HE21  GLN  11          1HE2      GLN  11  -3.315  -5.572   4.620
   97   HE22  GLN  11          2HE2      GLN  11  -1.864  -6.101   3.904
   98    H    GLU  12           H        GLU  12  -8.292  -5.958   3.371
   99    HA   GLU  12           HA       GLU  12  -8.844  -8.703   2.740
  100    HB2  GLU  12           1HB      GLU  12 -10.473  -7.238   3.864
  101    HB3  GLU  12           2HB      GLU  12 -10.488  -6.176   2.466
  102    HG2  GLU  12           1HG      GLU  12 -12.467  -7.485   2.463
  103    HG3  GLU  12           2HG      GLU  12 -11.431  -8.008   1.131
  104    H    ILE  13           H        ILE  13  -8.633  -5.713   1.112
  105    HA   ILE  13           HA       ILE  13  -9.253  -6.525  -1.487
  106    HB   ILE  13           HB       ILE  13  -7.892  -4.164  -0.290
  107   HG12  ILE  13          1HG1      ILE  13 -10.222  -4.315   0.184
  108   HG13  ILE  13          2HG1      ILE  13  -9.932  -3.017  -0.961
  109   HG21  ILE  13          1HG2      ILE  13  -8.649  -4.575  -3.125
  110   HG22  ILE  13          2HG2      ILE  13  -7.017  -4.588  -2.467
  111   HG23  ILE  13          3HG2      ILE  13  -7.979  -3.098  -2.419
  112   HD11  ILE  13          3HD1      ILE  13 -11.895  -4.126  -1.636
  113   HD12  ILE  13          1HD1      ILE  13 -11.111  -5.712  -1.492
  114   HD13  ILE  13          2HD1      ILE  13 -10.585  -4.587  -2.739
  115    H    LEU  14           H        LEU  14  -6.184  -5.616   0.096
  116    HA   LEU  14           HA       LEU  14  -4.412  -5.885  -1.888
  117    HG   LEU  14           HG       LEU  14  -2.032  -7.120  -0.410
  118    HB2  LEU  14           1HB      LEU  14  -4.066  -5.054   0.377
  119    HB3  LEU  14           2HB      LEU  14  -4.045  -6.702   0.957
  120   HD11  LEU  14          1HD1      LEU  14  -0.836  -5.230  -1.359
  121   HD12  LEU  14          2HD1      LEU  14  -2.148  -4.145  -0.907
  122   HD13  LEU  14          3HD1      LEU  14  -2.413  -5.399  -2.120
  123   HD21  LEU  14          3HD2      LEU  14  -1.949  -4.835   1.519
  124   HD22  LEU  14          1HD2      LEU  14  -0.553  -5.803   1.062
  125   HD23  LEU  14          2HD2      LEU  14  -1.880  -6.543   1.935
  126    H    GLU  15           H        GLU  15  -5.853  -8.508  -0.090
  127    HA   GLU  15           HA       GLU  15  -4.047 -10.490  -0.838
  128    HB2  GLU  15           1HB      GLU  15  -5.366 -10.835   1.022
  129    HB3  GLU  15           2HB      GLU  15  -6.892 -10.617   0.153
  130    HG2  GLU  15           1HG      GLU  15  -6.408 -12.718  -1.078
  131    HG3  GLU  15           2HG      GLU  15  -4.948 -12.913  -0.114
  132    H    ASN  16           H        ASN  16  -6.615  -9.075  -2.716
  133    HA   ASN  16           HA       ASN  16  -6.074 -11.118  -4.746
  134    HB2  ASN  16           1HB      ASN  16  -8.775 -10.058  -3.992
  135    HB3  ASN  16           2HB      ASN  16  -8.472 -10.894  -5.508
  136   HD21  ASN  16          1HD2      ASN  16  -8.852 -11.170  -2.118
  137   HD22  ASN  16          2HD2      ASN  16  -8.865 -12.883  -2.053
  138    H    LYS  17           H        LYS  17  -5.492 -10.331  -6.671
  139    HA   LYS  17           HA       LYS  17  -5.144  -7.622  -7.158
  140    HB2  LYS  17           1HB      LYS  17  -4.769  -8.089  -9.535
  141    HB3  LYS  17           2HB      LYS  17  -3.965  -9.284  -8.546
  142    HG2  LYS  17           1HG      LYS  17  -6.652  -9.803  -9.787
  143    HG3  LYS  17           2HG      LYS  17  -5.164 -10.023 -10.689
  144    HD2  LYS  17           1HD      LYS  17  -5.629 -11.403  -8.050
  145    HD3  LYS  17           2HD      LYS  17  -6.256 -12.060  -9.548
  146    HE2  LYS  17           1HE      LYS  17  -4.221 -13.180  -9.347
  147    HE3  LYS  17           2HE      LYS  17  -3.802 -11.841 -10.393
  148    HZ1  LYS  17           3HZ      LYS  17  -2.925 -10.693  -8.263
  149    HZ2  LYS  17           1HZ      LYS  17  -2.116 -12.085  -8.764
  150    HZ3  LYS  17           2HZ      LYS  17  -3.199 -12.170  -7.520
  151    H    ARG  18           H        ARG  18  -7.856  -9.576  -7.958
  152    HA   ARG  18           HA       ARG  18  -9.303  -7.571  -9.340
  153    HE   ARG  18           HE       ARG  18  -9.846 -12.719  -6.415
  154    HB2  ARG  18           1HB      ARG  18 -11.322  -9.041  -9.020
  155    HB3  ARG  18           2HB      ARG  18  -9.978  -9.782  -9.857
  156    HG2  ARG  18           1HG      ARG  18 -10.510 -10.249  -6.918
  157    HG3  ARG  18           2HG      ARG  18 -11.269 -11.213  -8.181
  158    HD2  ARG  18           1HD      ARG  18  -8.920 -11.745  -9.006
  159    HD3  ARG  18           2HD      ARG  18  -8.292 -11.040  -7.522
  160   HH11  ARG  18          1HH1      ARG  18  -8.212 -13.326  -9.529
  161   HH12  ARG  18          2HH1      ARG  18  -7.946 -14.968  -9.219
  162   HH21  ARG  18          1HH2      ARG  18  -9.476 -14.982  -6.030
  163   HH22  ARG  18          2HH2      ARG  18  -8.700 -15.937  -7.204
  164    H    LEU  19           H        LEU  19  -9.157  -8.442  -5.953
  165    HA   LEU  19           HA       LEU  19 -11.279  -6.670  -5.321
  166    HG   LEU  19           HG       LEU  19 -10.805  -9.634  -4.287
  167    HB2  LEU  19           1HB      LEU  19  -9.212  -7.945  -3.531
  168    HB3  LEU  19           2HB      LEU  19 -10.526  -6.932  -2.976
  169   HD11  LEU  19          1HD1      LEU  19 -11.481  -8.692  -1.514
  170   HD12  LEU  19          2HD1      LEU  19 -10.045  -9.602  -1.940
  171   HD13  LEU  19          3HD1      LEU  19 -11.642 -10.334  -2.143
  172   HD21  LEU  19          3HD2      LEU  19 -13.200  -9.373  -3.789
  173   HD22  LEU  19          1HD2      LEU  19 -12.635  -8.203  -4.982
  174   HD23  LEU  19          2HD2      LEU  19 -12.901  -7.703  -3.314
  175    H    LEU  20           H        LEU  20  -7.891  -6.480  -5.808
  176    HA   LEU  20           HA       LEU  20  -7.339  -4.041  -4.498
  177    HG   LEU  20           HG       LEU  20  -4.956  -2.977  -5.708
  178    HB2  LEU  20           1HB      LEU  20  -5.823  -5.876  -5.725
  179    HB3  LEU  20           2HB      LEU  20  -5.998  -4.768  -7.068
  180   HD11  LEU  20          1HD1      LEU  20  -5.635  -3.779  -3.494
  181   HD12  LEU  20          2HD1      LEU  20  -3.874  -3.622  -3.573
  182   HD13  LEU  20          3HD1      LEU  20  -4.629  -5.208  -3.710
  183   HD21  LEU  20          3HD2      LEU  20  -2.717  -3.900  -5.708
  184   HD22  LEU  20          1HD2      LEU  20  -3.586  -4.425  -7.156
  185   HD23  LEU  20          2HD2      LEU  20  -3.378  -5.530  -5.786
  186    H    GLU  21           H        GLU  21  -8.320  -4.902  -7.708
  187    HA   GLU  21           HA       GLU  21  -8.735  -2.403  -8.820
  188    HB2  GLU  21           1HB      GLU  21 -10.146  -5.020  -9.237
  189    HB3  GLU  21           2HB      GLU  21 -10.361  -3.619 -10.268
  190    HG2  GLU  21           1HG      GLU  21  -7.741  -5.013  -9.780
  191    HG3  GLU  21           2HG      GLU  21  -8.779  -5.266 -11.182
  192    H    SER  22           H        SER  22 -10.721  -4.264  -6.590
  193    HA   SER  22           HA       SER  22 -13.021  -2.664  -6.852
  194    HG   SER  22           HG       SER  22 -12.637  -5.168  -6.800
  195    HB2  SER  22           1HB      SER  22 -12.363  -4.294  -4.324
  196    HB3  SER  22           2HB      SER  22 -13.907  -3.712  -4.885
  197    H    TYR  23           H        TYR  23 -10.197  -2.224  -4.602
  198    HA   TYR  23           HA       TYR  23 -11.556   0.325  -4.009
  199    HD1  TYR  23           2HD      TYR  23  -8.049  -1.096  -3.850
  200    HD2  TYR  23           1HD      TYR  23  -9.231  -0.178   0.120
  201    HE1  TYR  23           2HE      TYR  23  -5.760  -1.549  -3.061
  202    HE2  TYR  23           1HE      TYR  23  -6.977  -0.584   0.941
  203    HH   TYR  23           HH       TYR  23  -5.003  -1.954   0.182
  204    HB2  TYR  23           1HB      TYR  23 -10.434   0.683  -1.950
  205    HB3  TYR  23           2HB      TYR  23 -10.917  -0.966  -1.797
  206    H    MET  24           H        MET  24  -9.846  -0.485  -6.225
  207    HA   MET  24           HA       MET  24  -7.548   1.051  -6.329
  208    HB2  MET  24           1HB      MET  24  -9.202  -0.239  -8.346
  209    HB3  MET  24           2HB      MET  24  -8.297   1.156  -8.924
  210    HG2  MET  24           1HG      MET  24  -7.098  -1.190  -7.474
  211    HG3  MET  24           2HG      MET  24  -7.093  -0.972  -9.221
  212    HE1  MET  24           3HE      MET  24  -4.449  -1.484  -7.530
  213    HE2  MET  24           1HE      MET  24  -4.462  -1.253  -9.277
  214    HE3  MET  24           2HE      MET  24  -3.359  -0.314  -8.271
  215    H    ASP  25           H        ASP  25 -10.750   2.253  -6.538
  216    HA   ASP  25           HA       ASP  25 -10.290   4.749  -7.777
  217    HB2  ASP  25           1HB      ASP  25 -12.504   4.237  -7.334
  218    HB3  ASP  25           2HB      ASP  25 -12.200   3.918  -5.635
  219    H    CYS  26           H        CYS  26 -10.026   3.825  -4.471
  220    HA   CYS  26           HA       CYS  26  -9.210   6.460  -3.812
  221    HB2  CYS  26           1HB      CYS  26  -8.907   5.272  -1.483
  222    HB3  CYS  26           2HB      CYS  26 -10.497   5.716  -2.116
  223    H    VAL  27           H        VAL  27  -7.597   3.441  -4.424
  224    HA   VAL  27           HA       VAL  27  -5.119   4.567  -3.506
  225    HB   VAL  27           HB       VAL  27  -5.621   2.022  -5.081
  226   HG11  VAL  27          1HG1      VAL  27  -3.082   2.993  -3.746
  227   HG12  VAL  27          2HG1      VAL  27  -3.314   1.408  -4.488
  228   HG13  VAL  27          3HG1      VAL  27  -3.343   2.865  -5.484
  229   HG21  VAL  27          3HG2      VAL  27  -4.998   2.503  -2.173
  230   HG22  VAL  27          1HG2      VAL  27  -5.175   0.928  -2.942
  231   HG23  VAL  27          2HG2      VAL  27  -6.559   2.016  -2.835
  232    H    LEU  28           H        LEU  28  -6.372   3.747  -6.832
  233    HA   LEU  28           HA       LEU  28  -4.219   5.482  -7.819
  234    HG   LEU  28           HG       LEU  28  -4.862   5.091 -10.849
  235    HB2  LEU  28           1HB      LEU  28  -4.192   3.161  -8.630
  236    HB3  LEU  28           2HB      LEU  28  -5.787   3.383  -9.310
  237   HD11  LEU  28          1HD1      LEU  28  -2.961   5.831  -9.542
  238   HD12  LEU  28          2HD1      LEU  28  -2.430   5.249 -11.124
  239   HD13  LEU  28          3HD1      LEU  28  -2.212   4.238  -9.693
  240   HD21  LEU  28          3HD2      LEU  28  -3.511   2.396 -10.939
  241   HD22  LEU  28          1HD2      LEU  28  -3.672   3.518 -12.294
  242   HD23  LEU  28          2HD2      LEU  28  -5.111   2.792 -11.579
  243    H    GLY  29           H        GLY  29  -7.647   4.966  -7.905
  244    HA2  GLY  29           1HA      GLY  29  -9.089   6.927  -8.165
  245    HA3  GLY  29           2HA      GLY  29  -7.960   7.512  -9.382
  246    H    LYS  30           H        LYS  30  -9.296   4.223  -9.045
  247    HA   LYS  30           HA       LYS  30 -10.113   4.412 -11.824
  248    HB2  LYS  30           1HB      LYS  30 -10.073   2.017 -10.011
  249    HB3  LYS  30           2HB      LYS  30 -10.482   1.978 -11.718
  250    HG2  LYS  30           1HG      LYS  30  -8.143   2.919 -12.122
  251    HG3  LYS  30           2HG      LYS  30  -7.863   2.539 -10.412
  252    HD2  LYS  30           1HD      LYS  30  -8.432   0.186 -10.823
  253    HD3  LYS  30           2HD      LYS  30  -8.746   0.553 -12.516
  254    HE2  LYS  30           1HE      LYS  30  -6.389   1.221 -12.780
  255    HE3  LYS  30           2HE      LYS  30  -6.095   0.792 -11.097
  256    HZ1  LYS  30           3HZ      LYS  30  -7.013  -1.089 -13.202
  257    HZ2  LYS  30           1HZ      LYS  30  -6.692  -1.511 -11.618
  258    HZ3  LYS  30           2HZ      LYS  30  -5.440  -1.015 -12.605
  259    H    GLY  31           H        GLY  31 -11.754   2.916  -8.995
  260    HA2  GLY  31           1HA      GLY  31 -14.301   3.352 -10.413
  261    HA3  GLY  31           2HA      GLY  31 -14.053   2.233  -9.089
  262    H    LYS  32           H        LYS  32 -14.893   2.811  -7.198
  263    HA   LYS  32           HA       LYS  32 -14.837   5.530  -6.327
  264    HB2  LYS  32           1HB      LYS  32 -17.272   5.643  -5.809
  265    HB3  LYS  32           2HB      LYS  32 -16.890   5.710  -7.519
  266    HG2  LYS  32           1HG      LYS  32 -17.563   3.394  -7.791
  267    HG3  LYS  32           2HG      LYS  32 -17.830   3.255  -6.054
  268    HD2  LYS  32           1HD      LYS  32 -19.300   5.182  -7.843
  269    HD3  LYS  32           2HD      LYS  32 -19.921   3.586  -7.411
  270    HE2  LYS  32           1HE      LYS  32 -19.918   4.223  -5.050
  271    HE3  LYS  32           2HE      LYS  32 -19.262   5.802  -5.442
  272    HZ1  LYS  32           3HZ      LYS  32 -21.890   4.734  -6.289
  273    HZ2  LYS  32           1HZ      LYS  32 -21.291   6.244  -6.727
  274    HZ3  LYS  32           2HZ      LYS  32 -21.636   5.911  -5.109
  275    H    CYS  33           H        CYS  33 -13.997   5.360  -4.432
  276    HA   CYS  33           HA       CYS  33 -14.943   3.374  -2.479
  277    HB2  CYS  33           1HB      CYS  33 -12.603   5.336  -2.285
  278    HB3  CYS  33           2HB      CYS  33 -12.977   4.014  -1.169
  279    H    THR  34           H        THR  34 -15.059   4.535  -0.125
  280    HA   THR  34           HA       THR  34 -16.746   6.844  -0.448
  281    HB   THR  34           HB       THR  34 -16.987   6.610   2.045
  282    HG1  THR  34           1HG      THR  34 -16.050   4.576   2.875
  283   HG21  THR  34          3HG2      THR  34 -18.223   4.513   2.003
  284   HG22  THR  34          1HG2      THR  34 -17.368   4.018   0.537
  285   HG23  THR  34          2HG2      THR  34 -18.470   5.390   0.492
  286    HA   PRO  35           HA       PRO  35 -13.663  10.025   0.283
  287    HB2  PRO  35           1HB      PRO  35 -14.887  11.336   2.464
  288    HB3  PRO  35           2HB      PRO  35 -15.095  11.741   0.761
  289    HG2  PRO  35           1HG      PRO  35 -16.830  10.096   2.542
  290    HG3  PRO  35           2HG      PRO  35 -17.292  11.176   1.213
  291    HD2  PRO  35           1HD      PRO  35 -17.365   8.527   0.931
  292    HD3  PRO  35           2HD      PRO  35 -16.817   9.563  -0.403
  293    H    GLU  36           H        GLU  36 -14.996   8.638   3.210
  294    HA   GLU  36           HA       GLU  36 -13.013   8.898   5.096
  295    HB2  GLU  36           1HB      GLU  36 -15.149   7.976   5.612
  296    HB3  GLU  36           2HB      GLU  36 -14.958   6.693   4.440
  297    HG2  GLU  36           1HG      GLU  36 -14.796   5.790   6.634
  298    HG3  GLU  36           2HG      GLU  36 -13.221   5.700   5.859
  299    H    GLY  37           H        GLY  37 -13.404   6.368   2.681
  300    HA2  GLY  37           1HA      GLY  37 -11.054   4.939   3.453
  301    HA3  GLY  37           2HA      GLY  37 -12.081   4.599   2.073
  302    H    LYS  38           H        LYS  38 -11.935   7.149   0.940
  303    HA   LYS  38           HA       LYS  38  -9.716   6.972  -0.773
  304    HB2  LYS  38           1HB      LYS  38 -11.268   9.450  -0.016
  305    HB3  LYS  38           2HB      LYS  38 -10.115   9.370  -1.334
  306    HG2  LYS  38           1HG      LYS  38 -11.505   7.750  -2.455
  307    HG3  LYS  38           2HG      LYS  38 -12.682   7.797  -1.144
  308    HD2  LYS  38           1HD      LYS  38 -12.937  10.268  -1.529
  309    HD3  LYS  38           2HD      LYS  38 -11.887  10.109  -2.920
  310    HE2  LYS  38           1HE      LYS  38 -14.458   8.561  -2.672
  311    HE3  LYS  38           2HE      LYS  38 -14.401  10.176  -3.355
  312    HZ1  LYS  38           3HZ      LYS  38 -14.315   8.565  -5.091
  313    HZ2  LYS  38           1HZ      LYS  38 -12.992   7.763  -4.433
  314    HZ3  LYS  38           2HZ      LYS  38 -12.824   9.321  -5.015
  315    H    GLU  39           H        GLU  39 -10.093   8.642   2.208
  316    HA   GLU  39           HA       GLU  39  -7.602  10.050   1.940
  317    HB2  GLU  39           1HB      GLU  39  -9.576  11.057   3.036
  318    HB3  GLU  39           2HB      GLU  39  -9.453   9.840   4.281
  319    HG2  GLU  39           1HG      GLU  39  -7.386  10.557   5.032
  320    HG3  GLU  39           2HG      GLU  39  -7.160  11.585   3.621
  321    H    LEU  40           H        LEU  40  -8.987   7.598   4.008
  322    HA   LEU  40           HA       LEU  40  -6.939   6.871   5.650
  323    HG   LEU  40           HG       LEU  40  -7.139   3.958   4.565
  324    HB2  LEU  40           1HB      LEU  40  -8.966   5.769   5.943
  325    HB3  LEU  40           2HB      LEU  40  -9.090   5.348   4.245
  326   HD11  LEU  40          1HD1      LEU  40  -6.279   4.669   6.682
  327   HD12  LEU  40          2HD1      LEU  40  -6.755   2.978   6.858
  328   HD13  LEU  40          3HD1      LEU  40  -7.787   4.256   7.498
  329   HD21  LEU  40          3HD2      LEU  40  -8.405   1.991   5.410
  330   HD22  LEU  40          1HD2      LEU  40  -9.243   2.935   4.198
  331   HD23  LEU  40          2HD2      LEU  40  -9.691   3.088   5.903
  332    H    LYS  41           H        LYS  41  -7.600   5.602   2.425
  333    HA   LYS  41           HA       LYS  41  -5.350   3.846   2.514
  334    HB2  LYS  41           1HB      LYS  41  -7.171   4.489   0.219
  335    HB3  LYS  41           2HB      LYS  41  -6.110   3.086   0.377
  336    HG2  LYS  41           1HG      LYS  41  -7.369   2.156   2.089
  337    HG3  LYS  41           2HG      LYS  41  -8.231   3.662   2.399
  338    HD2  LYS  41           1HD      LYS  41  -9.107   3.444   0.054
  339    HD3  LYS  41           2HD      LYS  41  -8.474   1.803   0.095
  340    HE2  LYS  41           1HE      LYS  41  -9.878   1.281   2.000
  341    HE3  LYS  41           2HE      LYS  41 -10.435   2.954   2.068
  342    HZ1  LYS  41           3HZ      LYS  41 -12.120   1.771   0.930
  343    HZ2  LYS  41           1HZ      LYS  41 -11.008   0.981  -0.089
  344    HZ3  LYS  41           2HZ      LYS  41 -11.270   2.615  -0.234
  345    H    ASP  42           H        ASP  42  -6.002   7.008   1.257
  346    HA   ASP  42           HA       ASP  42  -3.909   7.224  -0.570
  347    HB2  ASP  42           1HB      ASP  42  -5.609   8.975  -0.270
  348    HB3  ASP  42           2HB      ASP  42  -4.972   9.322   1.333
  349    H    HIS  43           H        HIS  43  -4.000   7.971   2.881
  350    HA   HIS  43           HA       HIS  43  -1.154   8.397   2.912
  351    HD1  HIS  43           1HD      HIS  43  -0.522  10.838   3.657
  352    HD2  HIS  43           2HD      HIS  43  -4.582  10.695   4.554
  353    HE1  HIS  43           1HE      HIS  43  -1.395  13.140   3.221
  354    HE2  HIS  43           2HE      HIS  43  -3.771  13.080   4.057
  355    HB2  HIS  43           1HB      HIS  43  -3.159   8.495   5.116
  356    HB3  HIS  43           2HB      HIS  43  -1.442   8.804   5.368
  357    H    LEU  44           H        LEU  44  -3.218   5.751   3.731
  358    HA   LEU  44           HA       LEU  44  -1.189   4.453   5.273
  359    HG   LEU  44           HG       LEU  44  -1.906   2.302   6.279
  360    HB2  LEU  44           1HB      LEU  44  -3.647   4.172   5.600
  361    HB3  LEU  44           2HB      LEU  44  -3.698   3.281   4.099
  362   HD11  LEU  44          1HD1      LEU  44  -3.873   1.064   7.181
  363   HD12  LEU  44          2HD1      LEU  44  -4.890   2.029   6.120
  364   HD13  LEU  44          3HD1      LEU  44  -3.971   2.811   7.402
  365   HD21  LEU  44          3HD2      LEU  44  -2.563   0.127   5.331
  366   HD22  LEU  44          1HD2      LEU  44  -1.907   1.185   4.081
  367   HD23  LEU  44          2HD2      LEU  44  -3.645   0.938   4.199
  368    H    GLN  45           H        GLN  45  -2.573   3.822   2.031
  369    HA   GLN  45           HA       GLN  45  -0.503   2.089   1.395
  370    HB2  GLN  45           1HB      GLN  45  -2.658   3.400  -0.208
  371    HB3  GLN  45           2HB      GLN  45  -1.284   2.757  -1.095
  372    HG2  GLN  45           1HG      GLN  45  -3.182   1.159  -0.974
  373    HG3  GLN  45           2HG      GLN  45  -1.712   0.520  -0.269
  374   HE21  GLN  45          1HE2      GLN  45  -2.825  -1.051   0.940
  375   HE22  GLN  45          2HE2      GLN  45  -3.734  -0.669   2.338
  376    H    GLU  46           H        GLU  46  -0.644   5.547   1.329
  377    HA   GLU  46           HA       GLU  46   1.686   6.322  -0.005
  378    HB2  GLU  46           1HB      GLU  46   0.236   7.910   1.129
  379    HB3  GLU  46           2HB      GLU  46   0.549   7.143   2.669
  380    HG2  GLU  46           1HG      GLU  46   2.952   7.895   2.348
  381    HG3  GLU  46           2HG      GLU  46   2.326   8.948   1.073
  382    H    ALA  47           H        ALA  47   1.272   5.203   3.322
  383    HA   ALA  47           HA       ALA  47   3.999   5.105   4.023
  384    HB1  ALA  47           3HB      ALA  47   3.192   3.835   5.955
  385    HB2  ALA  47           1HB      ALA  47   2.266   5.324   5.689
  386    HB3  ALA  47           2HB      ALA  47   1.597   3.750   5.218
  387    H    LEU  48           H        LEU  48   1.798   2.800   2.653
  388    HA   LEU  48           HA       LEU  48   3.249   0.424   2.758
  389    HG   LEU  48           HG       LEU  48   2.694   0.078  -0.556
  390    HB2  LEU  48           1HB      LEU  48   1.050   0.297   1.962
  391    HB3  LEU  48           2HB      LEU  48   1.322   1.593   0.817
  392   HD11  LEU  48          1HD1      LEU  48   2.693  -2.296  -0.162
  393   HD12  LEU  48          2HD1      LEU  48   1.742  -2.077   1.301
  394   HD13  LEU  48          3HD1      LEU  48   3.386  -1.444   1.214
  395   HD21  LEU  48          3HD2      LEU  48   0.315   0.490  -0.941
  396   HD22  LEU  48          1HD2      LEU  48  -0.081  -0.933   0.012
  397   HD23  LEU  48          2HD2      LEU  48   0.820  -1.087  -1.510
  398    H    GLU  49           H        GLU  49   3.365   3.020   0.366
  399    HA   GLU  49           HA       GLU  49   5.290   2.020  -1.394
  400    HB2  GLU  49           1HB      GLU  49   3.919   4.028  -1.797
  401    HB3  GLU  49           2HB      GLU  49   4.681   4.842  -0.461
  402    HG2  GLU  49           1HG      GLU  49   6.175   4.021  -2.942
  403    HG3  GLU  49           2HG      GLU  49   5.351   5.565  -2.775
  404    H    THR  50           H        THR  50   5.645   4.239   1.189
  405    HA   THR  50           HA       THR  50   7.436   3.173   2.880
  406    HB   THR  50           HB       THR  50   8.886   5.004   0.878
  407    HG1  THR  50           1HG      THR  50   8.706   2.492   0.941
  408   HG21  THR  50          3HG2      THR  50   9.443   5.656   3.190
  409   HG22  THR  50          1HG2      THR  50  10.834   4.921   2.388
  410   HG23  THR  50          2HG2      THR  50   9.892   3.987   3.548
  411    H    GLY  51           H        GLY  51   6.682   6.099   1.065
  412    HA2  GLY  51           1HA      GLY  51   6.048   8.237   1.723
  413    HA3  GLY  51           2HA      GLY  51   4.755   7.246   2.362
  414    H    CYS  52           H        CYS  52   4.470   7.081   4.449
  415    HA   CYS  52           HA       CYS  52   6.587   7.747   6.241
  416    HB2  CYS  52           1HB      CYS  52   5.488   9.918   5.943
  417    HB3  CYS  52           2HB      CYS  52   3.942   9.196   6.374
  418    H    GLU  53           H        GLU  53   6.442   5.499   6.429
  419    HA   GLU  53           HA       GLU  53   4.253   4.087   7.483
  420    HB2  GLU  53           1HB      GLU  53   6.172   2.934   6.497
  421    HB3  GLU  53           2HB      GLU  53   7.232   3.580   7.735
  422    HG2  GLU  53           1HG      GLU  53   6.046   2.284   9.431
  423    HG3  GLU  53           2HG      GLU  53   4.978   1.635   8.191
  424    H    LYS  54           H        LYS  54   6.925   5.695   9.079
  425    HA   LYS  54           HA       LYS  54   5.915   5.012  11.659
  426    HB2  LYS  54           1HB      LYS  54   7.767   6.524  12.539
  427    HB3  LYS  54           2HB      LYS  54   8.240   5.103  11.648
  428    HG2  LYS  54           1HG      LYS  54   9.669   6.948  11.084
  429    HG3  LYS  54           2HG      LYS  54   8.713   6.523   9.680
  430    HD2  LYS  54           1HD      LYS  54   7.293   8.443  10.017
  431    HD3  LYS  54           2HD      LYS  54   8.062   8.786  11.565
  432    HE2  LYS  54           1HE      LYS  54   8.900  10.302   9.877
  433    HE3  LYS  54           2HE      LYS  54  10.183   9.227  10.406
  434    HZ1  LYS  54           3HZ      LYS  54   9.742   7.897   8.327
  435    HZ2  LYS  54           1HZ      LYS  54  10.269   9.480   8.059
  436    HZ3  LYS  54           2HZ      LYS  54   8.671   9.133   7.856
  437    H    CYS  55           H        CYS  55   4.229   6.721   9.932
  438    HA   CYS  55           HA       CYS  55   4.030   9.170  11.371
  439    HB2  CYS  55           1HB      CYS  55   2.644   8.091   9.035
  440    HB3  CYS  55           2HB      CYS  55   1.708   9.208  10.008
  441    H    THR  56           H        THR  56   0.848   7.733  10.879
  442    HA   THR  56           HA       THR  56   0.473   8.074  13.732
  443    HB   THR  56           HB       THR  56  -1.947   7.925  13.131
  444    HG1  THR  56           1HG      THR  56  -1.832   8.412  10.544
  445   HG21  THR  56          3HG2      THR  56  -2.060  10.134  12.030
  446   HG22  THR  56          1HG2      THR  56  -0.353  10.000  11.612
  447   HG23  THR  56          2HG2      THR  56  -0.841  10.118  13.303
  448    H    GLU  57           H        GLU  57  -1.062   6.477  14.740
  449    HA   GLU  57           HA       GLU  57  -0.151   3.884  14.726
  450    HB2  GLU  57           1HB      GLU  57  -2.231   3.319  15.961
  451    HB3  GLU  57           2HB      GLU  57  -1.439   4.762  16.570
  452    HG2  GLU  57           1HG      GLU  57  -3.055   6.137  15.292
  453    HG3  GLU  57           2HG      GLU  57  -3.877   4.660  14.807
  454    H    ALA  58           H        ALA  58  -2.759   5.260  12.844
  455    HA   ALA  58           HA       ALA  58  -3.708   2.812  11.744
  456    HB1  ALA  58           3HB      ALA  58  -5.111   4.830  11.825
  457    HB2  ALA  58           1HB      ALA  58  -4.020   5.628  10.694
  458    HB3  ALA  58           2HB      ALA  58  -4.952   4.225  10.175
  459    H    GLN  59           H        GLN  59  -1.510   5.335  10.635
  460    HA   GLN  59           HA       GLN  59  -1.003   4.174   8.128
  461    HB2  GLN  59           1HB      GLN  59   0.455   6.253   9.728
  462    HB3  GLN  59           2HB      GLN  59   1.046   5.692   8.170
  463    HG2  GLN  59           1HG      GLN  59  -0.917   6.477   7.059
  464    HG3  GLN  59           2HG      GLN  59  -1.700   6.844   8.593
  465   HE21  GLN  59          1HE2      GLN  59   0.885   7.786   6.420
  466   HE22  GLN  59          2HE2      GLN  59   0.997   9.402   6.980
  467    H    GLU  60           H        GLU  60   0.940   4.127  11.120
  468    HA   GLU  60           HA       GLU  60   3.050   2.613  10.121
  469    HB2  GLU  60           1HB      GLU  60   3.546   1.994  12.504
  470    HB3  GLU  60           2HB      GLU  60   3.303   3.713  12.242
  471    HG2  GLU  60           1HG      GLU  60   1.053   3.542  13.106
  472    HG3  GLU  60           2HG      GLU  60   1.241   1.814  13.340
  473    H    LYS  61           H        LYS  61   0.200   1.403  11.837
  474    HA   LYS  61           HA       LYS  61   0.903  -1.335  11.739
  475    HB2  LYS  61           1HB      LYS  61  -0.624  -0.409  13.387
  476    HB3  LYS  61           2HB      LYS  61  -1.733   0.076  12.124
  477    HG2  LYS  61           1HG      LYS  61  -2.162  -2.272  11.604
  478    HG3  LYS  61           2HG      LYS  61  -1.047  -2.751  12.890
  479    HD2  LYS  61           1HD      LYS  61  -2.416  -1.598  14.533
  480    HD3  LYS  61           2HD      LYS  61  -3.514  -1.065  13.263
  481    HE2  LYS  61           1HE      LYS  61  -4.107  -3.374  12.791
  482    HE3  LYS  61           2HE      LYS  61  -2.970  -3.927  14.016
  483    HZ1  LYS  61           3HZ      LYS  61  -5.247  -3.865  14.855
  484    HZ2  LYS  61           1HZ      LYS  61  -5.333  -2.209  14.552
  485    HZ3  LYS  61           2HZ      LYS  61  -4.260  -2.787  15.696
  486    H    GLY  62           H        GLY  62  -1.238   0.713   9.840
  487    HA2  GLY  62           1HA      GLY  62  -2.239  -1.279   8.142
  488    HA3  GLY  62           2HA      GLY  62  -2.192   0.482   7.844
  489    H    ALA  63           H        ALA  63   0.522   0.925   7.854
  490    HA   ALA  63           HA       ALA  63   1.274   0.448   5.247
  491    HB1  ALA  63           3HB      ALA  63   2.273   2.148   6.716
  492    HB2  ALA  63           1HB      ALA  63   3.104   0.865   7.588
  493    HB3  ALA  63           2HB      ALA  63   3.491   1.166   5.894
  494    H    GLU  64           H        GLU  64   2.557  -1.122   8.161
  495    HA   GLU  64           HA       GLU  64   4.065  -2.907   6.628
  496    HB2  GLU  64           1HB      GLU  64   4.349  -4.229   8.723
  497    HB3  GLU  64           2HB      GLU  64   4.865  -2.552   8.775
  498    HG2  GLU  64           1HG      GLU  64   2.831  -1.990   9.988
  499    HG3  GLU  64           2HG      GLU  64   2.328  -3.682   9.916
  500    H    THR  65           H        THR  65   0.817  -3.195   7.751
  501    HA   THR  65           HA       THR  65   0.533  -6.009   7.071
  502    HB   THR  65           HB       THR  65  -1.663  -3.910   7.179
  503    HG1  THR  65           1HG      THR  65  -0.570  -3.700   9.150
  504   HG21  THR  65          3HG2      THR  65  -2.276  -6.174   6.398
  505   HG22  THR  65          1HG2      THR  65  -3.032  -5.785   7.940
  506   HG23  THR  65          2HG2      THR  65  -1.629  -6.854   7.893
  507    H    SER  66           H        SER  66  -0.104  -2.988   5.343
  508    HA   SER  66           HA       SER  66  -0.945  -4.356   3.073
  509    HG   SER  66           HG       SER  66  -0.266  -2.619   1.078
  510    HB2  SER  66           1HB      SER  66  -1.447  -1.941   3.566
  511    HB3  SER  66           2HB      SER  66   0.222  -1.565   3.143
  512    H    ILE  67           H        ILE  67   2.230  -3.285   4.165
  513    HA   ILE  67           HA       ILE  67   3.661  -3.881   1.823
  514    HB   ILE  67           HB       ILE  67   4.560  -3.927   4.734
  515   HG12  ILE  67          1HG1      ILE  67   4.959  -1.844   2.571
  516   HG13  ILE  67          2HG1      ILE  67   3.828  -1.728   3.911
  517   HG21  ILE  67          1HG2      ILE  67   6.065  -5.331   3.436
  518   HG22  ILE  67          2HG2      ILE  67   6.874  -3.840   3.915
  519   HG23  ILE  67          3HG2      ILE  67   6.296  -4.034   2.263
  520   HD11  ILE  67          3HD1      ILE  67   5.698  -1.701   5.484
  521   HD12  ILE  67          1HD1      ILE  67   5.806  -0.385   4.306
  522   HD13  ILE  67          2HD1      ILE  67   6.832  -1.818   4.128
  523    H    ASP  68           H        ASP  68   2.805  -5.801   4.635
  524    HA   ASP  68           HA       ASP  68   4.222  -8.082   4.214
  525    HB2  ASP  68           1HB      ASP  68   2.956  -7.675   6.237
  526    HB3  ASP  68           2HB      ASP  68   1.446  -7.773   5.353
  527    H    TYR  69           H        TYR  69   0.812  -7.610   3.103
  528    HA   TYR  69           HA       TYR  69   1.069 -10.108   1.692
  529    HD1  TYR  69           2HD      TYR  69  -1.293 -11.566   2.611
  530    HD2  TYR  69           1HD      TYR  69  -1.618  -9.429  -1.057
  531    HE1  TYR  69           2HE      TYR  69  -2.118 -13.586   1.527
  532    HE2  TYR  69           1HE      TYR  69  -2.430 -11.472  -2.149
  533    HH   TYR  69           HH       TYR  69  -3.454 -14.185  -0.416
  534    HB2  TYR  69           1HB      TYR  69  -1.270  -9.174   2.563
  535    HB3  TYR  69           2HB      TYR  69  -1.222  -8.291   1.041
  536    H    LEU  70           H        LEU  70   1.171  -6.743   0.751
  537    HA   LEU  70           HA       LEU  70   1.145  -7.126  -2.019
  538    HG   LEU  70           HG       LEU  70   1.816  -5.254  -3.295
  539    HB2  LEU  70           1HB      LEU  70   0.984  -4.950  -0.759
  540    HB3  LEU  70           2HB      LEU  70   2.703  -5.067  -0.518
  541   HD11  LEU  70          1HD1      LEU  70   0.313  -3.555  -2.651
  542   HD12  LEU  70          2HD1      LEU  70   1.725  -2.643  -3.251
  543   HD13  LEU  70          3HD1      LEU  70   1.475  -2.892  -1.531
  544   HD21  LEU  70          3HD2      LEU  70   3.969  -3.653  -1.897
  545   HD22  LEU  70          1HD2      LEU  70   3.761  -3.779  -3.642
  546   HD23  LEU  70          2HD2      LEU  70   4.195  -5.209  -2.700
  547    H    ILE  71           H        ILE  71   3.956  -7.122   0.175
  548    HA   ILE  71           HA       ILE  71   5.789  -7.464  -1.934
  549    HB   ILE  71           HB       ILE  71   6.113  -8.238   0.989
  550   HG12  ILE  71          1HG1      ILE  71   5.739  -5.857   0.749
  551   HG13  ILE  71          2HG1      ILE  71   7.419  -6.146   1.175
  552   HG21  ILE  71          1HG2      ILE  71   8.544  -8.223   0.581
  553   HG22  ILE  71          2HG2      ILE  71   8.239  -7.966  -1.135
  554   HG23  ILE  71          3HG2      ILE  71   7.720  -9.462  -0.368
  555   HD11  ILE  71          3HD1      ILE  71   8.039  -5.808  -1.178
  556   HD12  ILE  71          1HD1      ILE  71   7.241  -4.396  -0.469
  557   HD13  ILE  71          2HD1      ILE  71   6.342  -5.462  -1.551
  558    H    LYS  72           H        LYS  72   3.985  -9.818   0.020
  559    HA   LYS  72           HA       LYS  72   5.446 -11.876  -1.352
  560    HB2  LYS  72           1HB      LYS  72   4.245 -13.515   0.023
  561    HB3  LYS  72           2HB      LYS  72   5.036 -12.271   0.969
  562    HG2  LYS  72           1HG      LYS  72   2.786 -11.134   1.086
  563    HG3  LYS  72           2HG      LYS  72   2.109 -12.636   0.447
  564    HD2  LYS  72           1HD      LYS  72   3.163 -13.864   2.329
  565    HD3  LYS  72           2HD      LYS  72   3.735 -12.323   2.970
  566    HE2  LYS  72           1HE      LYS  72   1.402 -11.555   3.132
  567    HE3  LYS  72           2HE      LYS  72   0.860 -13.140   2.579
  568    HZ1  LYS  72           3HZ      LYS  72   1.998 -14.081   4.548
  569    HZ2  LYS  72           1HZ      LYS  72   0.733 -13.036   4.932
  570    HZ3  LYS  72           2HZ      LYS  72   2.304 -12.495   5.081
  571    H    ASN  73           H        ASN  73   2.552 -10.245  -2.121
  572    HA   ASN  73           HA       ASN  73   1.822 -12.490  -3.917
  573    HB2  ASN  73           1HB      ASN  73  -0.062 -11.812  -2.495
  574    HB3  ASN  73           2HB      ASN  73   0.072 -10.157  -3.074
  575   HD21  ASN  73          1HD2      ASN  73  -2.220 -10.162  -3.955
  576   HD22  ASN  73          2HD2      ASN  73  -2.492 -11.046  -5.371
  577    H    GLU  74           H        GLU  74   1.933  -8.890  -4.002
  578    HA   GLU  74           HA       GLU  74   2.708  -9.115  -6.763
  579    HB2  GLU  74           1HB      GLU  74   0.200  -7.640  -5.942
  580    HB3  GLU  74           2HB      GLU  74   0.990  -7.424  -7.501
  581    HG2  GLU  74           1HG      GLU  74   0.696  -9.818  -7.966
  582    HG3  GLU  74           2HG      GLU  74  -0.125 -10.002  -6.427
  583    H    LEU  75           H        LEU  75   4.574  -8.453  -6.036
  584    HA   LEU  75           HA       LEU  75   5.185  -6.063  -4.719
  585    HG   LEU  75           HG       LEU  75   6.266  -9.001  -6.729
  586    HB2  LEU  75           1HB      LEU  75   7.524  -6.483  -5.617
  587    HB3  LEU  75           2HB      LEU  75   6.813  -7.715  -4.603
  588   HD11  LEU  75          1HD1      LEU  75   6.418  -7.190  -8.331
  589   HD12  LEU  75          2HD1      LEU  75   7.528  -8.507  -8.723
  590   HD13  LEU  75          3HD1      LEU  75   8.140  -7.032  -7.977
  591   HD21  LEU  75          3HD2      LEU  75   9.150  -8.440  -6.132
  592   HD22  LEU  75          1HD2      LEU  75   8.533  -9.849  -6.995
  593   HD23  LEU  75          2HD2      LEU  75   8.119  -9.602  -5.296
  594    H    GLU  76           H        GLU  76   4.095  -6.421  -7.843
  595    HA   GLU  76           HA       GLU  76   5.420  -4.502  -9.356
  596    HB2  GLU  76           1HB      GLU  76   2.522  -5.303  -9.386
  597    HB3  GLU  76           2HB      GLU  76   3.278  -4.303 -10.617
  598    HG2  GLU  76           1HG      GLU  76   4.057  -7.106  -9.909
  599    HG3  GLU  76           2HG      GLU  76   3.100  -6.630 -11.315
  600    H    ILE  77           H        ILE  77   2.802  -4.156  -7.070
  601    HA   ILE  77           HA       ILE  77   2.229  -1.459  -7.645
  602    HB   ILE  77           HB       ILE  77   1.717  -3.032  -5.118
  603   HG12  ILE  77          1HG1      ILE  77   0.732  -4.048  -7.095
  604   HG13  ILE  77          2HG1      ILE  77  -0.528  -3.429  -6.013
  605   HG21  ILE  77          1HG2      ILE  77   0.437  -0.454  -6.078
  606   HG22  ILE  77          2HG2      ILE  77   1.516  -0.626  -4.692
  607   HG23  ILE  77          3HG2      ILE  77  -0.077  -1.379  -4.667
  608   HD11  ILE  77          3HD1      ILE  77  -0.759  -1.466  -7.500
  609   HD12  ILE  77          1HD1      ILE  77  -1.092  -2.989  -8.324
  610   HD13  ILE  77          2HD1      ILE  77   0.447  -2.170  -8.578
  611    H    TRP  78           H        TRP  78   4.540  -2.998  -5.481
  612    HA   TRP  78           HA       TRP  78   5.293  -0.700  -4.014
  613    HD1  TRP  78           HD       TRP  78   9.222  -1.488  -4.758
  614    HE1  TRP  78           1HE      TRP  78  10.620  -0.620  -2.793
  615    HE3  TRP  78           3HE      TRP  78   5.885  -2.278  -0.969
  616    HZ2  TRP  78           2HZ      TRP  78  10.349  -0.307   0.001
  617    HZ3  TRP  78           3HZ      TRP  78   6.549  -1.675   1.317
  618    HH2  TRP  78           HH       TRP  78   8.729  -0.714   1.789
  619    HB2  TRP  78           1HB      TRP  78   5.956  -3.002  -3.339
  620    HB3  TRP  78           2HB      TRP  78   6.985  -3.113  -4.761
  621    H    LYS  79           H        LYS  79   6.414  -2.144  -7.005
  622    HA   LYS  79           HA       LYS  79   8.556  -0.419  -7.609
  623    HB2  LYS  79           1HB      LYS  79   6.649  -1.801  -9.501
  624    HB3  LYS  79           2HB      LYS  79   8.149  -1.041  -9.986
  625    HG2  LYS  79           1HG      LYS  79   9.422  -2.661  -8.721
  626    HG3  LYS  79           2HG      LYS  79   7.930  -3.377  -8.101
  627    HD2  LYS  79           1HD      LYS  79   7.266  -4.000 -10.368
  628    HD3  LYS  79           2HD      LYS  79   8.715  -3.237 -11.015
  629    HE2  LYS  79           1HE      LYS  79  10.123  -4.815  -9.922
  630    HE3  LYS  79           2HE      LYS  79   8.762  -5.487  -9.028
  631    HZ1  LYS  79           3HZ      LYS  79   7.831  -6.295 -11.092
  632    HZ2  LYS  79           1HZ      LYS  79   9.405  -6.881 -10.904
  633    HZ3  LYS  79           2HZ      LYS  79   9.094  -5.625 -11.986
  634    H    GLU  80           H        GLU  80   5.187  -0.292  -8.574
  635    HA   GLU  80           HA       GLU  80   5.388   2.091 -10.048
  636    HB2  GLU  80           1HB      GLU  80   3.012   0.622  -8.949
  637    HB3  GLU  80           2HB      GLU  80   2.912   1.977 -10.072
  638    HG2  GLU  80           1HG      GLU  80   4.130   0.757 -11.751
  639    HG3  GLU  80           2HG      GLU  80   4.434  -0.562 -10.624
  640    H    LEU  81           H        LEU  81   4.243   1.520  -6.711
  641    HA   LEU  81           HA       LEU  81   3.508   4.199  -6.264
  642    HG   LEU  81           HG       LEU  81   2.396   1.396  -5.200
  643    HB2  LEU  81           1HB      LEU  81   4.504   2.195  -4.218
  644    HB3  LEU  81           2HB      LEU  81   3.759   3.727  -3.867
  645   HD11  LEU  81          1HD1      LEU  81   2.827   1.029  -2.849
  646   HD12  LEU  81          2HD1      LEU  81   1.105   1.291  -3.142
  647   HD13  LEU  81          3HD1      LEU  81   2.094   2.586  -2.458
  648   HD21  LEU  81          3HD2      LEU  81   1.496   3.512  -6.032
  649   HD22  LEU  81          1HD2      LEU  81   1.310   4.097  -4.377
  650   HD23  LEU  81          2HD2      LEU  81   0.345   2.739  -4.948
  651    H    THR  82           H        THR  82   6.567   2.504  -5.812
  652    HA   THR  82           HA       THR  82   7.963   4.722  -4.759
  653    HB   THR  82           HB       THR  82   9.075   2.409  -6.386
  654    HG1  THR  82           1HG      THR  82   8.148   1.534  -4.626
  655   HG21  THR  82          3HG2      THR  82  10.627   4.318  -6.186
  656   HG22  THR  82          1HG2      THR  82  11.196   2.915  -5.271
  657   HG23  THR  82          2HG2      THR  82  10.437   4.274  -4.429
  658    H    ALA  83           H        ALA  83   7.325   3.665  -8.064
  659    HA   ALA  83           HA       ALA  83   8.967   5.512  -9.373
  660    HB1  ALA  83           3HB      ALA  83   7.979   3.555 -10.475
  661    HB2  ALA  83           1HB      ALA  83   6.386   4.308 -10.359
  662    HB3  ALA  83           2HB      ALA  83   7.639   5.048 -11.355
  663    H    HIS  84           H        HIS  84   5.912   5.921  -7.835
  664    HA   HIS  84           HA       HIS  84   5.631   8.544  -9.070
  665    HD1  HIS  84           1HD      HIS  84   2.536   9.316  -9.929
  666    HD2  HIS  84           2HD      HIS  84   3.646   5.326  -9.775
  667    HE1  HIS  84           1HE      HIS  84   1.725   8.305 -12.088
  668    HE2  HIS  84           2HE      HIS  84   2.724   5.995 -12.074
  669    HB2  HIS  84           1HB      HIS  84   3.722   6.943  -7.411
  670    HB3  HIS  84           2HB      HIS  84   3.458   8.660  -7.702
  671    H    PHE  85           H        PHE  85   6.052   7.255  -5.810
  672    HA   PHE  85           HA       PHE  85   6.062   9.921  -4.749
  673    HD1  PHE  85           2HD      PHE  85   4.370   6.624  -4.502
  674    HD2  PHE  85           1HD      PHE  85   4.841   9.742  -1.655
  675    HE1  PHE  85           2HE      PHE  85   1.974   6.502  -3.987
  676    HE2  PHE  85           1HE      PHE  85   2.438   9.624  -1.132
  677    HZ   PHE  85           HZ       PHE  85   1.004   8.006  -2.296
  678    HB2  PHE  85           1HB      PHE  85   6.627   7.252  -3.469
  679    HB3  PHE  85           2HB      PHE  85   6.739   8.770  -2.594
  680    H    ASP  86           H        ASP  86   8.593   7.427  -5.080
  681    HA   ASP  86           HA       ASP  86  10.574   9.584  -5.138
  682    HB2  ASP  86           1HB      ASP  86  10.680   7.165  -3.337
  683    HB3  ASP  86           2HB      ASP  86  12.127   8.033  -3.805
  684    HA   PRO  87           HA       PRO  87  11.120   6.332  -8.444
  685    HB2  PRO  87           1HB      PRO  87  11.321   8.002 -10.563
  686    HB3  PRO  87           2HB      PRO  87   9.769   7.438  -9.914
  687    HG2  PRO  87           1HG      PRO  87  11.181  10.031  -9.410
  688    HG3  PRO  87           2HG      PRO  87   9.475   9.758  -9.820
  689    HD2  PRO  87           1HD      PRO  87  10.265  10.183  -7.285
  690    HD3  PRO  87           2HD      PRO  87   8.944   9.072  -7.674
  691    H    ASP  88           H        ASP  88  12.836   8.973  -7.254
  692    HA   ASP  88           HA       ASP  88  15.232   8.478  -8.810
  693    HB2  ASP  88           1HB      ASP  88  16.199  10.351  -7.689
  694    HB3  ASP  88           2HB      ASP  88  14.531  10.799  -8.013
  695    H    GLY  89           H        GLY  89  13.690   7.102  -6.247
  696    HA2  GLY  89           1HA      GLY  89  15.906   6.469  -4.563
  697    HA3  GLY  89           2HA      GLY  89  14.306   5.736  -4.517
  698    H    LYS  90           H        LYS  90  16.469   4.174  -4.155
  699    HA   LYS  90           HA       LYS  90  17.386   3.031  -6.622
  700    HB2  LYS  90           1HB      LYS  90  17.782   2.070  -3.791
  701    HB3  LYS  90           2HB      LYS  90  18.618   1.457  -5.207
  702    HG2  LYS  90           1HG      LYS  90  18.801   4.271  -4.133
  703    HG3  LYS  90           2HG      LYS  90  20.021   3.011  -3.946
  704    HD2  LYS  90           1HD      LYS  90  20.304   2.948  -6.387
  705    HD3  LYS  90           2HD      LYS  90  19.064   4.186  -6.546
  706    HE2  LYS  90           1HE      LYS  90  21.654   4.567  -5.050
  707    HE3  LYS  90           2HE      LYS  90  21.368   5.083  -6.708
  708    HZ1  LYS  90           3HZ      LYS  90  19.907   6.074  -4.299
  709    HZ2  LYS  90           1HZ      LYS  90  19.606   6.546  -5.881
  710    HZ3  LYS  90           2HZ      LYS  90  21.067   6.901  -5.166
  711    H    TRP  91           H        TRP  91  14.552   2.597  -4.917
  712    HA   TRP  91           HA       TRP  91  12.842   1.101  -4.932
  713    HD1  TRP  91           HD       TRP  91  10.524   0.136  -6.847
  714    HE1  TRP  91           1HE      TRP  91   9.471   1.840  -8.470
  715    HE3  TRP  91           3HE      TRP  91  14.796   2.245  -8.694
  716    HZ2  TRP  91           2HZ      TRP  91  10.331   3.802 -10.284
  717    HZ3  TRP  91           3HZ      TRP  91  14.588   4.022 -10.382
  718    HH2  TRP  91           HH       TRP  91  12.404   4.783 -11.158
  719    HB2  TRP  91           1HB      TRP  91  14.298   0.124  -7.369
  720    HB3  TRP  91           2HB      TRP  91  13.011  -0.862  -6.702
  721    H    ARG  92           H        ARG  92  15.724  -0.794  -5.537
  722    HA   ARG  92           HA       ARG  92  14.996  -3.145  -4.213
  723    HE   ARG  92           HE       ARG  92  14.313  -3.959  -6.521
  724    HB2  ARG  92           1HB      ARG  92  17.698  -1.947  -4.737
  725    HB3  ARG  92           2HB      ARG  92  17.459  -3.564  -4.108
  726    HG2  ARG  92           1HG      ARG  92  16.345  -2.624  -6.738
  727    HG3  ARG  92           2HG      ARG  92  17.918  -3.398  -6.558
  728    HD2  ARG  92           1HD      ARG  92  16.475  -5.140  -7.172
  729    HD3  ARG  92           2HD      ARG  92  16.681  -5.310  -5.438
  730   HH11  ARG  92          1HH1      ARG  92  15.661  -6.376  -4.338
  731   HH12  ARG  92          2HH1      ARG  92  14.244  -7.293  -4.184
  732   HH21  ARG  92          1HH2      ARG  92  12.302  -5.136  -6.263
  733   HH22  ARG  92          2HH2      ARG  92  12.241  -6.571  -5.328
  734    H    LYS  93           H        LYS  93  17.016  -0.486  -3.056
  735    HA   LYS  93           HA       LYS  93  17.778  -1.372  -0.569
  736    HB2  LYS  93           1HB      LYS  93  18.597   0.704  -1.560
  737    HB3  LYS  93           2HB      LYS  93  17.013   1.434  -1.365
  738    HG2  LYS  93           1HG      LYS  93  17.268   1.153   1.103
  739    HG3  LYS  93           2HG      LYS  93  18.927   0.630   0.816
  740    HD2  LYS  93           1HD      LYS  93  19.404   2.781  -0.280
  741    HD3  LYS  93           2HD      LYS  93  17.745   3.294   0.031
  742    HE2  LYS  93           1HE      LYS  93  18.142   3.038   2.446
  743    HE3  LYS  93           2HE      LYS  93  19.813   2.595   2.113
  744    HZ1  LYS  93           3HZ      LYS  93  19.604   4.919   2.717
  745    HZ2  LYS  93           1HZ      LYS  93  18.543   5.190   1.451
  746    HZ3  LYS  93           2HZ      LYS  93  20.149   4.794   1.134
  747    H    LYS  94           H        LYS  94  14.946   0.632  -1.240
  748    HA   LYS  94           HA       LYS  94  13.954   0.533   1.404
  749    HB2  LYS  94           1HB      LYS  94  11.962   1.661   0.459
  750    HB3  LYS  94           2HB      LYS  94  13.466   2.415  -0.046
  751    HG2  LYS  94           1HG      LYS  94  13.203   0.902  -2.151
  752    HG3  LYS  94           2HG      LYS  94  11.520   0.812  -1.649
  753    HD2  LYS  94           1HD      LYS  94  13.054   3.353  -2.199
  754    HD3  LYS  94           2HD      LYS  94  11.937   2.574  -3.306
  755    HE2  LYS  94           1HE      LYS  94  11.214   3.659  -0.589
  756    HE3  LYS  94           2HE      LYS  94  10.981   4.500  -2.117
  757    HZ1  LYS  94           3HZ      LYS  94   8.979   3.587  -1.592
  758    HZ2  LYS  94           1HZ      LYS  94   9.553   2.062  -1.160
  759    HZ3  LYS  94           2HZ      LYS  94   9.513   2.588  -2.790
  760    H    TYR  95           H        TYR  95  13.320  -1.402  -1.464
  761    HA   TYR  95           HA       TYR  95  10.969  -2.714  -0.603
  762    HD1  TYR  95           1HD      TYR  95  12.888  -6.055  -1.869
  763    HD2  TYR  95           2HD      TYR  95   9.618  -3.751  -3.309
  764    HE1  TYR  95           1HE      TYR  95  11.649  -8.121  -2.338
  765    HE2  TYR  95           2HE      TYR  95   8.376  -5.810  -3.772
  766    HH   TYR  95           HH       TYR  95   9.298  -8.840  -2.595
  767    HB2  TYR  95           1HB      TYR  95  11.733  -2.710  -2.950
  768    HB3  TYR  95           2HB      TYR  95  13.147  -3.645  -2.498
  769    H    GLU  96           H        GLU  96  14.341  -3.707  -0.617
  770    HA   GLU  96           HA       GLU  96  13.846  -6.158   0.673
  771    HB2  GLU  96           1HB      GLU  96  16.404  -4.675   0.059
  772    HB3  GLU  96           2HB      GLU  96  16.347  -6.316   0.699
  773    HG2  GLU  96           1HG      GLU  96  15.181  -7.103  -1.263
  774    HG3  GLU  96           2HG      GLU  96  15.029  -5.462  -1.874
  775    H    ASP  97           H        ASP  97  14.687  -2.982   1.822
  776    HA   ASP  97           HA       ASP  97  15.483  -3.853   4.431
  777    HB2  ASP  97           1HB      ASP  97  16.187  -1.644   3.630
  778    HB3  ASP  97           2HB      ASP  97  14.507  -1.130   3.574
  779    H    ARG  98           H        ARG  98  12.495  -2.335   3.232
  780    HA   ARG  98           HA       ARG  98  11.264  -2.469   5.760
  781    HE   ARG  98           HE       ARG  98  12.385  -0.475   5.937
  782    HB2  ARG  98           1HB      ARG  98  10.034  -2.102   3.034
  783    HB3  ARG  98           2HB      ARG  98   9.118  -2.035   4.525
  784    HG2  ARG  98           1HG      ARG  98  11.383  -0.167   3.800
  785    HG3  ARG  98           2HG      ARG  98   9.670   0.203   3.634
  786    HD2  ARG  98           1HD      ARG  98  10.341   1.243   5.649
  787    HD3  ARG  98           2HD      ARG  98   9.498  -0.217   6.153
  788   HH11  ARG  98          1HH1      ARG  98   9.713   0.358   8.205
  789   HH12  ARG  98          2HH1      ARG  98  10.669   0.018   9.557
  790   HH21  ARG  98          1HH2      ARG  98  13.598  -0.832   7.779
  791   HH22  ARG  98          2HH2      ARG  98  12.939  -0.640   9.355
  792    H    ALA  99           H        ALA  99  11.079  -4.648   2.956
  793    HA   ALA  99           HA       ALA  99   9.120  -6.326   4.034
  794    HB1  ALA  99           3HB      ALA  99   9.836  -6.396   1.678
  795    HB2  ALA  99           1HB      ALA  99  11.392  -7.055   2.179
  796    HB3  ALA  99           2HB      ALA  99   9.920  -7.992   2.425
  797    H    LYS 100           H        LYS 100  12.672  -6.442   4.312
  798    HA   LYS 100           HA       LYS 100  12.763  -8.831   5.769
  799    HB2  LYS 100           1HB      LYS 100  14.709  -7.753   4.602
  800    HB3  LYS 100           2HB      LYS 100  14.732  -6.536   5.862
  801    HG2  LYS 100           1HG      LYS 100  16.441  -8.165   6.296
  802    HG3  LYS 100           2HG      LYS 100  15.174  -8.294   7.520
  803    HD2  LYS 100           1HD      LYS 100  14.191 -10.167   6.265
  804    HD3  LYS 100           2HD      LYS 100  15.518 -10.075   5.111
  805    HE2  LYS 100           1HE      LYS 100  17.117 -10.535   6.913
  806    HE3  LYS 100           2HE      LYS 100  15.783 -10.629   8.061
  807    HZ1  LYS 100           3HZ      LYS 100  16.140 -12.440   5.729
  808    HZ2  LYS 100           1HZ      LYS 100  14.927 -12.544   6.879
  809    HZ3  LYS 100           2HZ      LYS 100  16.522 -12.829   7.305
  810    H    ALA 101           H        ALA 101  12.557  -5.460   6.753
  811    HA   ALA 101           HA       ALA 101  12.854  -5.882   9.537
  812    HB1  ALA 101           3HB      ALA 101  11.477  -3.594   8.140
  813    HB2  ALA 101           1HB      ALA 101  12.062  -3.604   9.802
  814    HB3  ALA 101           2HB      ALA 101  13.205  -3.698   8.463
  815    H    LYS 102           H        LYS 102   9.971  -5.567   7.480
  816    HA   LYS 102           HA       LYS 102   8.098  -5.748   9.559
  817    HB2  LYS 102           1HB      LYS 102   8.006  -5.987   6.596
  818    HB3  LYS 102           2HB      LYS 102   6.624  -6.534   7.521
  819    HG2  LYS 102           1HG      LYS 102   6.261  -4.242   6.740
  820    HG3  LYS 102           2HG      LYS 102   6.391  -4.374   8.491
  821    HD2  LYS 102           1HD      LYS 102   8.894  -3.679   7.120
  822    HD3  LYS 102           2HD      LYS 102   7.623  -2.465   7.017
  823    HE2  LYS 102           1HE      LYS 102   8.574  -3.693   9.613
  824    HE3  LYS 102           2HE      LYS 102   9.217  -2.198   8.947
  825    HZ1  LYS 102           3HZ      LYS 102   6.422  -2.637   9.974
  826    HZ2  LYS 102           1HZ      LYS 102   6.901  -1.328   8.986
  827    HZ3  LYS 102           2HZ      LYS 102   7.613  -1.565  10.469
  828    H    GLY 103           H        GLY 103   9.891  -8.180   7.905
  829    HA2  GLY 103           1HA      GLY 103  10.101 -10.311   9.064
  830    HA3  GLY 103           2HA      GLY 103   8.405 -10.171   9.502
  831    H    ILE 104           H        ILE 104   9.567  -9.432   6.308
  832    HA   ILE 104           HA       ILE 104   8.030 -11.663   5.274
  833    HB   ILE 104           HB       ILE 104   9.279  -9.249   3.938
  834   HG12  ILE 104          1HG1      ILE 104   7.321  -8.707   5.244
  835   HG13  ILE 104          2HG1      ILE 104   6.944  -8.559   3.531
  836   HG21  ILE 104          1HG2      ILE 104   8.183  -9.909   1.875
  837   HG22  ILE 104          2HG2      ILE 104   7.600 -11.390   2.637
  838   HG23  ILE 104          3HG2      ILE 104   9.334 -11.145   2.395
  839   HD11  ILE 104          3HD1      ILE 104   5.793 -10.701   3.587
  840   HD12  ILE 104          1HD1      ILE 104   5.119  -9.620   4.801
  841   HD13  ILE 104          2HD1      ILE 104   6.207 -10.897   5.290
  842    H    VAL 105           H        VAL 105   8.944 -13.350   4.275
  843    HA   VAL 105           HA       VAL 105  11.795 -13.520   4.576
  844    HB   VAL 105           HB       VAL 105  11.509 -15.969   3.981
  845   HG11  VAL 105          1HG1      VAL 105   9.919 -14.922   6.322
  846   HG12  VAL 105          2HG1      VAL 105  10.516 -16.570   6.147
  847   HG13  VAL 105          3HG1      VAL 105  11.652 -15.231   6.297
  848   HG21  VAL 105          3HG2      VAL 105   9.395 -15.806   2.737
  849   HG22  VAL 105          1HG2      VAL 105   8.561 -15.303   4.207
  850   HG23  VAL 105          2HG2      VAL 105   9.243 -16.928   4.090
  851    H    ILE 106           H        ILE 106  12.812 -12.538   3.072
  852    HA   ILE 106           HA       ILE 106  12.375 -13.402   0.316
  853    HB   ILE 106           HB       ILE 106  13.478 -11.329  -0.489
  854   HG12  ILE 106          1HG1      ILE 106  14.791 -10.812   1.642
  855   HG13  ILE 106          2HG1      ILE 106  14.051  -9.426   0.861
  856   HG21  ILE 106          1HG2      ILE 106  11.102 -11.338  -0.481
  857   HG22  ILE 106          2HG2      ILE 106  11.684  -9.718  -0.093
  858   HG23  ILE 106          3HG2      ILE 106  11.066 -10.760   1.185
  859   HD11  ILE 106          3HD1      ILE 106  13.054 -10.838   3.335
  860   HD12  ILE 106          1HD1      ILE 106  12.258  -9.479   2.537
  861   HD13  ILE 106          2HD1      ILE 106  13.852  -9.269   3.255
  862    HA   PRO 107           HA       PRO 107  16.318 -15.276   0.519
  863    HB2  PRO 107           1HB      PRO 107  17.399 -13.766  -1.792
  864    HB3  PRO 107           2HB      PRO 107  17.194 -15.510  -1.600
  865    HG2  PRO 107           1HG      PRO 107  15.592 -14.107  -3.216
  866    HG3  PRO 107           2HG      PRO 107  14.963 -15.449  -2.243
  867    HD2  PRO 107           1HD      PRO 107  14.755 -12.500  -1.770
  868    HD3  PRO 107           2HD      PRO 107  13.522 -13.757  -1.547
  869    H    GLU 108           H        GLU 108  17.328 -14.551   2.344
  870    HA   GLU 108           HA       GLU 108  19.436 -12.685   2.126
  871    HB2  GLU 108           1HB      GLU 108  17.505 -11.233   2.590
  872    HB3  GLU 108           2HB      GLU 108  17.012 -12.282   3.906
  873    HG2  GLU 108           1HG      GLU 108  18.037 -10.453   4.911
  874    HG3  GLU 108           2HG      GLU 108  19.175 -11.813   4.937
  Start of MODEL    9
    1    HA   TYR   1           HA       TYR   1 -19.532   0.501   1.224
    2    HD1  TYR   1           1HD      TYR   1 -21.431   2.459   0.847
    3    HD2  TYR   1           2HD      TYR   1 -21.687  -0.656  -2.023
    4    HE1  TYR   1           1HE      TYR   1 -21.533   4.136  -0.945
    5    HE2  TYR   1           2HE      TYR   1 -21.794   1.013  -3.836
    6    HH   TYR   1           HH       TYR   1 -22.411   3.376  -4.129
    7    H1   TYR   1           1HT      TYR   1 -19.202  -0.713  -0.806
    8    H2   TYR   1           2HT      TYR   1 -19.534  -2.149   0.025
    9    H3   TYR   1           3HT      TYR   1 -18.224  -1.195   0.503
   10    HB2  TYR   1           1HB      TYR   1 -21.859  -1.180   0.292
   11    HB3  TYR   1           2HB      TYR   1 -22.038   0.108   1.485
   12    H    THR   2           H        THR   2 -19.829  -2.991   1.737
   13    HA   THR   2           HA       THR   2 -18.994  -2.274   4.374
   14    HB   THR   2           HB       THR   2 -21.287  -2.986   4.739
   15    HG1  THR   2           1HG      THR   2 -19.300  -4.838   5.589
   16   HG21  THR   2          3HG2      THR   2 -22.117  -5.239   4.113
   17   HG22  THR   2          1HG2      THR   2 -20.610  -5.538   3.247
   18   HG23  THR   2          2HG2      THR   2 -21.710  -4.272   2.695
   19    H    ASP   3           H        ASP   3 -16.971  -2.650   4.224
   20    HA   ASP   3           HA       ASP   3 -14.996  -3.828   4.288
   21    HB2  ASP   3           1HB      ASP   3 -16.711  -6.298   3.854
   22    HB3  ASP   3           2HB      ASP   3 -15.026  -6.280   4.347
   23    H    LYS   4           H        LYS   4 -16.180  -2.736   1.867
   24    HA   LYS   4           HA       LYS   4 -14.742  -4.262  -0.138
   25    HB2  LYS   4           1HB      LYS   4 -17.723  -3.859  -0.355
   26    HB3  LYS   4           2HB      LYS   4 -16.700  -4.278  -1.718
   27    HG2  LYS   4           1HG      LYS   4 -17.003  -5.930   0.771
   28    HG3  LYS   4           2HG      LYS   4 -17.892  -6.204  -0.729
   29    HD2  LYS   4           1HD      LYS   4 -15.809  -6.640  -1.905
   30    HD3  LYS   4           2HD      LYS   4 -14.881  -6.250  -0.457
   31    HE2  LYS   4           1HE      LYS   4 -15.108  -8.672  -0.800
   32    HE3  LYS   4           2HE      LYS   4 -15.833  -8.127   0.709
   33    HZ1  LYS   4           3HZ      LYS   4 -17.176  -9.735  -0.540
   34    HZ2  LYS   4           1HZ      LYS   4 -17.368  -8.625  -1.779
   35    HZ3  LYS   4           2HZ      LYS   4 -17.999  -8.314  -0.235
   36    H    TYR   5           H        TYR   5 -13.508  -2.650  -0.389
   37    HA   TYR   5           HA       TYR   5 -12.555  -1.015  -1.285
   38    HD1  TYR   5           2HD      TYR   5 -15.835   1.167  -3.158
   39    HD2  TYR   5           1HD      TYR   5 -15.019  -2.926  -3.968
   40    HE1  TYR   5           2HE      TYR   5 -18.134   0.871  -3.963
   41    HE2  TYR   5           1HE      TYR   5 -17.311  -3.227  -4.777
   42    HH   TYR   5           HH       TYR   5 -19.366  -0.606  -5.434
   43    HB2  TYR   5           1HB      TYR   5 -13.588   0.373  -3.222
   44    HB3  TYR   5           2HB      TYR   5 -13.149  -1.255  -3.574
   45    H    ASP   6           H        ASP   6 -15.519  -0.166  -0.082
   46    HA   ASP   6           HA       ASP   6 -15.776   2.511  -0.207
   47    HB2  ASP   6           1HB      ASP   6 -17.015   2.213   2.017
   48    HB3  ASP   6           2HB      ASP   6 -17.566   1.272   0.640
   49    H    LYS   7           H        LYS   7 -14.296   0.787   2.409
   50    HA   LYS   7           HA       LYS   7 -12.675   2.952   3.114
   51    HB2  LYS   7           1HB      LYS   7 -14.559   4.124   3.882
   52    HB3  LYS   7           2HB      LYS   7 -15.295   2.667   4.534
   53    HG2  LYS   7           1HG      LYS   7 -13.463   2.649   6.273
   54    HG3  LYS   7           2HG      LYS   7 -13.011   4.254   5.702
   55    HD2  LYS   7           1HD      LYS   7 -15.081   5.173   6.369
   56    HD3  LYS   7           2HD      LYS   7 -15.804   3.581   6.591
   57    HE2  LYS   7           1HE      LYS   7 -15.264   4.625   8.739
   58    HE3  LYS   7           2HE      LYS   7 -14.333   3.153   8.489
   59    HZ1  LYS   7           3HZ      LYS   7 -12.413   4.509   7.910
   60    HZ2  LYS   7           1HZ      LYS   7 -13.015   4.973   9.407
   61    HZ3  LYS   7           2HZ      LYS   7 -13.359   5.915   8.061
   62    H    ILE   8           H        ILE   8 -14.630   0.421   4.646
   63    HA   ILE   8           HA       ILE   8 -12.632  -0.004   6.658
   64    HB   ILE   8           HB       ILE   8 -14.251  -1.700   7.577
   65   HG12  ILE   8          1HG1      ILE   8 -16.051  -0.579   5.412
   66   HG13  ILE   8          2HG1      ILE   8 -15.412  -2.214   5.458
   67   HG21  ILE   8          1HG2      ILE   8 -14.140   0.566   8.430
   68   HG22  ILE   8          2HG2      ILE   8 -15.816   0.017   8.396
   69   HG23  ILE   8          3HG2      ILE   8 -15.226   1.122   7.155
   70   HD11  ILE   8          3HD1      ILE   8 -16.685  -2.619   7.524
   71   HD12  ILE   8          1HD1      ILE   8 -17.724  -2.158   6.175
   72   HD13  ILE   8          2HD1      ILE   8 -17.327  -0.979   7.424
   73    H    ASN   9           H        ASN   9 -11.612  -0.637   4.282
   74    HA   ASN   9           HA       ASN   9 -10.689  -3.220   4.975
   75    HB2  ASN   9           1HB      ASN   9 -10.808  -4.229   2.772
   76    HB3  ASN   9           2HB      ASN   9 -12.427  -3.889   3.366
   77   HD21  ASN   9          1HD2      ASN   9 -10.523  -1.315   1.851
   78   HD22  ASN   9          2HD2      ASN   9 -11.322  -1.558   0.342
   79    H    LEU  10           H        LEU  10  -8.543  -3.464   4.584
   80    HA   LEU  10           HA       LEU  10  -7.240  -1.665   2.714
   81    HG   LEU  10           HG       LEU  10  -5.771  -0.010   5.825
   82    HB2  LEU  10           1HB      LEU  10  -6.084  -2.481   5.432
   83    HB3  LEU  10           2HB      LEU  10  -5.254  -1.613   4.185
   84   HD11  LEU  10          1HD1      LEU  10  -7.731   0.350   3.644
   85   HD12  LEU  10          2HD1      LEU  10  -6.014   0.757   3.615
   86   HD13  LEU  10          3HD1      LEU  10  -7.104   1.595   4.723
   87   HD21  LEU  10          3HD2      LEU  10  -7.505  -1.170   7.078
   88   HD22  LEU  10          1HD2      LEU  10  -8.642  -0.927   5.740
   89   HD23  LEU  10          2HD2      LEU  10  -8.025   0.467   6.652
   90    H    GLN  11           H        GLN  11  -6.686  -4.376   4.828
   91    HA   GLN  11           HA       GLN  11  -4.815  -5.637   3.151
   92    HB2  GLN  11           1HB      GLN  11  -4.750  -5.816   5.575
   93    HB3  GLN  11           2HB      GLN  11  -6.303  -6.631   5.569
   94    HG2  GLN  11           1HG      GLN  11  -4.462  -8.188   5.878
   95    HG3  GLN  11           2HG      GLN  11  -5.352  -8.516   4.390
   96   HE21  GLN  11          1HE2      GLN  11  -3.069  -5.924   4.775
   97   HE22  GLN  11          2HE2      GLN  11  -1.838  -6.531   3.770
   98    H    GLU  12           H        GLU  12  -8.351  -5.871   3.378
   99    HA   GLU  12           HA       GLU  12  -8.132  -8.499   2.283
  100    HB2  GLU  12           1HB      GLU  12 -10.771  -8.397   2.340
  101    HB3  GLU  12           2HB      GLU  12  -9.845  -8.693   3.791
  102    HG2  GLU  12           1HG      GLU  12 -10.998  -6.044   2.980
  103    HG3  GLU  12           2HG      GLU  12 -11.755  -7.172   4.084
  104    H    ILE  13           H        ILE  13  -8.162  -5.541   1.184
  105    HA   ILE  13           HA       ILE  13  -9.140  -6.126  -1.459
  106    HB   ILE  13           HB       ILE  13  -7.569  -3.852  -0.262
  107   HG12  ILE  13          1HG1      ILE  13  -9.875  -3.716   0.336
  108   HG13  ILE  13          2HG1      ILE  13  -9.550  -2.556  -0.956
  109   HG21  ILE  13          1HG2      ILE  13  -7.682  -2.699  -2.360
  110   HG22  ILE  13          2HG2      ILE  13  -8.514  -4.077  -3.068
  111   HG23  ILE  13          3HG2      ILE  13  -6.823  -4.243  -2.534
  112   HD11  ILE  13          3HD1      ILE  13 -11.623  -3.549  -1.437
  113   HD12  ILE  13          1HD1      ILE  13 -10.934  -5.174  -1.216
  114   HD13  ILE  13          2HD1      ILE  13 -10.389  -4.170  -2.555
  115    H    LEU  14           H        LEU  14  -6.060  -5.441   0.104
  116    HA   LEU  14           HA       LEU  14  -4.330  -5.871  -1.971
  117    HG   LEU  14           HG       LEU  14  -2.004  -7.154  -0.361
  118    HB2  LEU  14           1HB      LEU  14  -3.816  -4.808   0.147
  119    HB3  LEU  14           2HB      LEU  14  -3.925  -6.358   0.950
  120   HD11  LEU  14          1HD1      LEU  14  -2.304  -5.713  -2.320
  121   HD12  LEU  14          2HD1      LEU  14  -0.690  -5.573  -1.647
  122   HD13  LEU  14          3HD1      LEU  14  -1.882  -4.306  -1.340
  123   HD21  LEU  14          3HD2      LEU  14  -1.691  -6.218   1.858
  124   HD22  LEU  14          1HD2      LEU  14  -1.593  -4.600   1.182
  125   HD23  LEU  14          2HD2      LEU  14  -0.346  -5.790   0.830
  126    H    GLU  15           H        GLU  15  -5.747  -8.190   0.199
  127    HA   GLU  15           HA       GLU  15  -4.015 -10.299  -0.501
  128    HB2  GLU  15           1HB      GLU  15  -5.210 -10.133   1.650
  129    HB3  GLU  15           2HB      GLU  15  -6.728 -10.436   0.817
  130    HG2  GLU  15           1HG      GLU  15  -5.971 -12.654   0.211
  131    HG3  GLU  15           2HG      GLU  15  -4.395 -12.336   0.929
  132    H    ASN  16           H        ASN  16  -6.766  -8.986  -2.123
  133    HA   ASN  16           HA       ASN  16  -6.942 -11.446  -3.736
  134    HB2  ASN  16           1HB      ASN  16  -9.280  -9.675  -2.980
  135    HB3  ASN  16           2HB      ASN  16  -9.363 -11.107  -3.986
  136   HD21  ASN  16          1HD2      ASN  16  -9.251  -9.838  -0.800
  137   HD22  ASN  16          2HD2      ASN  16  -9.423 -11.336   0.028
  138    H    LYS  17           H        LYS  17  -6.384 -10.974  -5.811
  139    HA   LYS  17           HA       LYS  17  -5.881  -8.389  -6.644
  140    HB2  LYS  17           1HB      LYS  17  -5.597  -9.176  -8.965
  141    HB3  LYS  17           2HB      LYS  17  -4.738 -10.165  -7.815
  142    HG2  LYS  17           1HG      LYS  17  -7.410 -10.944  -8.948
  143    HG3  LYS  17           2HG      LYS  17  -5.898 -11.326  -9.762
  144    HD2  LYS  17           1HD      LYS  17  -5.174 -12.573  -7.745
  145    HD3  LYS  17           2HD      LYS  17  -6.730 -12.210  -7.003
  146    HE2  LYS  17           1HE      LYS  17  -7.882 -13.455  -8.744
  147    HE3  LYS  17           2HE      LYS  17  -6.354 -13.753  -9.570
  148    HZ1  LYS  17           3HZ      LYS  17  -7.098 -14.791  -6.870
  149    HZ2  LYS  17           1HZ      LYS  17  -5.627 -15.056  -7.633
  150    HZ3  LYS  17           2HZ      LYS  17  -7.028 -15.674  -8.290
  151    H    ARG  18           H        ARG  18  -8.906 -10.147  -7.164
  152    HA   ARG  18           HA       ARG  18  -9.986  -8.178  -8.909
  153    HE   ARG  18           HE       ARG  18 -12.403 -12.179  -5.062
  154    HB2  ARG  18           1HB      ARG  18 -12.202  -9.150  -8.449
  155    HB3  ARG  18           2HB      ARG  18 -11.021 -10.418  -8.728
  156    HG2  ARG  18           1HG      ARG  18 -10.876 -10.792  -6.295
  157    HG3  ARG  18           2HG      ARG  18 -12.058  -9.519  -6.051
  158    HD2  ARG  18           1HD      ARG  18 -13.734 -10.768  -7.253
  159    HD3  ARG  18           2HD      ARG  18 -12.560 -12.029  -7.638
  160   HH11  ARG  18          1HH1      ARG  18 -15.436 -11.556  -6.834
  161   HH12  ARG  18          2HH1      ARG  18 -16.391 -12.357  -5.681
  162   HH21  ARG  18          1HH2      ARG  18 -13.753 -13.312  -3.548
  163   HH22  ARG  18          2HH2      ARG  18 -15.427 -13.394  -3.798
  164    H    LEU  19           H        LEU  19  -9.888  -8.464  -5.436
  165    HA   LEU  19           HA       LEU  19 -11.639  -6.250  -5.049
  166    HG   LEU  19           HG       LEU  19 -11.680  -9.192  -3.802
  167    HB2  LEU  19           1HB      LEU  19  -9.877  -7.704  -3.077
  168    HB3  LEU  19           2HB      LEU  19 -11.045  -6.465  -2.670
  169   HD11  LEU  19          1HD1      LEU  19 -11.076  -9.246  -1.458
  170   HD12  LEU  19          2HD1      LEU  19 -12.799  -9.555  -1.668
  171   HD13  LEU  19          3HD1      LEU  19 -12.248  -7.975  -1.112
  172   HD21  LEU  19          3HD2      LEU  19 -13.245  -7.569  -4.709
  173   HD22  LEU  19          1HD2      LEU  19 -13.538  -6.916  -3.092
  174   HD23  LEU  19          2HD2      LEU  19 -14.039  -8.556  -3.486
  175    H    LEU  20           H        LEU  20  -8.314  -6.770  -5.539
  176    HA   LEU  20           HA       LEU  20  -7.278  -4.380  -4.456
  177    HG   LEU  20           HG       LEU  20  -4.945  -3.901  -6.372
  178    HB2  LEU  20           1HB      LEU  20  -6.003  -6.448  -5.149
  179    HB3  LEU  20           2HB      LEU  20  -6.241  -5.937  -6.807
  180   HD11  LEU  20          1HD1      LEU  20  -4.570  -5.154  -3.682
  181   HD12  LEU  20          2HD1      LEU  20  -5.493  -3.681  -3.975
  182   HD13  LEU  20          3HD1      LEU  20  -3.735  -3.702  -4.228
  183   HD21  LEU  20          3HD2      LEU  20  -2.786  -5.011  -6.064
  184   HD22  LEU  20          1HD2      LEU  20  -3.833  -5.897  -7.184
  185   HD23  LEU  20          2HD2      LEU  20  -3.640  -6.455  -5.518
  186    H    GLU  21           H        GLU  21  -8.354  -5.359  -7.598
  187    HA   GLU  21           HA       GLU  21  -8.113  -2.996  -9.017
  188    HB2  GLU  21           1HB      GLU  21 -10.192  -5.168  -9.166
  189    HB3  GLU  21           2HB      GLU  21  -9.928  -3.964 -10.409
  190    HG2  GLU  21           1HG      GLU  21  -7.837  -5.918  -9.486
  191    HG3  GLU  21           2HG      GLU  21  -8.901  -6.210 -10.855
  192    H    SER  22           H        SER  22 -10.548  -4.082  -6.705
  193    HA   SER  22           HA       SER  22 -12.469  -2.118  -7.257
  194    HG   SER  22           HG       SER  22 -12.757  -4.386  -7.165
  195    HB2  SER  22           1HB      SER  22 -12.041  -3.639  -4.691
  196    HB3  SER  22           2HB      SER  22 -13.515  -2.805  -5.201
  197    H    TYR  23           H        TYR  23 -10.142  -2.114  -4.376
  198    HA   TYR  23           HA       TYR  23 -10.926   0.671  -4.264
  199    HD1  TYR  23           1HD      TYR  23  -7.481  -0.625  -3.167
  200    HD2  TYR  23           2HD      TYR  23  -9.885   0.037   0.250
  201    HE1  TYR  23           1HE      TYR  23  -5.507  -0.932  -1.698
  202    HE2  TYR  23           2HE      TYR  23  -7.984  -0.241   1.688
  203    HH   TYR  23           HH       TYR  23  -4.874  -0.168   0.686
  204    HB2  TYR  23           1HB      TYR  23 -10.389   0.977  -2.076
  205    HB3  TYR  23           2HB      TYR  23 -10.911  -0.638  -1.916
  206    H    MET  24           H        MET  24  -8.926  -0.668  -6.024
  207    HA   MET  24           HA       MET  24  -6.592   0.783  -5.926
  208    HB2  MET  24           1HB      MET  24  -7.250  -1.075  -7.564
  209    HB3  MET  24           2HB      MET  24  -8.037   0.180  -8.510
  210    HG2  MET  24           1HG      MET  24  -5.800  -0.364  -9.354
  211    HG3  MET  24           2HG      MET  24  -5.916   1.314  -8.820
  212    HE1  MET  24           3HE      MET  24  -2.194   0.141  -8.034
  213    HE2  MET  24           1HE      MET  24  -3.204  -0.449  -9.354
  214    HE3  MET  24           2HE      MET  24  -3.180   1.268  -8.967
  215    H    ASP  25           H        ASP  25  -9.770   1.874  -6.500
  216    HA   ASP  25           HA       ASP  25  -9.400   4.390  -7.720
  217    HB2  ASP  25           1HB      ASP  25 -11.599   3.688  -7.331
  218    HB3  ASP  25           2HB      ASP  25 -11.316   3.526  -5.601
  219    H    CYS  26           H        CYS  26  -9.306   3.598  -4.266
  220    HA   CYS  26           HA       CYS  26  -8.592   6.273  -3.823
  221    HB2  CYS  26           1HB      CYS  26  -8.221   5.269  -1.378
  222    HB3  CYS  26           2HB      CYS  26  -9.809   5.671  -2.020
  223    H    VAL  27           H        VAL  27  -6.803   3.372  -4.287
  224    HA   VAL  27           HA       VAL  27  -4.386   4.661  -3.402
  225    HB   VAL  27           HB       VAL  27  -4.700   2.148  -5.073
  226   HG11  VAL  27          1HG1      VAL  27  -2.287   3.195  -3.588
  227   HG12  VAL  27          2HG1      VAL  27  -2.395   1.636  -4.406
  228   HG13  VAL  27          3HG1      VAL  27  -2.479   3.132  -5.338
  229   HG21  VAL  27          3HG2      VAL  27  -4.271   0.956  -2.970
  230   HG22  VAL  27          1HG2      VAL  27  -5.739   1.929  -2.884
  231   HG23  VAL  27          2HG2      VAL  27  -4.261   2.496  -2.109
  232    H    LEU  28           H        LEU  28  -5.555   3.728  -6.738
  233    HA   LEU  28           HA       LEU  28  -3.614   5.663  -7.797
  234    HG   LEU  28           HG       LEU  28  -4.045   5.255 -10.711
  235    HB2  LEU  28           1HB      LEU  28  -3.454   3.291  -8.507
  236    HB3  LEU  28           2HB      LEU  28  -5.027   3.447  -9.260
  237   HD11  LEU  28          1HD1      LEU  28  -1.460   4.231  -9.540
  238   HD12  LEU  28          2HD1      LEU  28  -2.134   5.845  -9.333
  239   HD13  LEU  28          3HD1      LEU  28  -1.600   5.310 -10.930
  240   HD21  LEU  28          3HD2      LEU  28  -2.801   2.518 -10.894
  241   HD22  LEU  28          1HD2      LEU  28  -2.946   3.687 -12.210
  242   HD23  LEU  28          2HD2      LEU  28  -4.399   2.972 -11.504
  243    H    GLY  29           H        GLY  29  -6.993   4.792  -7.832
  244    HA2  GLY  29           1HA      GLY  29  -8.604   6.678  -8.097
  245    HA3  GLY  29           2HA      GLY  29  -7.598   7.222  -9.425
  246    H    LYS  30           H        LYS  30  -8.434   3.832  -8.980
  247    HA   LYS  30           HA       LYS  30  -9.610   3.893 -11.610
  248    HB2  LYS  30           1HB      LYS  30  -8.963   1.545  -9.860
  249    HB3  LYS  30           2HB      LYS  30  -9.591   1.437 -11.501
  250    HG2  LYS  30           1HG      LYS  30  -7.576   2.749 -12.237
  251    HG3  LYS  30           2HG      LYS  30  -6.947   2.527 -10.599
  252    HD2  LYS  30           1HD      LYS  30  -6.000   0.823 -12.034
  253    HD3  LYS  30           2HD      LYS  30  -7.140   0.072 -10.919
  254    HE2  LYS  30           1HE      LYS  30  -7.386  -0.860 -13.143
  255    HE3  LYS  30           2HE      LYS  30  -8.843   0.005 -12.698
  256    HZ1  LYS  30           3HZ      LYS  30  -8.154   0.464 -14.989
  257    HZ2  LYS  30           1HZ      LYS  30  -6.680   1.040 -14.453
  258    HZ3  LYS  30           2HZ      LYS  30  -8.077   1.887 -14.096
  259    H    GLY  31           H        GLY  31 -10.791   2.173  -8.672
  260    HA2  GLY  31           1HA      GLY  31 -13.456   1.978  -9.843
  261    HA3  GLY  31           2HA      GLY  31 -12.944   1.302  -8.305
  262    H    LYS  32           H        LYS  32 -14.012   2.165  -6.574
  263    HA   LYS  32           HA       LYS  32 -14.022   4.959  -6.210
  264    HB2  LYS  32           1HB      LYS  32 -16.454   5.306  -5.961
  265    HB3  LYS  32           2HB      LYS  32 -15.948   5.003  -7.610
  266    HG2  LYS  32           1HG      LYS  32 -16.771   2.722  -7.480
  267    HG3  LYS  32           2HG      LYS  32 -17.213   2.962  -5.789
  268    HD2  LYS  32           1HD      LYS  32 -18.267   4.580  -8.069
  269    HD3  LYS  32           2HD      LYS  32 -19.106   3.165  -7.407
  270    HE2  LYS  32           1HE      LYS  32 -19.264   4.303  -5.233
  271    HE3  LYS  32           2HE      LYS  32 -18.400   5.696  -5.885
  272    HZ1  LYS  32           3HZ      LYS  32 -21.048   4.728  -6.828
  273    HZ2  LYS  32           1HZ      LYS  32 -20.207   6.051  -7.421
  274    HZ3  LYS  32           2HZ      LYS  32 -20.793   6.075  -5.859
  275    H    CYS  33           H        CYS  33 -13.106   4.790  -4.348
  276    HA   CYS  33           HA       CYS  33 -14.413   3.401  -2.095
  277    HB2  CYS  33           1HB      CYS  33 -11.969   5.183  -1.848
  278    HB3  CYS  33           2HB      CYS  33 -12.422   3.776  -0.881
  279    H    THR  34           H        THR  34 -14.507   5.025   0.030
  280    HA   THR  34           HA       THR  34 -15.940   7.350  -0.857
  281    HB   THR  34           HB       THR  34 -16.376   7.625   1.607
  282    HG1  THR  34           1HG      THR  34 -15.696   5.991   2.984
  283   HG21  THR  34          3HG2      THR  34 -17.774   5.623   1.868
  284   HG22  THR  34          1HG2      THR  34 -16.919   4.850   0.532
  285   HG23  THR  34          2HG2      THR  34 -17.904   6.282   0.237
  286    HA   PRO  35           HA       PRO  35 -12.775  10.497  -0.376
  287    HB2  PRO  35           1HB      PRO  35 -13.921  12.110   1.626
  288    HB3  PRO  35           2HB      PRO  35 -14.113  12.315  -0.112
  289    HG2  PRO  35           1HG      PRO  35 -15.911  11.006   1.848
  290    HG3  PRO  35           2HG      PRO  35 -16.312  11.919   0.390
  291    HD2  PRO  35           1HD      PRO  35 -16.531   9.262   0.451
  292    HD3  PRO  35           2HD      PRO  35 -15.947  10.094  -1.002
  293    H    GLU  36           H        GLU  36 -14.095   9.449   2.776
  294    HA   GLU  36           HA       GLU  36 -11.765  10.115   4.228
  295    HB2  GLU  36           1HB      GLU  36 -13.957   9.736   5.297
  296    HB3  GLU  36           2HB      GLU  36 -13.880   8.042   4.844
  297    HG2  GLU  36           1HG      GLU  36 -11.966   7.713   6.289
  298    HG3  GLU  36           2HG      GLU  36 -11.970   9.428   6.708
  299    H    GLY  37           H        GLY  37 -12.861   7.239   2.570
  300    HA2  GLY  37           1HA      GLY  37 -10.744   5.514   3.252
  301    HA3  GLY  37           2HA      GLY  37 -11.750   5.380   1.812
  302    H    LYS  38           H        LYS  38 -11.206   7.809   0.631
  303    HA   LYS  38           HA       LYS  38  -8.929   7.466  -0.913
  304    HB2  LYS  38           1HB      LYS  38 -10.504   9.928  -0.203
  305    HB3  LYS  38           2HB      LYS  38  -9.077  10.044  -1.208
  306    HG2  LYS  38           1HG      LYS  38 -11.329   8.202  -1.929
  307    HG3  LYS  38           2HG      LYS  38 -11.380   9.921  -2.332
  308    HD2  LYS  38           1HD      LYS  38  -9.253   9.695  -3.537
  309    HD3  LYS  38           2HD      LYS  38  -9.217   7.979  -3.143
  310    HE2  LYS  38           1HE      LYS  38 -11.248   7.611  -4.412
  311    HE3  LYS  38           2HE      LYS  38 -11.394   9.339  -4.732
  312    HZ1  LYS  38           3HZ      LYS  38  -9.055   7.746  -5.625
  313    HZ2  LYS  38           1HZ      LYS  38  -9.527   9.262  -6.168
  314    HZ3  LYS  38           2HZ      LYS  38 -10.434   7.865  -6.551
  315    H    GLU  39           H        GLU  39  -9.259   9.205   2.138
  316    HA   GLU  39           HA       GLU  39  -6.672  10.470   1.925
  317    HB2  GLU  39           1HB      GLU  39  -8.718  11.430   3.079
  318    HB3  GLU  39           2HB      GLU  39  -8.488  10.143   4.263
  319    HG2  GLU  39           1HG      GLU  39  -7.594  12.182   5.150
  320    HG3  GLU  39           2HG      GLU  39  -6.292  11.042   4.791
  321    H    LEU  40           H        LEU  40  -8.258   8.093   3.960
  322    HA   LEU  40           HA       LEU  40  -6.268   7.254   5.645
  323    HG   LEU  40           HG       LEU  40  -7.066   4.283   4.839
  324    HB2  LEU  40           1HB      LEU  40  -8.435   6.546   6.077
  325    HB3  LEU  40           2HB      LEU  40  -8.692   6.006   4.433
  326   HD11  LEU  40          1HD1      LEU  40  -6.703   3.511   7.217
  327   HD12  LEU  40          2HD1      LEU  40  -7.461   5.008   7.760
  328   HD13  LEU  40          3HD1      LEU  40  -5.949   5.063   6.850
  329   HD21  LEU  40          3HD2      LEU  40  -8.664   2.743   5.991
  330   HD22  LEU  40          1HD2      LEU  40  -9.361   3.718   4.708
  331   HD23  LEU  40          2HD2      LEU  40  -9.648   4.154   6.392
  332    H    LYS  41           H        LYS  41  -7.191   5.797   2.553
  333    HA   LYS  41           HA       LYS  41  -5.193   3.772   2.747
  334    HB2  LYS  41           1HB      LYS  41  -7.085   4.520   0.554
  335    HB3  LYS  41           2HB      LYS  41  -6.070   3.072   0.575
  336    HG2  LYS  41           1HG      LYS  41  -7.209   2.088   2.218
  337    HG3  LYS  41           2HG      LYS  41  -7.791   3.579   2.937
  338    HD2  LYS  41           1HD      LYS  41  -9.256   3.876   0.962
  339    HD3  LYS  41           2HD      LYS  41  -8.701   2.311   0.367
  340    HE2  LYS  41           1HE      LYS  41  -9.610   1.235   2.339
  341    HE3  LYS  41           2HE      LYS  41 -10.122   2.802   2.969
  342    HZ1  LYS  41           3HZ      LYS  41 -11.652   3.054   1.190
  343    HZ2  LYS  41           1HZ      LYS  41 -11.903   1.547   1.851
  344    HZ3  LYS  41           2HZ      LYS  41 -11.099   1.703   0.377
  345    H    ASP  42           H        ASP  42  -5.494   6.813   1.045
  346    HA   ASP  42           HA       ASP  42  -3.403   6.459  -0.764
  347    HB2  ASP  42           1HB      ASP  42  -4.881   8.318  -1.012
  348    HB3  ASP  42           2HB      ASP  42  -4.455   8.969   0.560
  349    H    HIS  43           H        HIS  43  -3.475   7.661   2.516
  350    HA   HIS  43           HA       HIS  43  -0.639   8.191   2.576
  351    HD1  HIS  43           1HD      HIS  43  -1.219  11.023   5.591
  352    HD2  HIS  43           2HD      HIS  43  -3.230  10.052   2.100
  353    HE1  HIS  43           1HE      HIS  43  -1.999  13.202   4.627
  354    HE2  HIS  43           2HE      HIS  43  -3.666  12.393   2.917
  355    HB2  HIS  43           1HB      HIS  43  -2.717   8.217   4.766
  356    HB3  HIS  43           2HB      HIS  43  -1.024   8.598   5.032
  357    H    LEU  44           H        LEU  44  -2.719   5.570   3.473
  358    HA   LEU  44           HA       LEU  44  -0.856   4.246   5.159
  359    HG   LEU  44           HG       LEU  44  -1.848   2.061   6.126
  360    HB2  LEU  44           1HB      LEU  44  -3.334   4.022   5.260
  361    HB3  LEU  44           2HB      LEU  44  -3.294   3.177   3.738
  362   HD11  LEU  44          1HD1      LEU  44  -4.086   2.516   6.899
  363   HD12  LEU  44          2HD1      LEU  44  -3.961   0.784   6.556
  364   HD13  LEU  44          3HD1      LEU  44  -4.761   1.860   5.416
  365   HD21  LEU  44          3HD2      LEU  44  -2.315  -0.053   5.005
  366   HD22  LEU  44          1HD2      LEU  44  -1.470   1.039   3.911
  367   HD23  LEU  44          2HD2      LEU  44  -3.209   0.792   3.740
  368    H    GLN  45           H        GLN  45  -1.960   3.475   1.794
  369    HA   GLN  45           HA       GLN  45   0.201   1.692   1.543
  370    HB2  GLN  45           1HB      GLN  45  -1.843   2.684  -0.385
  371    HB3  GLN  45           2HB      GLN  45  -0.349   2.074  -1.071
  372    HG2  GLN  45           1HG      GLN  45  -1.877   0.254  -1.077
  373    HG3  GLN  45           2HG      GLN  45  -0.733  -0.066   0.211
  374   HE21  GLN  45          1HE2      GLN  45  -2.142  -1.520   1.190
  375   HE22  GLN  45          2HE2      GLN  45  -3.590  -1.116   2.026
  376    H    GLU  46           H        GLU  46  -0.023   5.111   1.076
  377    HA   GLU  46           HA       GLU  46   2.388   5.637  -0.304
  378    HB2  GLU  46           1HB      GLU  46   0.703   7.361   0.427
  379    HB3  GLU  46           2HB      GLU  46   1.272   7.144   2.072
  380    HG2  GLU  46           1HG      GLU  46   2.320   9.091   1.329
  381    HG3  GLU  46           2HG      GLU  46   3.545   7.843   1.216
  382    H    ALA  47           H        ALA  47   1.655   5.029   3.084
  383    HA   ALA  47           HA       ALA  47   4.134   5.458   4.284
  384    HB1  ALA  47           3HB      ALA  47   3.322   4.016   6.069
  385    HB2  ALA  47           1HB      ALA  47   2.111   5.219   5.590
  386    HB3  ALA  47           2HB      ALA  47   1.965   3.530   5.064
  387    H    LEU  48           H        LEU  48   2.763   2.626   2.780
  388    HA   LEU  48           HA       LEU  48   4.735   0.741   3.369
  389    HG   LEU  48           HG       LEU  48   4.250  -1.527   2.017
  390    HB2  LEU  48           1HB      LEU  48   2.537   0.327   2.247
  391    HB3  LEU  48           2HB      LEU  48   3.174   1.034   0.789
  392   HD11  LEU  48          1HD1      LEU  48   1.948  -1.807   1.445
  393   HD12  LEU  48          2HD1      LEU  48   2.963  -2.640   0.261
  394   HD13  LEU  48          3HD1      LEU  48   2.229  -1.081  -0.133
  395   HD21  LEU  48          3HD2      LEU  48   5.176  -1.927  -0.210
  396   HD22  LEU  48          1HD2      LEU  48   5.801  -0.412   0.447
  397   HD23  LEU  48          2HD2      LEU  48   4.528  -0.387  -0.772
  398    H    GLU  49           H        GLU  49   4.704   3.299   0.945
  399    HA   GLU  49           HA       GLU  49   7.271   2.381   0.002
  400    HB2  GLU  49           1HB      GLU  49   5.788   2.922  -1.812
  401    HB3  GLU  49           2HB      GLU  49   5.384   4.471  -1.108
  402    HG2  GLU  49           1HG      GLU  49   6.847   4.644  -3.090
  403    HG3  GLU  49           2HG      GLU  49   7.553   5.358  -1.649
  404    H    THR  50           H        THR  50   6.423   5.792   0.265
  405    HA   THR  50           HA       THR  50   8.681   6.043   2.142
  406    HB   THR  50           HB       THR  50   8.400   7.930  -0.235
  407    HG1  THR  50           1HG      THR  50   9.099   5.378  -0.356
  408   HG21  THR  50          3HG2      THR  50   9.760   8.726   1.671
  409   HG22  THR  50          1HG2      THR  50  10.762   8.417   0.253
  410   HG23  THR  50          2HG2      THR  50  10.740   7.260   1.581
  411    H    GLY  51           H        GLY  51   5.679   6.293   2.216
  412    HA2  GLY  51           1HA      GLY  51   5.177   9.065   2.788
  413    HA3  GLY  51           2HA      GLY  51   4.083   7.714   3.062
  414    H    CYS  52           H        CYS  52   3.586   7.436   5.056
  415    HA   CYS  52           HA       CYS  52   5.672   7.803   6.993
  416    HB2  CYS  52           1HB      CYS  52   4.578   9.954   6.967
  417    HB3  CYS  52           2HB      CYS  52   3.006   9.196   7.196
  418    H    GLU  53           H        GLU  53   5.738   5.691   7.457
  419    HA   GLU  53           HA       GLU  53   3.545   3.964   7.998
  420    HB2  GLU  53           1HB      GLU  53   5.804   3.184   7.384
  421    HB3  GLU  53           2HB      GLU  53   6.432   3.847   8.885
  422    HG2  GLU  53           1HG      GLU  53   4.861   2.297  10.089
  423    HG3  GLU  53           2HG      GLU  53   4.561   1.539   8.524
  424    H    LYS  54           H        LYS  54   5.874   5.550  10.008
  425    HA   LYS  54           HA       LYS  54   4.747   4.727  12.460
  426    HB2  LYS  54           1HB      LYS  54   6.530   6.241  13.438
  427    HB3  LYS  54           2HB      LYS  54   7.062   4.930  12.411
  428    HG2  LYS  54           1HG      LYS  54   8.386   6.825  11.874
  429    HG3  LYS  54           2HG      LYS  54   7.289   6.573  10.526
  430    HD2  LYS  54           1HD      LYS  54   7.382   8.925  10.961
  431    HD3  LYS  54           2HD      LYS  54   5.813   8.350  11.529
  432    HE2  LYS  54           1HE      LYS  54   6.743   9.861  13.165
  433    HE3  LYS  54           2HE      LYS  54   6.738   8.237  13.833
  434    HZ1  LYS  54           3HZ      LYS  54   8.832   9.351  14.260
  435    HZ2  LYS  54           1HZ      LYS  54   9.061   9.602  12.615
  436    HZ3  LYS  54           2HZ      LYS  54   9.090   8.039  13.254
  437    H    CYS  55           H        CYS  55   3.046   6.496  10.754
  438    HA   CYS  55           HA       CYS  55   2.769   8.901  12.275
  439    HB2  CYS  55           1HB      CYS  55   1.606   7.831   9.824
  440    HB3  CYS  55           2HB      CYS  55   0.537   8.890  10.714
  441    H    THR  56           H        THR  56  -0.329   7.588  11.499
  442    HA   THR  56           HA       THR  56  -0.855   7.435  14.356
  443    HB   THR  56           HB       THR  56  -2.764   7.554  11.998
  444    HG1  THR  56           1HG      THR  56  -1.347   9.472  12.572
  445   HG21  THR  56          3HG2      THR  56  -3.771   6.542  14.013
  446   HG22  THR  56          1HG2      THR  56  -4.476   8.126  13.688
  447   HG23  THR  56          2HG2      THR  56  -3.273   7.942  14.961
  448    H    GLU  57           H        GLU  57  -1.934   5.572  15.158
  449    HA   GLU  57           HA       GLU  57  -0.884   3.181  14.556
  450    HB2  GLU  57           1HB      GLU  57  -2.714   2.149  15.832
  451    HB3  GLU  57           2HB      GLU  57  -2.021   3.565  16.611
  452    HG2  GLU  57           1HG      GLU  57  -3.883   4.910  15.881
  453    HG3  GLU  57           2HG      GLU  57  -4.567   3.535  15.022
  454    H    ALA  58           H        ALA  58  -3.949   4.346  13.093
  455    HA   ALA  58           HA       ALA  58  -4.600   1.902  11.870
  456    HB1  ALA  58           3HB      ALA  58  -6.174   3.855  12.095
  457    HB2  ALA  58           1HB      ALA  58  -5.295   4.614  10.770
  458    HB3  ALA  58           2HB      ALA  58  -6.148   3.108  10.494
  459    H    GLN  59           H        GLN  59  -2.624   4.577  10.801
  460    HA   GLN  59           HA       GLN  59  -2.065   3.329   8.286
  461    HB2  GLN  59           1HB      GLN  59  -0.910   5.763   9.620
  462    HB3  GLN  59           2HB      GLN  59  -0.300   5.137   8.094
  463    HG2  GLN  59           1HG      GLN  59  -2.476   5.439   7.073
  464    HG3  GLN  59           2HG      GLN  59  -3.133   6.016   8.599
  465   HE21  GLN  59          1HE2      GLN  59   0.093   6.851   7.457
  466   HE22  GLN  59          2HE2      GLN  59  -0.289   8.511   7.163
  467    H    GLU  60           H        GLU  60  -0.359   3.716  11.351
  468    HA   GLU  60           HA       GLU  60   2.066   2.526  10.776
  469    HB2  GLU  60           1HB      GLU  60   0.387   2.081  13.230
  470    HB3  GLU  60           2HB      GLU  60   2.078   1.641  13.088
  471    HG2  GLU  60           1HG      GLU  60   2.547   3.939  12.584
  472    HG3  GLU  60           2HG      GLU  60   0.897   4.378  13.006
  473    H    LYS  61           H        LYS  61  -0.701   0.931  12.056
  474    HA   LYS  61           HA       LYS  61   0.287  -1.730  11.681
  475    HB2  LYS  61           1HB      LYS  61  -2.584  -0.903  12.168
  476    HB3  LYS  61           2HB      LYS  61  -1.946  -2.528  12.334
  477    HG2  LYS  61           1HG      LYS  61  -1.225  -0.133  14.022
  478    HG3  LYS  61           2HG      LYS  61  -2.210  -1.505  14.512
  479    HD2  LYS  61           1HD      LYS  61   0.722  -1.635  13.751
  480    HD3  LYS  61           2HD      LYS  61   0.086  -1.621  15.392
  481    HE2  LYS  61           1HE      LYS  61  -1.039  -3.741  15.009
  482    HE3  LYS  61           2HE      LYS  61  -0.506  -3.745  13.329
  483    HZ1  LYS  61           3HZ      LYS  61   1.752  -3.871  14.047
  484    HZ2  LYS  61           1HZ      LYS  61   0.888  -5.146  14.718
  485    HZ3  LYS  61           2HZ      LYS  61   1.325  -3.831  15.680
  486    H    GLY  62           H        GLY  62  -1.717   0.386   9.839
  487    HA2  GLY  62           1HA      GLY  62  -2.642  -1.442   7.912
  488    HA3  GLY  62           2HA      GLY  62  -2.471   0.326   7.732
  489    H    ALA  63           H        ALA  63   0.221   0.615   8.074
  490    HA   ALA  63           HA       ALA  63   1.214   0.075   5.541
  491    HB1  ALA  63           3HB      ALA  63   2.023   1.912   6.923
  492    HB2  ALA  63           1HB      ALA  63   2.720   0.751   8.052
  493    HB3  ALA  63           2HB      ALA  63   3.353   0.873   6.404
  494    H    GLU  64           H        GLU  64   1.947  -1.464   8.669
  495    HA   GLU  64           HA       GLU  64   3.797  -3.252   7.524
  496    HB2  GLU  64           1HB      GLU  64   3.669  -4.566   9.597
  497    HB3  GLU  64           2HB      GLU  64   3.926  -2.854   9.887
  498    HG2  GLU  64           1HG      GLU  64   1.647  -2.579  10.526
  499    HG3  GLU  64           2HG      GLU  64   1.279  -4.248  10.103
  500    H    THR  65           H        THR  65   0.320  -3.579   7.919
  501    HA   THR  65           HA       THR  65   0.344  -6.343   7.001
  502    HB   THR  65           HB       THR  65  -1.466  -5.387   8.522
  503    HG1  THR  65           1HG      THR  65  -1.836  -7.292   7.325
  504   HG21  THR  65          3HG2      THR  65  -2.438  -4.079   5.981
  505   HG22  THR  65          1HG2      THR  65  -1.827  -3.253   7.414
  506   HG23  THR  65          2HG2      THR  65  -3.336  -4.164   7.498
  507    H    SER  66           H        SER  66  -0.104  -3.230   5.444
  508    HA   SER  66           HA       SER  66  -0.664  -4.445   2.997
  509    HG   SER  66           HG       SER  66   0.285  -2.758   1.213
  510    HB2  SER  66           1HB      SER  66  -1.142  -2.033   3.546
  511    HB3  SER  66           2HB      SER  66   0.583  -1.715   3.390
  512    H    ILE  67           H        ILE  67   2.341  -3.524   4.563
  513    HA   ILE  67           HA       ILE  67   4.064  -3.995   2.395
  514    HB   ILE  67           HB       ILE  67   4.574  -4.197   5.385
  515   HG12  ILE  67          1HG1      ILE  67   5.492  -2.118   3.395
  516   HG13  ILE  67          2HG1      ILE  67   4.045  -1.938   4.391
  517   HG21  ILE  67          1HG2      ILE  67   6.178  -5.637   4.251
  518   HG22  ILE  67          2HG2      ILE  67   6.983  -4.198   4.874
  519   HG23  ILE  67          3HG2      ILE  67   6.607  -4.326   3.156
  520   HD11  ILE  67          3HD1      ILE  67   5.880  -0.687   5.300
  521   HD12  ILE  67          1HD1      ILE  67   6.902  -2.135   5.325
  522   HD13  ILE  67          2HD1      ILE  67   5.487  -2.034   6.383
  523    H    ASP  68           H        ASP  68   2.912  -6.136   4.957
  524    HA   ASP  68           HA       ASP  68   4.341  -8.425   4.368
  525    HB2  ASP  68           1HB      ASP  68   3.093  -8.444   6.363
  526    HB3  ASP  68           2HB      ASP  68   1.612  -7.977   5.549
  527    H    TYR  69           H        TYR  69   1.054  -7.677   3.181
  528    HA   TYR  69           HA       TYR  69   1.300 -10.032   1.579
  529    HD1  TYR  69           1HD      TYR  69  -0.677 -11.559   2.703
  530    HD2  TYR  69           2HD      TYR  69  -1.711  -9.421  -0.811
  531    HE1  TYR  69           1HE      TYR  69  -1.500 -13.631   1.709
  532    HE2  TYR  69           2HE      TYR  69  -2.545 -11.500  -1.819
  533    HH   TYR  69           HH       TYR  69  -3.021 -14.352  -0.017
  534    HB2  TYR  69           1HB      TYR  69  -0.870  -9.116   2.715
  535    HB3  TYR  69           2HB      TYR  69  -1.036  -8.254   1.184
  536    H    LEU  70           H        LEU  70   1.414  -6.584   0.889
  537    HA   LEU  70           HA       LEU  70   1.207  -6.936  -1.903
  538    HG   LEU  70           HG       LEU  70   1.441  -4.899  -3.143
  539    HB2  LEU  70           1HB      LEU  70   0.821  -4.789  -0.587
  540    HB3  LEU  70           2HB      LEU  70   2.549  -4.689  -0.421
  541   HD11  LEU  70          1HD1      LEU  70   1.449  -2.372  -1.463
  542   HD12  LEU  70          2HD1      LEU  70   0.017  -3.194  -2.078
  543   HD13  LEU  70          3HD1      LEU  70   1.142  -2.426  -3.198
  544   HD21  LEU  70          3HD2      LEU  70   3.839  -4.860  -2.804
  545   HD22  LEU  70          1HD2      LEU  70   3.704  -3.339  -1.917
  546   HD23  LEU  70          2HD2      LEU  70   3.300  -3.400  -3.635
  547    H    ILE  71           H        ILE  71   4.035  -6.756   0.248
  548    HA   ILE  71           HA       ILE  71   5.826  -6.880  -1.929
  549    HB   ILE  71           HB       ILE  71   6.259  -7.535   0.998
  550   HG12  ILE  71          1HG1      ILE  71   5.743  -5.175   0.567
  551   HG13  ILE  71          2HG1      ILE  71   7.405  -5.364   1.100
  552   HG21  ILE  71          1HG2      ILE  71   8.359  -7.265  -1.146
  553   HG22  ILE  71          2HG2      ILE  71   7.900  -8.752  -0.320
  554   HG23  ILE  71          3HG2      ILE  71   8.665  -7.448   0.582
  555   HD11  ILE  71          3HD1      ILE  71   6.484  -4.904  -1.737
  556   HD12  ILE  71          1HD1      ILE  71   8.164  -5.123  -1.221
  557   HD13  ILE  71          2HD1      ILE  71   7.244  -3.722  -0.665
  558    H    LYS  72           H        LYS  72   4.289  -9.443   0.014
  559    HA   LYS  72           HA       LYS  72   5.921 -11.343  -1.443
  560    HB2  LYS  72           1HB      LYS  72   5.114 -13.065   0.014
  561    HB3  LYS  72           2HB      LYS  72   5.570 -11.670   0.974
  562    HG2  LYS  72           1HG      LYS  72   3.130 -11.058   1.008
  563    HG3  LYS  72           2HG      LYS  72   2.812 -12.656   0.325
  564    HD2  LYS  72           1HD      LYS  72   4.019 -13.665   2.234
  565    HD3  LYS  72           2HD      LYS  72   4.215 -12.056   2.925
  566    HE2  LYS  72           1HE      LYS  72   1.730 -11.826   2.896
  567    HE3  LYS  72           2HE      LYS  72   1.636 -13.517   2.410
  568    HZ1  LYS  72           3HZ      LYS  72   2.658 -12.392   4.945
  569    HZ2  LYS  72           1HZ      LYS  72   2.935 -14.008   4.501
  570    HZ3  LYS  72           2HZ      LYS  72   1.364 -13.446   4.716
  571    H    ASN  73           H        ASN  73   3.051  -9.855  -2.194
  572    HA   ASN  73           HA       ASN  73   2.295 -12.162  -3.907
  573    HB2  ASN  73           1HB      ASN  73   0.582 -11.938  -2.164
  574    HB3  ASN  73           2HB      ASN  73   0.360 -10.244  -2.581
  575   HD21  ASN  73          1HD2      ASN  73  -1.805 -10.323  -3.247
  576   HD22  ASN  73          2HD2      ASN  73  -2.288 -11.190  -4.641
  577    H    GLU  74           H        GLU  74   1.755  -8.632  -3.570
  578    HA   GLU  74           HA       GLU  74   1.585  -8.507  -6.491
  579    HB2  GLU  74           1HB      GLU  74   0.208  -6.836  -4.396
  580    HB3  GLU  74           2HB      GLU  74   0.224  -6.415  -6.097
  581    HG2  GLU  74           1HG      GLU  74  -0.945  -8.928  -4.919
  582    HG3  GLU  74           2HG      GLU  74  -1.855  -7.506  -5.428
  583    H    LEU  75           H        LEU  75   3.875  -8.319  -6.426
  584    HA   LEU  75           HA       LEU  75   5.132  -6.141  -5.062
  585    HG   LEU  75           HG       LEU  75   7.763  -6.046  -6.698
  586    HB2  LEU  75           1HB      LEU  75   6.226  -8.330  -5.466
  587    HB3  LEU  75           2HB      LEU  75   6.280  -7.957  -7.175
  588   HD11  LEU  75          1HD1      LEU  75   7.648  -7.079  -3.870
  589   HD12  LEU  75          2HD1      LEU  75   7.058  -5.520  -4.447
  590   HD13  LEU  75          3HD1      LEU  75   8.782  -5.869  -4.464
  591   HD21  LEU  75          3HD2      LEU  75   8.715  -8.220  -7.286
  592   HD22  LEU  75          1HD2      LEU  75   8.715  -8.687  -5.587
  593   HD23  LEU  75          2HD2      LEU  75   9.749  -7.370  -6.139
  594    H    GLU  76           H        GLU  76   3.699  -6.525  -8.156
  595    HA   GLU  76           HA       GLU  76   5.187  -4.519  -9.534
  596    HB2  GLU  76           1HB      GLU  76   2.396  -5.535 -10.136
  597    HB3  GLU  76           2HB      GLU  76   3.393  -4.538 -11.159
  598    HG2  GLU  76           1HG      GLU  76   4.162  -7.293 -10.283
  599    HG3  GLU  76           2HG      GLU  76   3.392  -6.904 -11.820
  600    H    ILE  77           H        ILE  77   2.430  -4.542  -7.464
  601    HA   ILE  77           HA       ILE  77   1.527  -1.908  -7.992
  602    HB   ILE  77           HB       ILE  77   1.184  -3.541  -5.453
  603   HG12  ILE  77          1HG1      ILE  77   0.328  -4.730  -7.408
  604   HG13  ILE  77          2HG1      ILE  77  -0.999  -4.185  -6.372
  605   HG21  ILE  77          1HG2      ILE  77  -0.406  -1.176  -6.461
  606   HG22  ILE  77          2HG2      ILE  77   0.703  -1.170  -5.092
  607   HG23  ILE  77          3HG2      ILE  77  -0.779  -2.127  -5.023
  608   HD11  ILE  77          3HD1      ILE  77  -1.539  -3.915  -8.718
  609   HD12  ILE  77          1HD1      ILE  77  -0.095  -2.933  -8.965
  610   HD13  ILE  77          2HD1      ILE  77  -1.402  -2.332  -7.946
  611    H    TRP  78           H        TRP  78   3.921  -3.288  -5.837
  612    HA   TRP  78           HA       TRP  78   4.474  -0.960  -4.343
  613    HD1  TRP  78           HD       TRP  78   6.172  -0.546  -2.290
  614    HE1  TRP  78           1HE      TRP  78   8.599   0.149  -1.848
  615    HE3  TRP  78           3HE      TRP  78   8.502  -3.649  -5.597
  616    HZ2  TRP  78           2HZ      TRP  78  11.141  -0.544  -2.763
  617    HZ3  TRP  78           3HZ      TRP  78  10.946  -3.577  -5.747
  618    HH2  TRP  78           HH       TRP  78  12.248  -2.055  -4.360
  619    HB2  TRP  78           1HB      TRP  78   5.349  -3.066  -3.532
  620    HB3  TRP  78           2HB      TRP  78   6.245  -3.317  -5.026
  621    H    LYS  79           H        LYS  79   5.789  -2.231  -7.332
  622    HA   LYS  79           HA       LYS  79   7.726  -0.275  -7.849
  623    HB2  LYS  79           1HB      LYS  79   5.990  -1.794  -9.788
  624    HB3  LYS  79           2HB      LYS  79   7.409  -0.869 -10.248
  625    HG2  LYS  79           1HG      LYS  79   8.817  -2.362  -8.955
  626    HG3  LYS  79           2HG      LYS  79   7.392  -3.259  -8.419
  627    HD2  LYS  79           1HD      LYS  79   6.890  -3.860 -10.729
  628    HD3  LYS  79           2HD      LYS  79   8.274  -2.924 -11.284
  629    HE2  LYS  79           1HE      LYS  79   9.781  -4.394 -10.106
  630    HE3  LYS  79           2HE      LYS  79   8.422  -5.293  -9.432
  631    HZ1  LYS  79           3HZ      LYS  79   9.428  -6.381 -11.340
  632    HZ2  LYS  79           1HZ      LYS  79   9.038  -5.075 -12.326
  633    HZ3  LYS  79           2HZ      LYS  79   7.806  -5.996 -11.612
  634    H    GLU  80           H        GLU  80   4.272  -0.268  -8.321
  635    HA   GLU  80           HA       GLU  80   4.296   2.191  -9.752
  636    HB2  GLU  80           1HB      GLU  80   2.002   0.696  -8.510
  637    HB3  GLU  80           2HB      GLU  80   1.840   2.131  -9.518
  638    HG2  GLU  80           1HG      GLU  80   3.087   0.884 -11.304
  639    HG3  GLU  80           2HG      GLU  80   2.931  -0.551 -10.300
  640    H    LEU  81           H        LEU  81   3.960   1.325  -6.382
  641    HA   LEU  81           HA       LEU  81   3.264   3.984  -5.553
  642    HG   LEU  81           HG       LEU  81   2.533   0.920  -4.710
  643    HB2  LEU  81           1HB      LEU  81   4.678   1.893  -3.845
  644    HB3  LEU  81           2HB      LEU  81   3.782   3.274  -3.310
  645   HD11  LEU  81          1HD1      LEU  81   2.479   1.727  -1.812
  646   HD12  LEU  81          2HD1      LEU  81   3.288   0.317  -2.507
  647   HD13  LEU  81          3HD1      LEU  81   1.524   0.433  -2.544
  648   HD21  LEU  81          3HD2      LEU  81   1.309   2.987  -5.168
  649   HD22  LEU  81          1HD2      LEU  81   1.278   3.367  -3.445
  650   HD23  LEU  81          2HD2      LEU  81   0.396   1.973  -4.062
  651    H    THR  82           H        THR  82   6.166   2.187  -6.105
  652    HA   THR  82           HA       THR  82   8.054   4.069  -5.376
  653    HB   THR  82           HB       THR  82   7.991   1.871  -7.444
  654    HG1  THR  82           1HG      THR  82   8.564   2.028  -4.805
  655   HG21  THR  82          3HG2      THR  82  10.357   3.613  -6.743
  656   HG22  THR  82          1HG2      THR  82   9.606   3.392  -8.329
  657   HG23  THR  82          2HG2      THR  82  10.484   2.052  -7.573
  658    H    ALA  83           H        ALA  83   6.465   3.542  -8.535
  659    HA   ALA  83           HA       ALA  83   7.546   5.762  -9.858
  660    HB1  ALA  83           3HB      ALA  83   5.713   5.503 -11.458
  661    HB2  ALA  83           1HB      ALA  83   6.386   3.931 -11.016
  662    HB3  ALA  83           2HB      ALA  83   4.857   4.466 -10.319
  663    H    HIS  84           H        HIS  84   4.922   5.532  -7.624
  664    HA   HIS  84           HA       HIS  84   3.655   8.009  -8.097
  665    HD1  HIS  84           1HD      HIS  84   0.464   7.590  -6.074
  666    HD2  HIS  84           2HD      HIS  84   3.879   8.732  -4.026
  667    HE1  HIS  84           1HE      HIS  84  -0.308   9.122  -4.257
  668    HE2  HIS  84           2HE      HIS  84   1.753   9.295  -2.807
  669    HB2  HIS  84           1HB      HIS  84   2.473   6.324  -6.859
  670    HB3  HIS  84           2HB      HIS  84   3.757   6.197  -5.677
  671    H    PHE  85           H        PHE  85   6.175   7.112  -5.738
  672    HA   PHE  85           HA       PHE  85   6.354   9.981  -5.064
  673    HD1  PHE  85           1HD      PHE  85   9.227   8.961  -2.593
  674    HD2  PHE  85           2HD      PHE  85   5.282  10.483  -2.188
  675    HE1  PHE  85           1HE      PHE  85  10.046  10.637  -0.994
  676    HE2  PHE  85           2HE      PHE  85   6.090  12.162  -0.579
  677    HZ   PHE  85           HZ       PHE  85   8.479  12.239   0.017
  678    HB2  PHE  85           1HB      PHE  85   5.662   8.370  -3.230
  679    HB3  PHE  85           2HB      PHE  85   7.268   7.680  -3.342
  680    H    ASP  86           H        ASP  86   8.410   7.093  -5.410
  681    HA   ASP  86           HA       ASP  86  10.647   8.823  -6.110
  682    HB2  ASP  86           1HB      ASP  86  10.922   8.642  -3.745
  683    HB3  ASP  86           2HB      ASP  86  10.589   6.919  -3.768
  684    HA   PRO  87           HA       PRO  87  10.148   5.150  -8.837
  685    HB2  PRO  87           1HB      PRO  87  11.153   7.010 -10.875
  686    HB3  PRO  87           2HB      PRO  87   9.666   6.057 -10.867
  687    HG2  PRO  87           1HG      PRO  87   9.628   8.714 -10.549
  688    HG3  PRO  87           2HG      PRO  87   8.489   7.665  -9.689
  689    HD2  PRO  87           1HD      PRO  87  10.999   8.955  -8.696
  690    HD3  PRO  87           2HD      PRO  87   9.419   8.797  -7.896
  691    H    ASP  88           H        ASP  88  12.826   7.429  -8.785
  692    HA   ASP  88           HA       ASP  88  14.563   5.343  -9.814
  693    HB2  ASP  88           1HB      ASP  88  14.754   8.322  -9.868
  694    HB3  ASP  88           2HB      ASP  88  16.206   7.343 -10.066
  695    H    GLY  89           H        GLY  89  13.625   5.410  -7.179
  696    HA2  GLY  89           1HA      GLY  89  15.668   6.196  -5.381
  697    HA3  GLY  89           2HA      GLY  89  14.376   5.061  -5.040
  698    H    LYS  90           H        LYS  90  16.374   4.244  -3.801
  699    HA   LYS  90           HA       LYS  90  18.477   2.991  -5.215
  700    HB2  LYS  90           1HB      LYS  90  18.518   3.775  -2.814
  701    HB3  LYS  90           2HB      LYS  90  17.496   2.406  -2.416
  702    HG2  LYS  90           1HG      LYS  90  19.807   1.962  -1.840
  703    HG3  LYS  90           2HG      LYS  90  19.275   0.876  -3.128
  704    HD2  LYS  90           1HD      LYS  90  20.400   2.218  -4.780
  705    HD3  LYS  90           2HD      LYS  90  20.830   3.423  -3.561
  706    HE2  LYS  90           1HE      LYS  90  22.226   1.833  -2.430
  707    HE3  LYS  90           2HE      LYS  90  21.735   0.543  -3.522
  708    HZ1  LYS  90           3HZ      LYS  90  23.266   2.981  -4.239
  709    HZ2  LYS  90           1HZ      LYS  90  22.744   1.803  -5.335
  710    HZ3  LYS  90           2HZ      LYS  90  23.869   1.409  -4.138
  711    H    TRP  91           H        TRP  91  15.333   2.072  -4.305
  712    HA   TRP  91           HA       TRP  91  13.901   0.423  -4.921
  713    HD1  TRP  91           HD       TRP  91  12.832   0.487  -8.192
  714    HE1  TRP  91           1HE      TRP  91  11.307  -1.446  -8.878
  715    HE3  TRP  91           3HE      TRP  91  15.263  -3.391  -5.853
  716    HZ2  TRP  91           2HZ      TRP  91  11.134  -4.232  -8.501
  717    HZ3  TRP  91           3HZ      TRP  91  14.339  -5.645  -6.077
  718    HH2  TRP  91           HH       TRP  91  12.316  -6.060  -7.369
  719    HB2  TRP  91           1HB      TRP  91  15.170   0.678  -7.156
  720    HB3  TRP  91           2HB      TRP  91  16.012  -0.793  -6.702
  721    H    ARG  92           H        ARG  92  17.011  -1.182  -4.945
  722    HA   ARG  92           HA       ARG  92  16.105  -3.607  -3.826
  723    HE   ARG  92           HE       ARG  92  19.230  -1.600  -5.939
  724    HB2  ARG  92           1HB      ARG  92  18.853  -2.398  -4.065
  725    HB3  ARG  92           2HB      ARG  92  18.603  -3.931  -3.258
  726    HG2  ARG  92           1HG      ARG  92  19.335  -4.322  -5.511
  727    HG3  ARG  92           2HG      ARG  92  17.670  -4.849  -5.344
  728    HD2  ARG  92           1HD      ARG  92  18.012  -3.723  -7.474
  729    HD3  ARG  92           2HD      ARG  92  16.921  -2.786  -6.473
  730   HH11  ARG  92          1HH1      ARG  92  17.793  -2.551  -9.029
  731   HH12  ARG  92          2HH1      ARG  92  18.564  -1.322  -9.920
  732   HH21  ARG  92          1HH2      ARG  92  20.289   0.073  -7.170
  733   HH22  ARG  92          2HH2      ARG  92  20.029   0.182  -8.852
  734    H    LYS  93           H        LYS  93  17.698  -0.842  -2.367
  735    HA   LYS  93           HA       LYS  93  17.837  -1.783   0.245
  736    HB2  LYS  93           1HB      LYS  93  19.016   0.214  -0.533
  737    HB3  LYS  93           2HB      LYS  93  17.483   1.057  -0.694
  738    HG2  LYS  93           1HG      LYS  93  17.139   0.952   1.704
  739    HG3  LYS  93           2HG      LYS  93  18.633   0.035   1.899
  740    HD2  LYS  93           1HD      LYS  93  19.871   1.922   0.921
  741    HD3  LYS  93           2HD      LYS  93  18.369   2.843   0.845
  742    HE2  LYS  93           1HE      LYS  93  18.160   2.717   3.271
  743    HE3  LYS  93           2HE      LYS  93  19.627   1.746   3.359
  744    HZ1  LYS  93           3HZ      LYS  93  19.436   4.549   2.422
  745    HZ2  LYS  93           1HZ      LYS  93  20.835   3.621   2.388
  746    HZ3  LYS  93           2HZ      LYS  93  20.145   4.023   3.859
  747    H    LYS  94           H        LYS  94  15.257  -0.112  -1.438
  748    HA   LYS  94           HA       LYS  94  13.489   0.338   0.731
  749    HB2  LYS  94           1HB      LYS  94  12.906  -0.350  -2.106
  750    HB3  LYS  94           2HB      LYS  94  11.711   0.246  -0.960
  751    HG2  LYS  94           1HG      LYS  94  12.967   2.371  -0.901
  752    HG3  LYS  94           2HG      LYS  94  14.058   1.705  -2.138
  753    HD2  LYS  94           1HD      LYS  94  12.202   1.352  -3.640
  754    HD3  LYS  94           2HD      LYS  94  11.071   1.904  -2.411
  755    HE2  LYS  94           1HE      LYS  94  12.121   4.105  -2.478
  756    HE3  LYS  94           2HE      LYS  94  13.194   3.538  -3.765
  757    HZ1  LYS  94           3HZ      LYS  94  11.220   3.063  -5.103
  758    HZ2  LYS  94           1HZ      LYS  94  11.263   4.700  -4.672
  759    HZ3  LYS  94           2HZ      LYS  94  10.240   3.597  -3.873
  760    H    TYR  95           H        TYR  95  13.783  -2.239  -1.627
  761    HA   TYR  95           HA       TYR  95  11.644  -3.826  -0.891
  762    HD1  TYR  95           1HD      TYR  95  10.598  -5.233  -2.341
  763    HD2  TYR  95           2HD      TYR  95  14.501  -6.864  -2.686
  764    HE1  TYR  95           1HE      TYR  95   9.633  -7.413  -2.931
  765    HE2  TYR  95           2HE      TYR  95  13.542  -9.050  -3.264
  766    HH   TYR  95           HH       TYR  95  11.494 -10.252  -2.995
  767    HB2  TYR  95           1HB      TYR  95  12.980  -3.910  -2.996
  768    HB3  TYR  95           2HB      TYR  95  14.289  -4.663  -2.104
  769    H    GLU  96           H        GLU  96  15.050  -3.988   0.088
  770    HA   GLU  96           HA       GLU  96  14.783  -6.104   1.931
  771    HB2  GLU  96           1HB      GLU  96  16.760  -3.816   1.870
  772    HB3  GLU  96           2HB      GLU  96  16.901  -5.231   2.899
  773    HG2  GLU  96           1HG      GLU  96  17.074  -6.644   0.901
  774    HG3  GLU  96           2HG      GLU  96  16.964  -5.206  -0.115
  775    H    ASP  97           H        ASP  97  14.852  -2.608   2.391
  776    HA   ASP  97           HA       ASP  97  14.642  -2.356   5.127
  777    HB2  ASP  97           1HB      ASP  97  15.137  -0.495   3.717
  778    HB3  ASP  97           2HB      ASP  97  13.589  -0.624   2.906
  779    H    ARG  98           H        ARG  98  11.915  -2.304   2.843
  780    HA   ARG  98           HA       ARG  98   9.959  -2.031   4.904
  781    HE   ARG  98           HE       ARG  98   9.255   1.353   1.223
  782    HB2  ARG  98           1HB      ARG  98   9.708  -2.745   1.984
  783    HB3  ARG  98           2HB      ARG  98   8.320  -2.769   3.045
  784    HG2  ARG  98           1HG      ARG  98   8.420  -0.715   1.710
  785    HG3  ARG  98           2HG      ARG  98   8.554  -0.367   3.427
  786    HD2  ARG  98           1HD      ARG  98  10.833   0.122   3.256
  787    HD3  ARG  98           2HD      ARG  98  10.975  -0.668   1.693
  788   HH11  ARG  98          1HH1      ARG  98  12.275   1.425   3.005
  789   HH12  ARG  98          2HH1      ARG  98  12.946   2.757   2.178
  790   HH21  ARG  98          1HH2      ARG  98  10.187   3.224  -0.004
  791   HH22  ARG  98          2HH2      ARG  98  11.701   3.834   0.475
  792    H    ALA  99           H        ALA  99  11.044  -4.791   2.964
  793    HA   ALA  99           HA       ALA  99   9.113  -6.558   4.013
  794    HB1  ALA  99           3HB      ALA  99  10.156  -6.868   1.851
  795    HB2  ALA  99           1HB      ALA  99  11.707  -7.139   2.631
  796    HB3  ALA  99           2HB      ALA  99  10.393  -8.292   2.865
  797    H    LYS 100           H        LYS 100  12.569  -6.123   4.734
  798    HA   LYS 100           HA       LYS 100  12.587  -8.311   6.531
  799    HB2  LYS 100           1HB      LYS 100  14.608  -6.113   6.188
  800    HB3  LYS 100           2HB      LYS 100  14.826  -7.588   7.123
  801    HG2  LYS 100           1HG      LYS 100  14.351  -7.475   4.144
  802    HG3  LYS 100           2HG      LYS 100  15.911  -7.717   4.909
  803    HD2  LYS 100           1HD      LYS 100  13.533  -9.561   5.171
  804    HD3  LYS 100           2HD      LYS 100  14.915  -9.805   4.111
  805    HE2  LYS 100           1HE      LYS 100  14.903  -9.749   7.132
  806    HE3  LYS 100           2HE      LYS 100  15.217 -11.139   6.100
  807    HZ1  LYS 100           3HZ      LYS 100  17.306 -10.318   6.865
  808    HZ2  LYS 100           1HZ      LYS 100  16.932  -8.740   6.420
  809    HZ3  LYS 100           2HZ      LYS 100  17.177  -9.874   5.232
  810    H    ALA 101           H        ALA 101  12.027  -4.880   6.983
  811    HA   ALA 101           HA       ALA 101  12.402  -4.922   9.791
  812    HB1  ALA 101           3HB      ALA 101  11.240  -2.785   9.824
  813    HB2  ALA 101           1HB      ALA 101  12.384  -2.834   8.485
  814    HB3  ALA 101           2HB      ALA 101  10.663  -3.052   8.180
  815    H    LYS 102           H        LYS 102   9.706  -5.742   7.729
  816    HA   LYS 102           HA       LYS 102   7.989  -6.030  10.076
  817    HB2  LYS 102           1HB      LYS 102   7.297  -6.333   7.163
  818    HB3  LYS 102           2HB      LYS 102   6.159  -6.320   8.504
  819    HG2  LYS 102           1HG      LYS 102   7.924  -4.051   7.630
  820    HG3  LYS 102           2HG      LYS 102   6.182  -4.195   7.400
  821    HD2  LYS 102           1HD      LYS 102   5.859  -4.128   9.847
  822    HD3  LYS 102           2HD      LYS 102   7.605  -4.052  10.078
  823    HE2  LYS 102           1HE      LYS 102   7.638  -1.922   8.829
  824    HE3  LYS 102           2HE      LYS 102   5.882  -1.987   8.728
  825    HZ1  LYS 102           3HZ      LYS 102   7.446  -1.874  11.252
  826    HZ2  LYS 102           1HZ      LYS 102   5.765  -1.833  11.164
  827    HZ3  LYS 102           2HZ      LYS 102   6.695  -0.562  10.551
  828    H    GLY 103           H        GLY 103   9.913  -7.834   8.103
  829    HA2  GLY 103           1HA      GLY 103  10.645 -10.007   8.768
  830    HA3  GLY 103           2HA      GLY 103   9.111 -10.236   9.599
  831    H    ILE 104           H        ILE 104   9.866  -9.292   6.282
  832    HA   ILE 104           HA       ILE 104   8.304 -11.588   5.342
  833    HB   ILE 104           HB       ILE 104   8.899  -8.964   3.941
  834   HG12  ILE 104          1HG1      ILE 104   7.353  -8.565   5.756
  835   HG13  ILE 104          2HG1      ILE 104   6.490  -8.461   4.227
  836   HG21  ILE 104          1HG2      ILE 104   7.265  -9.667   2.255
  837   HG22  ILE 104          2HG2      ILE 104   7.095 -11.223   3.071
  838   HG23  ILE 104          3HG2      ILE 104   8.638 -10.770   2.344
  839   HD11  ILE 104          3HD1      ILE 104   5.179  -9.620   5.917
  840   HD12  ILE 104          1HD1      ILE 104   6.469 -10.802   6.123
  841   HD13  ILE 104          2HD1      ILE 104   5.596 -10.709   4.593
  842    H    VAL 105           H        VAL 105   9.382 -13.058   4.139
  843    HA   VAL 105           HA       VAL 105  12.201 -12.615   3.701
  844    HB   VAL 105           HB       VAL 105  12.256 -15.005   2.894
  845   HG11  VAL 105          1HG1      VAL 105  11.900 -15.978   5.135
  846   HG12  VAL 105          2HG1      VAL 105  12.809 -14.465   5.173
  847   HG13  VAL 105          3HG1      VAL 105  11.109 -14.477   5.623
  848   HG21  VAL 105          3HG2      VAL 105   9.371 -15.006   3.801
  849   HG22  VAL 105          1HG2      VAL 105  10.308 -16.423   3.332
  850   HG23  VAL 105          2HG2      VAL 105   9.927 -15.184   2.138
  851    H    ILE 106           H        ILE 106  13.161 -12.101   1.913
  852    HA   ILE 106           HA       ILE 106  11.796 -12.385  -0.640
  853    HB   ILE 106           HB       ILE 106  12.294 -10.126  -1.360
  854   HG12  ILE 106          1HG1      ILE 106  14.317  -9.679   0.030
  855   HG13  ILE 106          2HG1      ILE 106  13.190  -8.339   0.065
  856   HG21  ILE 106          1HG2      ILE 106  10.734 -10.094   1.193
  857   HG22  ILE 106          2HG2      ILE 106  10.131 -10.419  -0.432
  858   HG23  ILE 106          3HG2      ILE 106  10.729  -8.810  -0.016
  859   HD11  ILE 106          3HD1      ILE 106  13.644 -10.375   2.215
  860   HD12  ILE 106          1HD1      ILE 106  12.437  -9.093   2.270
  861   HD13  ILE 106          2HD1      ILE 106  14.152  -8.685   2.215
  862    HA   PRO 107           HA       PRO 107  15.992 -13.272  -2.014
  863    HB2  PRO 107           1HB      PRO 107  15.406 -11.664  -4.441
  864    HB3  PRO 107           2HB      PRO 107  15.926 -13.350  -4.323
  865    HG2  PRO 107           1HG      PRO 107  13.421 -12.743  -4.999
  866    HG3  PRO 107           2HG      PRO 107  13.766 -14.119  -3.935
  867    HD2  PRO 107           1HD      PRO 107  12.785 -11.385  -3.241
  868    HD3  PRO 107           2HD      PRO 107  12.267 -12.964  -2.602
  869    H    GLU 108           H        GLU 108  17.380 -12.095  -0.822
  870    HA   GLU 108           HA       GLU 108  17.532  -9.201  -1.141
  871    HB2  GLU 108           1HB      GLU 108  18.928 -11.044   0.830
  872    HB3  GLU 108           2HB      GLU 108  18.870  -9.285   0.903
  873    HG2  GLU 108           1HG      GLU 108  16.559  -9.284   1.387
  874    HG3  GLU 108           2HG      GLU 108  16.428 -11.008   1.055
  Start of MODEL   10
    1    HA   TYR   1           HA       TYR   1 -21.766  -0.582   0.616
    2    HD1  TYR   1           1HD      TYR   1 -20.580  -0.090  -2.033
    3    HD2  TYR   1           2HD      TYR   1 -21.881   3.638  -0.448
    4    HE1  TYR   1           1HE      TYR   1 -21.300   0.629  -4.282
    5    HE2  TYR   1           2HE      TYR   1 -22.605   4.347  -2.665
    6    HH   TYR   1           HH       TYR   1 -22.082   3.841  -4.983
    7    H1   TYR   1           1HT      TYR   1 -22.997   1.898   1.641
    8    H2   TYR   1           2HT      TYR   1 -23.639   0.360   1.745
    9    H3   TYR   1           3HT      TYR   1 -23.488   1.085   0.227
   10    HB2  TYR   1           1HB      TYR   1 -20.571   2.203   0.887
   11    HB3  TYR   1           2HB      TYR   1 -19.786   0.786   0.219
   12    H    THR   2           H        THR   2 -20.660  -1.671   2.239
   13    HA   THR   2           HA       THR   2 -19.713  -0.113   4.414
   14    HB   THR   2           HB       THR   2 -21.889  -0.703   5.321
   15    HG1  THR   2           1HG      THR   2 -19.696  -2.062   6.455
   16   HG21  THR   2          3HG2      THR   2 -22.438  -2.682   3.974
   17   HG22  THR   2          1HG2      THR   2 -22.616  -3.039   5.692
   18   HG23  THR   2          2HG2      THR   2 -21.199  -3.610   4.814
   19    H    ASP   3           H        ASP   3 -17.763  -0.431   3.837
   20    HA   ASP   3           HA       ASP   3 -15.771  -1.265   3.824
   21    HB2  ASP   3           1HB      ASP   3 -16.930  -3.650   5.250
   22    HB3  ASP   3           2HB      ASP   3 -15.200  -3.421   4.956
   23    H    LYS   4           H        LYS   4 -14.368  -3.272   3.120
   24    HA   LYS   4           HA       LYS   4 -13.342  -3.719   1.213
   25    HB2  LYS   4           1HB      LYS   4 -16.068  -4.766   0.416
   26    HB3  LYS   4           2HB      LYS   4 -14.657  -4.944  -0.618
   27    HG2  LYS   4           1HG      LYS   4 -13.536  -6.151   1.235
   28    HG3  LYS   4           2HG      LYS   4 -15.056  -6.078   2.127
   29    HD2  LYS   4           1HD      LYS   4 -16.158  -7.263   0.247
   30    HD3  LYS   4           2HD      LYS   4 -14.583  -7.393  -0.527
   31    HE2  LYS   4           1HE      LYS   4 -13.715  -8.708   1.273
   32    HE3  LYS   4           2HE      LYS   4 -15.172  -8.462   2.227
   33    HZ1  LYS   4           3HZ      LYS   4 -16.417  -9.738   0.636
   34    HZ2  LYS   4           1HZ      LYS   4 -15.090 -10.634   1.150
   35    HZ3  LYS   4           2HZ      LYS   4 -15.058  -9.902  -0.361
   36    H    TYR   5           H        TYR   5 -12.541  -2.346  -0.180
   37    HA   TYR   5           HA       TYR   5 -12.190  -0.415  -1.174
   38    HD1  TYR   5           1HD      TYR   5 -16.192   0.679  -2.244
   39    HD2  TYR   5           2HD      TYR   5 -14.550  -3.009  -3.592
   40    HE1  TYR   5           1HE      TYR   5 -18.458  -0.170  -2.672
   41    HE2  TYR   5           2HE      TYR   5 -16.805  -3.864  -4.018
   42    HH   TYR   5           HH       TYR   5 -19.554  -1.867  -4.065
   43    HB2  TYR   5           1HB      TYR   5 -13.784   0.423  -3.002
   44    HB3  TYR   5           2HB      TYR   5 -13.115  -1.159  -3.258
   45    H    ASP   6           H        ASP   6 -15.176  -0.411   0.324
   46    HA   ASP   6           HA       ASP   6 -15.478   2.360   0.535
   47    HB2  ASP   6           1HB      ASP   6 -17.426   1.107   0.631
   48    HB3  ASP   6           2HB      ASP   6 -16.765  -0.019   1.803
   49    H    LYS   7           H        LYS   7 -13.722   0.028   2.630
   50    HA   LYS   7           HA       LYS   7 -12.878   2.231   4.130
   51    HB2  LYS   7           1HB      LYS   7 -15.174   2.325   4.948
   52    HB3  LYS   7           2HB      LYS   7 -14.980   0.750   5.691
   53    HG2  LYS   7           1HG      LYS   7 -13.304   1.649   7.211
   54    HG3  LYS   7           2HG      LYS   7 -13.404   3.209   6.414
   55    HD2  LYS   7           1HD      LYS   7 -14.661   3.368   8.449
   56    HD3  LYS   7           2HD      LYS   7 -15.806   3.353   7.124
   57    HE2  LYS   7           1HE      LYS   7 -15.103   0.927   8.800
   58    HE3  LYS   7           2HE      LYS   7 -16.451   1.995   9.147
   59    HZ1  LYS   7           3HZ      LYS   7 -17.322   1.375   6.883
   60    HZ2  LYS   7           1HZ      LYS   7 -17.259   0.117   7.996
   61    HZ3  LYS   7           2HZ      LYS   7 -16.102   0.165   6.836
   62    H    ILE   8           H        ILE   8 -13.437  -0.627   6.208
   63    HA   ILE   8           HA       ILE   8 -10.560  -0.458   6.850
   64    HB   ILE   8           HB       ILE   8 -11.109  -2.051   8.702
   65   HG12  ILE   8          1HG1      ILE   8 -13.961  -1.637   7.829
   66   HG13  ILE   8          2HG1      ILE   8 -13.064  -3.101   7.496
   67   HG21  ILE   8          1HG2      ILE   8 -12.312  -0.466  10.084
   68   HG22  ILE   8          2HG2      ILE   8 -12.857   0.399   8.658
   69   HG23  ILE   8          3HG2      ILE   8 -11.140   0.379   9.071
   70   HD11  ILE   8          3HD1      ILE   8 -12.893  -3.466   9.946
   71   HD12  ILE   8          1HD1      ILE   8 -14.563  -3.375   9.389
   72   HD13  ILE   8          2HD1      ILE   8 -13.826  -1.991  10.201
   73    H    ASN   9           H        ASN   9 -10.994  -1.471   4.459
   74    HA   ASN   9           HA       ASN   9 -10.927  -4.413   4.543
   75    HB2  ASN   9           1HB      ASN   9 -11.304  -4.214   2.147
   76    HB3  ASN   9           2HB      ASN   9 -12.521  -3.366   3.095
   77   HD21  ASN   9          1HD2      ASN   9  -9.579  -2.851   1.309
   78   HD22  ASN   9          2HD2      ASN   9  -9.845  -1.261   0.794
   79    H    LEU  10           H        LEU  10  -8.467  -2.905   5.313
   80    HA   LEU  10           HA       LEU  10  -7.021  -2.422   2.886
   81    HG   LEU  10           HG       LEU  10  -5.725   0.127   5.226
   82    HB2  LEU  10           1HB      LEU  10  -5.917  -2.393   5.704
   83    HB3  LEU  10           2HB      LEU  10  -5.079  -1.858   4.270
   84   HD11  LEU  10          1HD1      LEU  10  -7.919  -0.444   3.308
   85   HD12  LEU  10          2HD1      LEU  10  -6.296   0.144   2.947
   86   HD13  LEU  10          3HD1      LEU  10  -7.406   1.144   3.880
   87   HD21  LEU  10          3HD2      LEU  10  -7.820   0.622   6.286
   88   HD22  LEU  10          1HD2      LEU  10  -7.128  -0.848   6.986
   89   HD23  LEU  10          2HD2      LEU  10  -8.481  -0.958   5.831
   90    H    GLN  11           H        GLN  11  -7.185  -4.927   5.196
   91    HA   GLN  11           HA       GLN  11  -5.070  -6.316   3.838
   92    HB2  GLN  11           1HB      GLN  11  -6.641  -6.933   6.293
   93    HB3  GLN  11           2HB      GLN  11  -5.525  -8.084   5.563
   94    HG2  GLN  11           1HG      GLN  11  -4.811  -5.310   6.475
   95    HG3  GLN  11           2HG      GLN  11  -4.484  -6.795   7.369
   96   HE21  GLN  11          1HE2      GLN  11  -3.595  -4.906   4.465
   97   HE22  GLN  11          2HE2      GLN  11  -2.117  -5.723   4.249
   98    H    GLU  12           H        GLU  12  -8.541  -6.236   3.849
   99    HA   GLU  12           HA       GLU  12  -8.964  -8.952   3.040
  100    HB2  GLU  12           1HB      GLU  12 -10.716  -6.489   2.904
  101    HB3  GLU  12           2HB      GLU  12 -11.249  -8.072   2.383
  102    HG2  GLU  12           1HG      GLU  12 -12.111  -7.532   4.579
  103    HG3  GLU  12           2HG      GLU  12 -11.012  -8.903   4.673
  104    H    ILE  13           H        ILE  13  -8.889  -5.868   1.557
  105    HA   ILE  13           HA       ILE  13  -9.346  -6.777  -1.068
  106    HB   ILE  13           HB       ILE  13  -8.488  -4.197   0.151
  107   HG12  ILE  13          1HG1      ILE  13 -10.857  -4.660   0.315
  108   HG13  ILE  13          2HG1      ILE  13 -10.583  -3.349  -0.834
  109   HG21  ILE  13          1HG2      ILE  13  -8.631  -4.740  -2.763
  110   HG22  ILE  13          2HG2      ILE  13  -7.237  -4.260  -1.780
  111   HG23  ILE  13          3HG2      ILE  13  -8.572  -3.135  -2.024
  112   HD11  ILE  13          3HD1      ILE  13 -10.767  -5.039  -2.622
  113   HD12  ILE  13          1HD1      ILE  13 -12.264  -4.717  -1.719
  114   HD13  ILE  13          2HD1      ILE  13 -11.337  -6.166  -1.369
  115    H    LEU  14           H        LEU  14  -6.411  -5.727   0.700
  116    HA   LEU  14           HA       LEU  14  -4.670  -5.863  -1.463
  117    HG   LEU  14           HG       LEU  14  -2.078  -6.602   0.047
  118    HB2  LEU  14           1HB      LEU  14  -4.304  -4.667   0.642
  119    HB3  LEU  14           2HB      LEU  14  -4.082  -6.198   1.450
  120   HD11  LEU  14          1HD1      LEU  14  -2.655  -3.820  -0.924
  121   HD12  LEU  14          2HD1      LEU  14  -2.557  -5.317  -1.881
  122   HD13  LEU  14          3HD1      LEU  14  -1.122  -4.665  -1.117
  123   HD21  LEU  14          3HD2      LEU  14  -1.882  -5.681   2.256
  124   HD22  LEU  14          1HD2      LEU  14  -2.155  -4.059   1.617
  125   HD23  LEU  14          2HD2      LEU  14  -0.694  -4.945   1.181
  126    H    GLU  15           H        GLU  15  -5.897  -8.397   0.527
  127    HA   GLU  15           HA       GLU  15  -3.831 -10.229   0.032
  128    HB2  GLU  15           1HB      GLU  15  -5.236 -10.526   1.892
  129    HB3  GLU  15           2HB      GLU  15  -6.696 -10.629   0.903
  130    HG2  GLU  15           1HG      GLU  15  -5.868 -12.738  -0.040
  131    HG3  GLU  15           2HG      GLU  15  -4.421 -12.606   0.954
  132    H    ASN  16           H        ASN  16  -6.276  -9.079  -2.057
  133    HA   ASN  16           HA       ASN  16  -5.657 -11.239  -3.965
  134    HB2  ASN  16           1HB      ASN  16  -8.391 -10.087  -3.391
  135    HB3  ASN  16           2HB      ASN  16  -8.021 -11.032  -4.820
  136   HD21  ASN  16          1HD2      ASN  16  -8.569 -11.077  -1.424
  137   HD22  ASN  16          2HD2      ASN  16  -8.696 -12.787  -1.259
  138    H    LYS  17           H        LYS  17  -4.950 -10.354  -5.940
  139    HA   LYS  17           HA       LYS  17  -4.983  -7.534  -6.131
  140    HB2  LYS  17           1HB      LYS  17  -3.887  -7.593  -8.248
  141    HB3  LYS  17           2HB      LYS  17  -3.200  -8.886  -7.289
  142    HG2  LYS  17           1HG      LYS  17  -5.385  -9.366  -9.288
  143    HG3  LYS  17           2HG      LYS  17  -3.689  -9.319  -9.757
  144    HD2  LYS  17           1HD      LYS  17  -4.868 -11.142  -7.686
  145    HD3  LYS  17           2HD      LYS  17  -4.608 -11.581  -9.366
  146    HE2  LYS  17           1HE      LYS  17  -2.488 -10.860  -7.319
  147    HE3  LYS  17           2HE      LYS  17  -2.760 -12.428  -8.067
  148    HZ1  LYS  17           3HZ      LYS  17  -2.194 -11.315 -10.251
  149    HZ2  LYS  17           1HZ      LYS  17  -0.932 -11.431  -9.137
  150    HZ3  LYS  17           2HZ      LYS  17  -1.690  -9.977  -9.329
  151    H    ARG  18           H        ARG  18  -7.142  -9.847  -7.115
  152    HA   ARG  18           HA       ARG  18  -8.619  -8.213  -8.910
  153    HE   ARG  18           HE       ARG  18  -8.635 -13.091  -5.531
  154    HB2  ARG  18           1HB      ARG  18 -10.537  -9.854  -8.502
  155    HB3  ARG  18           2HB      ARG  18  -9.070 -10.490  -9.212
  156    HG2  ARG  18           1HG      ARG  18  -9.559 -10.744  -6.261
  157    HG3  ARG  18           2HG      ARG  18 -10.328 -11.856  -7.388
  158    HD2  ARG  18           1HD      ARG  18  -8.018 -12.367  -8.300
  159    HD3  ARG  18           2HD      ARG  18  -7.343 -11.445  -6.965
  160   HH11  ARG  18          1HH1      ARG  18  -7.312 -13.981  -8.702
  161   HH12  ARG  18          2HH1      ARG  18  -6.954 -15.575  -8.251
  162   HH21  ARG  18          1HH2      ARG  18  -8.126 -15.262  -4.921
  163   HH22  ARG  18          2HH2      ARG  18  -7.437 -16.323  -6.046
  164    H    LEU  19           H        LEU  19  -8.683  -8.691  -5.465
  165    HA   LEU  19           HA       LEU  19 -10.960  -7.017  -5.191
  166    HG   LEU  19           HG       LEU  19 -10.474  -9.874  -3.921
  167    HB2  LEU  19           1HB      LEU  19  -9.023  -8.080  -3.145
  168    HB3  LEU  19           2HB      LEU  19 -10.410  -7.085  -2.770
  169   HD11  LEU  19          1HD1      LEU  19  -9.991  -9.709  -1.519
  170   HD12  LEU  19          2HD1      LEU  19 -11.554 -10.456  -1.847
  171   HD13  LEU  19          3HD1      LEU  19 -11.475  -8.781  -1.299
  172   HD21  LEU  19          3HD2      LEU  19 -12.267  -8.595  -4.930
  173   HD22  LEU  19          1HD2      LEU  19 -12.735  -7.963  -3.347
  174   HD23  LEU  19          2HD2      LEU  19 -12.921  -9.672  -3.700
  175    H    LEU  20           H        LEU  20  -7.551  -6.679  -5.363
  176    HA   LEU  20           HA       LEU  20  -7.285  -4.044  -4.409
  177    HG   LEU  20           HG       LEU  20  -5.314  -6.266  -4.119
  178    HB2  LEU  20           1HB      LEU  20  -5.746  -5.645  -6.448
  179    HB3  LEU  20           2HB      LEU  20  -5.317  -3.974  -6.091
  180   HD11  LEU  20          1HD1      LEU  20  -3.470  -6.393  -5.797
  181   HD12  LEU  20          2HD1      LEU  20  -2.897  -6.036  -4.174
  182   HD13  LEU  20          3HD1      LEU  20  -3.027  -4.746  -5.363
  183   HD21  LEU  20          3HD2      LEU  20  -5.856  -4.222  -3.037
  184   HD22  LEU  20          1HD2      LEU  20  -4.576  -3.372  -3.899
  185   HD23  LEU  20          2HD2      LEU  20  -4.148  -4.572  -2.705
  186    H    GLU  21           H        GLU  21  -7.954  -5.367  -7.554
  187    HA   GLU  21           HA       GLU  21  -8.416  -3.063  -8.979
  188    HB2  GLU  21           1HB      GLU  21  -9.518  -5.821  -9.109
  189    HB3  GLU  21           2HB      GLU  21 -10.098  -4.580 -10.202
  190    HG2  GLU  21           1HG      GLU  21  -7.214  -5.363  -9.894
  191    HG3  GLU  21           2HG      GLU  21  -8.300  -6.003 -11.131
  192    H    SER  22           H        SER  22 -10.519  -4.712  -6.689
  193    HA   SER  22           HA       SER  22 -12.809  -3.205  -7.298
  194    HG   SER  22           HG       SER  22 -12.420  -5.579  -7.067
  195    HB2  SER  22           1HB      SER  22 -12.156  -4.544  -4.646
  196    HB3  SER  22           2HB      SER  22 -13.744  -4.084  -5.261
  197    H    TYR  23           H        TYR  23 -10.273  -2.629  -4.752
  198    HA   TYR  23           HA       TYR  23 -11.600  -0.062  -4.351
  199    HD1  TYR  23           2HD      TYR  23  -8.034  -1.458  -4.244
  200    HD2  TYR  23           1HD      TYR  23  -9.113  -0.185  -0.353
  201    HE1  TYR  23           2HE      TYR  23  -5.691  -1.663  -3.523
  202    HE2  TYR  23           1HE      TYR  23  -6.832  -0.343   0.410
  203    HH   TYR  23           HH       TYR  23  -4.231  -0.757  -1.799
  204    HB2  TYR  23           1HB      TYR  23 -10.441   0.370  -2.368
  205    HB3  TYR  23           2HB      TYR  23 -10.829  -1.281  -2.108
  206    H    MET  24           H        MET  24  -9.817  -0.984  -6.594
  207    HA   MET  24           HA       MET  24  -7.726   0.803  -6.743
  208    HB2  MET  24           1HB      MET  24  -9.162  -0.731  -8.804
  209    HB3  MET  24           2HB      MET  24  -8.246   0.685  -9.325
  210    HG2  MET  24           1HG      MET  24  -7.152  -1.613  -7.734
  211    HG3  MET  24           2HG      MET  24  -6.884  -1.320  -9.456
  212    HE1  MET  24           3HE      MET  24  -4.500  -1.728  -7.382
  213    HE2  MET  24           1HE      MET  24  -4.271  -1.433  -9.103
  214    HE3  MET  24           2HE      MET  24  -3.398  -0.462  -7.917
  215    H    ASP  25           H        ASP  25 -11.007   1.559  -6.974
  216    HA   ASP  25           HA       ASP  25 -10.816   3.995  -8.415
  217    HB2  ASP  25           1HB      ASP  25 -12.963   3.174  -7.974
  218    HB3  ASP  25           2HB      ASP  25 -12.671   3.104  -6.244
  219    H    CYS  26           H        CYS  26 -10.431   3.251  -5.026
  220    HA   CYS  26           HA       CYS  26  -9.955   5.984  -4.504
  221    HB2  CYS  26           1HB      CYS  26  -9.371   4.903  -2.151
  222    HB3  CYS  26           2HB      CYS  26 -11.031   5.169  -2.695
  223    H    VAL  27           H        VAL  27  -7.954   3.212  -5.088
  224    HA   VAL  27           HA       VAL  27  -5.607   4.655  -4.247
  225    HB   VAL  27           HB       VAL  27  -5.865   2.020  -5.719
  226   HG11  VAL  27          1HG1      VAL  27  -3.751   3.076  -6.234
  227   HG12  VAL  27          2HG1      VAL  27  -3.410   3.313  -4.516
  228   HG13  VAL  27          3HG1      VAL  27  -3.497   1.678  -5.191
  229   HG21  VAL  27          3HG2      VAL  27  -5.239   1.046  -3.559
  230   HG22  VAL  27          1HG2      VAL  27  -6.735   1.973  -3.448
  231   HG23  VAL  27          2HG2      VAL  27  -5.229   2.659  -2.841
  232    H    LEU  28           H        LEU  28  -6.799   3.512  -7.417
  233    HA   LEU  28           HA       LEU  28  -4.972   5.392  -8.724
  234    HG   LEU  28           HG       LEU  28  -4.020   2.464 -10.756
  235    HB2  LEU  28           1HB      LEU  28  -6.041   2.761  -9.435
  236    HB3  LEU  28           2HB      LEU  28  -5.972   3.907 -10.743
  237   HD11  LEU  28          1HD1      LEU  28  -3.288   5.246  -9.901
  238   HD12  LEU  28          2HD1      LEU  28  -3.747   4.735 -11.523
  239   HD13  LEU  28          3HD1      LEU  28  -2.259   4.119 -10.792
  240   HD21  LEU  28          3HD2      LEU  28  -3.331   3.612  -8.079
  241   HD22  LEU  28          1HD2      LEU  28  -2.400   2.435  -9.001
  242   HD23  LEU  28          2HD2      LEU  28  -3.977   1.979  -8.330
  243    H    GLY  29           H        GLY  29  -8.339   4.612  -8.457
  244    HA2  GLY  29           1HA      GLY  29 -10.027   6.295  -8.895
  245    HA3  GLY  29           2HA      GLY  29  -9.001   6.921 -10.183
  246    H    LYS  30           H        LYS  30  -9.627   3.524  -9.625
  247    HA   LYS  30           HA       LYS  30 -10.607   3.361 -12.367
  248    HB2  LYS  30           1HB      LYS  30  -9.703   1.127 -10.572
  249    HB3  LYS  30           2HB      LYS  30 -10.072   1.012 -12.287
  250    HG2  LYS  30           1HG      LYS  30  -8.203   2.533 -12.797
  251    HG3  LYS  30           2HG      LYS  30  -7.888   2.645 -11.059
  252    HD2  LYS  30           1HD      LYS  30  -6.322   1.100 -12.162
  253    HD3  LYS  30           2HD      LYS  30  -7.314   0.263 -10.984
  254    HE2  LYS  30           1HE      LYS  30  -8.766  -0.530 -12.817
  255    HE3  LYS  30           2HE      LYS  30  -7.707   0.274 -13.976
  256    HZ1  LYS  30           3HZ      LYS  30  -5.877  -1.170 -13.119
  257    HZ2  LYS  30           1HZ      LYS  30  -7.138  -2.048 -13.812
  258    HZ3  LYS  30           2HZ      LYS  30  -7.012  -1.978 -12.163
  259    H    GLY  31           H        GLY  31 -11.472   1.259  -9.563
  260    HA2  GLY  31           1HA      GLY  31 -14.058   0.701 -10.691
  261    HA3  GLY  31           2HA      GLY  31 -13.450   0.115  -9.158
  262    H    LYS  32           H        LYS  32 -14.483   0.873  -7.337
  263    HA   LYS  32           HA       LYS  32 -15.339   3.591  -7.229
  264    HB2  LYS  32           1HB      LYS  32 -17.707   3.040  -6.611
  265    HB3  LYS  32           2HB      LYS  32 -17.306   2.799  -8.302
  266    HG2  LYS  32           1HG      LYS  32 -17.165   0.401  -7.953
  267    HG3  LYS  32           2HG      LYS  32 -17.471   0.619  -6.228
  268    HD2  LYS  32           1HD      LYS  32 -19.661   1.466  -6.653
  269    HD3  LYS  32           2HD      LYS  32 -19.357   1.513  -8.390
  270    HE2  LYS  32           1HE      LYS  32 -19.412  -0.978  -6.698
  271    HE3  LYS  32           2HE      LYS  32 -20.749  -0.415  -7.699
  272    HZ1  LYS  32           3HZ      LYS  32 -19.536  -2.077  -8.869
  273    HZ2  LYS  32           1HZ      LYS  32 -18.071  -1.288  -8.618
  274    HZ3  LYS  32           2HZ      LYS  32 -19.208  -0.601  -9.629
  275    H    CYS  33           H        CYS  33 -14.686   4.261  -5.338
  276    HA   CYS  33           HA       CYS  33 -15.188   2.621  -2.948
  277    HB2  CYS  33           1HB      CYS  33 -13.014   4.685  -3.419
  278    HB3  CYS  33           2HB      CYS  33 -13.262   3.767  -1.942
  279    H    THR  34           H        THR  34 -15.614   4.116  -0.993
  280    HA   THR  34           HA       THR  34 -17.263   6.303  -1.786
  281    HB   THR  34           HB       THR  34 -17.579   6.360   0.754
  282    HG1  THR  34           1HG      THR  34 -16.841   4.152   1.593
  283   HG21  THR  34          3HG2      THR  34 -19.147   5.204  -0.766
  284   HG22  THR  34          1HG2      THR  34 -18.963   4.323   0.750
  285   HG23  THR  34          2HG2      THR  34 -18.136   3.761  -0.700
  286    HA   PRO  35           HA       PRO  35 -14.475   9.736  -0.973
  287    HB2  PRO  35           1HB      PRO  35 -16.052  10.481   1.435
  288    HB3  PRO  35           2HB      PRO  35 -15.603  11.470   0.041
  289    HG2  PRO  35           1HG      PRO  35 -18.084  10.568   0.354
  290    HG3  PRO  35           2HG      PRO  35 -17.347  10.645  -1.254
  291    HD2  PRO  35           1HD      PRO  35 -17.861   8.316   0.496
  292    HD3  PRO  35           2HD      PRO  35 -17.883   8.440  -1.277
  293    H    GLU  36           H        GLU  36 -15.632   8.230   1.979
  294    HA   GLU  36           HA       GLU  36 -13.518   8.835   3.695
  295    HB2  GLU  36           1HB      GLU  36 -15.814   7.877   4.250
  296    HB3  GLU  36           2HB      GLU  36 -15.191   6.327   3.735
  297    HG2  GLU  36           1HG      GLU  36 -15.112   6.515   6.152
  298    HG3  GLU  36           2HG      GLU  36 -13.488   6.392   5.475
  299    H    GLY  37           H        GLY  37 -14.154   6.076   1.584
  300    HA2  GLY  37           1HA      GLY  37 -11.919   4.541   2.254
  301    HA3  GLY  37           2HA      GLY  37 -12.861   4.411   0.776
  302    H    LYS  38           H        LYS  38 -12.470   6.912  -0.290
  303    HA   LYS  38           HA       LYS  38 -10.134   6.629  -1.740
  304    HB2  LYS  38           1HB      LYS  38 -11.888   9.011  -1.256
  305    HB3  LYS  38           2HB      LYS  38 -10.466   9.105  -2.277
  306    HG2  LYS  38           1HG      LYS  38 -11.413   7.296  -3.656
  307    HG3  LYS  38           2HG      LYS  38 -12.886   7.363  -2.696
  308    HD2  LYS  38           1HD      LYS  38 -13.343   9.608  -3.336
  309    HD3  LYS  38           2HD      LYS  38 -11.755   9.804  -4.070
  310    HE2  LYS  38           1HE      LYS  38 -13.515   9.598  -5.765
  311    HE3  LYS  38           2HE      LYS  38 -12.388   8.255  -5.855
  312    HZ1  LYS  38           3HZ      LYS  38 -13.924   6.790  -5.120
  313    HZ2  LYS  38           1HZ      LYS  38 -14.860   7.796  -6.033
  314    HZ3  LYS  38           2HZ      LYS  38 -14.939   7.934  -4.352
  315    H    GLU  39           H        GLU  39 -10.666   8.702   1.011
  316    HA   GLU  39           HA       GLU  39  -8.059   9.866   0.651
  317    HB2  GLU  39           1HB      GLU  39 -10.104  10.328   2.805
  318    HB3  GLU  39           2HB      GLU  39  -8.699  11.342   2.470
  319    HG2  GLU  39           1HG      GLU  39  -9.590  11.835   0.246
  320    HG3  GLU  39           2HG      GLU  39 -10.986  10.819   0.592
  321    H    LEU  40           H        LEU  40  -9.549   7.502   2.720
  322    HA   LEU  40           HA       LEU  40  -7.460   7.561   4.645
  323    HG   LEU  40           HG       LEU  40  -9.764   4.805   3.231
  324    HB2  LEU  40           1HB      LEU  40  -8.590   5.890   5.795
  325    HB3  LEU  40           2HB      LEU  40  -9.859   6.731   4.988
  326   HD11  LEU  40          1HD1      LEU  40  -8.429   3.385   5.558
  327   HD12  LEU  40          2HD1      LEU  40  -7.706   3.707   3.984
  328   HD13  LEU  40          3HD1      LEU  40  -9.053   2.613   4.101
  329   HD21  LEU  40          3HD2      LEU  40 -10.806   4.359   6.022
  330   HD22  LEU  40          1HD2      LEU  40 -11.297   3.463   4.584
  331   HD23  LEU  40          2HD2      LEU  40 -11.639   5.188   4.702
  332    H    LYS  41           H        LYS  41  -8.152   5.602   1.810
  333    HA   LYS  41           HA       LYS  41  -5.934   3.863   2.252
  334    HB2  LYS  41           1HB      LYS  41  -7.760   4.286  -0.106
  335    HB3  LYS  41           2HB      LYS  41  -6.477   3.079  -0.064
  336    HG2  LYS  41           1HG      LYS  41  -7.541   1.762   1.404
  337    HG3  LYS  41           2HG      LYS  41  -8.473   3.009   2.179
  338    HD2  LYS  41           1HD      LYS  41  -9.768   3.211   0.068
  339    HD3  LYS  41           2HD      LYS  41  -8.884   1.814  -0.536
  340    HE2  LYS  41           1HE      LYS  41 -10.948   1.013   0.344
  341    HE3  LYS  41           2HE      LYS  41  -9.697   0.578   1.506
  342    HZ1  LYS  41           3HZ      LYS  41 -10.365   2.662   2.732
  343    HZ2  LYS  41           1HZ      LYS  41 -11.492   1.395   2.709
  344    HZ3  LYS  41           2HZ      LYS  41 -11.714   2.702   1.691
  345    H    ASP  42           H        ASP  42  -6.485   6.832   0.569
  346    HA   ASP  42           HA       ASP  42  -4.209   6.900  -1.035
  347    HB2  ASP  42           1HB      ASP  42  -5.868   8.610  -1.305
  348    HB3  ASP  42           2HB      ASP  42  -5.705   9.116   0.370
  349    H    HIS  43           H        HIS  43  -4.635   8.039   2.310
  350    HA   HIS  43           HA       HIS  43  -1.807   8.518   2.511
  351    HD1  HIS  43           1HD      HIS  43  -0.841  10.764   3.490
  352    HD2  HIS  43           2HD      HIS  43  -4.975  11.234   3.558
  353    HE1  HIS  43           1HE      HIS  43  -1.258  13.136   2.824
  354    HE2  HIS  43           2HE      HIS  43  -3.727  13.469   3.089
  355    HB2  HIS  43           1HB      HIS  43  -4.024   8.871   4.448
  356    HB3  HIS  43           2HB      HIS  43  -2.350   8.961   4.997
  357    H    LEU  44           H        LEU  44  -3.844   5.871   3.447
  358    HA   LEU  44           HA       LEU  44  -1.922   4.789   5.264
  359    HG   LEU  44           HG       LEU  44  -2.749   2.629   6.377
  360    HB2  LEU  44           1HB      LEU  44  -4.386   4.442   5.416
  361    HB3  LEU  44           2HB      LEU  44  -4.315   3.479   3.964
  362   HD11  LEU  44          1HD1      LEU  44  -4.732   1.336   7.083
  363   HD12  LEU  44          2HD1      LEU  44  -5.691   2.172   5.854
  364   HD13  LEU  44          3HD1      LEU  44  -4.998   3.075   7.198
  365   HD21  LEU  44          3HD2      LEU  44  -3.217   0.412   5.449
  366   HD22  LEU  44          1HD2      LEU  44  -2.418   1.445   4.265
  367   HD23  LEU  44          2HD2      LEU  44  -4.149   1.152   4.145
  368    H    GLN  45           H        GLN  45  -2.937   3.899   1.954
  369    HA   GLN  45           HA       GLN  45  -0.816   2.094   1.647
  370    HB2  GLN  45           1HB      GLN  45  -2.801   3.322  -0.219
  371    HB3  GLN  45           2HB      GLN  45  -1.357   2.613  -0.928
  372    HG2  GLN  45           1HG      GLN  45  -3.268   1.045  -0.914
  373    HG3  GLN  45           2HG      GLN  45  -1.905   0.442   0.006
  374   HE21  GLN  45          1HE2      GLN  45  -3.258  -1.029   1.105
  375   HE22  GLN  45          2HE2      GLN  45  -4.274  -0.539   2.388
  376    H    GLU  46           H        GLU  46  -1.016   5.532   1.344
  377    HA   GLU  46           HA       GLU  46   1.472   6.044   0.145
  378    HB2  GLU  46           1HB      GLU  46  -0.091   7.807   0.591
  379    HB3  GLU  46           2HB      GLU  46  -0.030   7.498   2.320
  380    HG2  GLU  46           1HG      GLU  46   2.376   8.153   2.220
  381    HG3  GLU  46           2HG      GLU  46   2.100   8.697   0.574
  382    H    ALA  47           H        ALA  47   0.559   5.508   3.559
  383    HA   ALA  47           HA       ALA  47   3.028   5.860   4.806
  384    HB1  ALA  47           3HB      ALA  47   0.904   3.908   5.626
  385    HB2  ALA  47           1HB      ALA  47   2.192   4.543   6.632
  386    HB3  ALA  47           2HB      ALA  47   0.907   5.634   6.055
  387    H    LEU  48           H        LEU  48   1.782   3.204   3.065
  388    HA   LEU  48           HA       LEU  48   3.428   1.110   3.742
  389    HG   LEU  48           HG       LEU  48   2.971  -0.909   2.091
  390    HB2  LEU  48           1HB      LEU  48   1.537   1.174   2.079
  391    HB3  LEU  48           2HB      LEU  48   2.636   1.871   0.929
  392   HD11  LEU  48          1HD1      LEU  48   0.859  -0.644   0.868
  393   HD12  LEU  48          2HD1      LEU  48   1.989  -1.714   0.051
  394   HD13  LEU  48          3HD1      LEU  48   1.760  -0.062  -0.529
  395   HD21  LEU  48          3HD2      LEU  48   4.411  -1.286   0.158
  396   HD22  LEU  48          1HD2      LEU  48   5.030   0.063   1.110
  397   HD23  LEU  48          2HD2      LEU  48   4.152   0.370  -0.391
  398    H    GLU  49           H        GLU  49   4.294   3.955   1.722
  399    HA   GLU  49           HA       GLU  49   7.078   3.476   2.262
  400    HB2  GLU  49           1HB      GLU  49   6.301   1.932   0.239
  401    HB3  GLU  49           2HB      GLU  49   6.504   3.418  -0.671
  402    HG2  GLU  49           1HG      GLU  49   8.598   2.166   1.043
  403    HG3  GLU  49           2HG      GLU  49   8.491   1.894  -0.703
  404    H    THR  50           H        THR  50   4.920   5.016  -0.088
  405    HA   THR  50           HA       THR  50   6.517   7.157  -0.793
  406    HB   THR  50           HB       THR  50   3.501   7.040  -0.839
  407    HG1  THR  50           1HG      THR  50   5.238   6.014  -2.854
  408   HG21  THR  50          3HG2      THR  50   4.536   9.158  -1.599
  409   HG22  THR  50          1HG2      THR  50   3.766   8.294  -2.930
  410   HG23  THR  50          2HG2      THR  50   5.518   8.257  -2.757
  411    H    GLY  51           H        GLY  51   4.733   6.703   2.059
  412    HA2  GLY  51           1HA      GLY  51   4.896   9.593   2.699
  413    HA3  GLY  51           2HA      GLY  51   3.703   8.526   3.423
  414    H    CYS  52           H        CYS  52   4.177   7.384   5.169
  415    HA   CYS  52           HA       CYS  52   6.871   6.879   5.824
  416    HB2  CYS  52           1HB      CYS  52   6.913   8.091   7.978
  417    HB3  CYS  52           2HB      CYS  52   6.833   9.150   6.578
  418    H    GLU  53           H        GLU  53   6.961   5.001   6.614
  419    HA   GLU  53           HA       GLU  53   4.689   3.653   7.770
  420    HB2  GLU  53           1HB      GLU  53   7.372   2.405   7.901
  421    HB3  GLU  53           2HB      GLU  53   5.869   1.729   7.312
  422    HG2  GLU  53           1HG      GLU  53   7.222   1.706   5.434
  423    HG3  GLU  53           2HG      GLU  53   6.310   3.194   5.213
  424    H    LYS  54           H        LYS  54   7.710   5.012   8.497
  425    HA   LYS  54           HA       LYS  54   7.948   4.160  11.217
  426    HB2  LYS  54           1HB      LYS  54   9.947   5.723  11.201
  427    HB3  LYS  54           2HB      LYS  54   9.962   4.415  10.034
  428    HG2  LYS  54           1HG      LYS  54  10.780   6.263   8.850
  429    HG3  LYS  54           2HG      LYS  54   9.118   6.127   8.317
  430    HD2  LYS  54           1HD      LYS  54   9.512   8.433   8.670
  431    HD3  LYS  54           2HD      LYS  54   8.575   7.902  10.064
  432    HE2  LYS  54           1HE      LYS  54  10.400   9.351  10.761
  433    HE3  LYS  54           2HE      LYS  54  10.639   7.713  11.365
  434    HZ1  LYS  54           3HZ      LYS  54  12.010   8.928   9.009
  435    HZ2  LYS  54           1HZ      LYS  54  12.218   7.334   9.514
  436    HZ3  LYS  54           2HZ      LYS  54  12.713   8.593  10.489
  437    H    CYS  55           H        CYS  55   5.619   5.932  10.405
  438    HA   CYS  55           HA       CYS  55   6.114   8.188  12.151
  439    HB2  CYS  55           1HB      CYS  55   4.017   7.667  10.106
  440    HB3  CYS  55           2HB      CYS  55   3.724   8.885  11.336
  441    H    THR  56           H        THR  56   2.769   7.749  12.302
  442    HA   THR  56           HA       THR  56   3.039   7.228  15.115
  443    HB   THR  56           HB       THR  56   0.577   7.952  14.909
  444    HG1  THR  56           1HG      THR  56   0.184   9.104  12.975
  445   HG21  THR  56          3HG2      THR  56   2.380   9.401  15.789
  446   HG22  THR  56          1HG2      THR  56   1.241  10.326  14.813
  447   HG23  THR  56          2HG2      THR  56   2.803   9.864  14.141
  448    H    GLU  57           H        GLU  57   1.072   6.025  16.030
  449    HA   GLU  57           HA       GLU  57   1.246   3.353  15.508
  450    HB2  GLU  57           1HB      GLU  57   0.358   4.243  17.559
  451    HB3  GLU  57           2HB      GLU  57  -1.030   4.891  16.703
  452    HG2  GLU  57           1HG      GLU  57  -1.765   2.628  16.179
  453    HG3  GLU  57           2HG      GLU  57  -0.372   1.983  17.049
  454    H    ALA  58           H        ALA  58  -1.409   5.460  14.410
  455    HA   ALA  58           HA       ALA  58  -2.800   3.359  13.132
  456    HB1  ALA  58           3HB      ALA  58  -3.891   5.476  13.808
  457    HB2  ALA  58           1HB      ALA  58  -3.011   6.300  12.518
  458    HB3  ALA  58           2HB      ALA  58  -4.192   5.063  12.117
  459    H    GLN  59           H        GLN  59  -0.387   5.620  12.036
  460    HA   GLN  59           HA       GLN  59  -0.664   4.861   9.304
  461    HB2  GLN  59           1HB      GLN  59   1.564   6.368  10.657
  462    HB3  GLN  59           2HB      GLN  59   1.429   6.105   8.924
  463    HG2  GLN  59           1HG      GLN  59  -0.742   7.321   8.982
  464    HG3  GLN  59           2HG      GLN  59  -0.427   7.690  10.679
  465   HE21  GLN  59          1HE2      GLN  59   2.047   7.582   8.189
  466   HE22  GLN  59          2HE2      GLN  59   2.392   9.253   8.196
  467    H    GLU  60           H        GLU  60   1.669   4.078  11.879
  468    HA   GLU  60           HA       GLU  60   3.231   2.504  10.213
  469    HB2  GLU  60           1HB      GLU  60   4.255   1.510  12.219
  470    HB3  GLU  60           2HB      GLU  60   4.161   3.254  12.308
  471    HG2  GLU  60           1HG      GLU  60   2.522   3.202  13.921
  472    HG3  GLU  60           2HG      GLU  60   2.093   1.521  13.632
  473    H    LYS  61           H        LYS  61   0.453   1.618  12.218
  474    HA   LYS  61           HA       LYS  61   0.718  -1.155  11.696
  475    HB2  LYS  61           1HB      LYS  61  -1.709   0.390  12.627
  476    HB3  LYS  61           2HB      LYS  61  -1.625  -1.363  12.532
  477    HG2  LYS  61           1HG      LYS  61   0.041   0.425  14.300
  478    HG3  LYS  61           2HG      LYS  61  -1.262  -0.652  14.805
  479    HD2  LYS  61           1HD      LYS  61   0.050  -2.589  14.029
  480    HD3  LYS  61           2HD      LYS  61   1.356  -1.502  13.555
  481    HE2  LYS  61           1HE      LYS  61   1.876  -2.488  15.682
  482    HE3  LYS  61           2HE      LYS  61   1.556  -0.767  15.892
  483    HZ1  LYS  61           3HZ      LYS  61  -0.695  -1.350  16.646
  484    HZ2  LYS  61           1HZ      LYS  61   0.499  -2.057  17.609
  485    HZ3  LYS  61           2HZ      LYS  61  -0.326  -2.984  16.479
  486    H    GLY  62           H        GLY  62  -1.067   1.438  10.146
  487    HA2  GLY  62           1HA      GLY  62  -2.380  -0.225   8.254
  488    HA3  GLY  62           2HA      GLY  62  -2.109   1.536   8.120
  489    H    ALA  63           H        ALA  63   0.715   1.341   8.399
  490    HA   ALA  63           HA       ALA  63   1.457   0.894   5.738
  491    HB1  ALA  63           3HB      ALA  63   2.582   2.515   7.187
  492    HB2  ALA  63           1HB      ALA  63   3.218   1.188   8.158
  493    HB3  ALA  63           2HB      ALA  63   3.714   1.364   6.476
  494    H    GLU  64           H        GLU  64   1.984  -0.991   8.738
  495    HA   GLU  64           HA       GLU  64   3.767  -2.728   7.388
  496    HB2  GLU  64           1HB      GLU  64   3.793  -4.127   9.385
  497    HB3  GLU  64           2HB      GLU  64   4.023  -2.440   9.791
  498    HG2  GLU  64           1HG      GLU  64   1.842  -2.272  10.641
  499    HG3  GLU  64           2HG      GLU  64   1.397  -3.867  10.032
  500    H    THR  65           H        THR  65   0.379  -2.819   8.089
  501    HA   THR  65           HA       THR  65  -0.116  -5.458   7.263
  502    HB   THR  65           HB       THR  65  -2.369  -4.333   6.611
  503    HG1  THR  65           1HG      THR  65  -1.566  -2.323   8.363
  504   HG21  THR  65          3HG2      THR  65  -2.168  -5.729   8.574
  505   HG22  THR  65          1HG2      THR  65  -3.127  -4.293   8.925
  506   HG23  THR  65          2HG2      THR  65  -1.449  -4.386   9.486
  507    H    SER  66           H        SER  66  -0.178  -2.390   5.521
  508    HA   SER  66           HA       SER  66  -0.875  -3.529   3.070
  509    HG   SER  66           HG       SER  66  -1.424  -0.749   4.652
  510    HB2  SER  66           1HB      SER  66   0.431  -0.862   3.604
  511    HB3  SER  66           2HB      SER  66  -0.425  -1.352   2.134
  512    H    ILE  67           H        ILE  67   2.260  -2.670   4.415
  513    HA   ILE  67           HA       ILE  67   3.803  -3.227   2.125
  514    HB   ILE  67           HB       ILE  67   4.591  -3.397   5.070
  515   HG12  ILE  67          1HG1      ILE  67   5.114  -1.155   3.110
  516   HG13  ILE  67          2HG1      ILE  67   3.710  -1.190   4.167
  517   HG21  ILE  67          1HG2      ILE  67   6.353  -3.197   2.614
  518   HG22  ILE  67          2HG2      ILE  67   6.166  -4.622   3.632
  519   HG23  ILE  67          3HG2      ILE  67   6.903  -3.160   4.291
  520   HD11  ILE  67          3HD1      ILE  67   6.610  -1.007   4.985
  521   HD12  ILE  67          1HD1      ILE  67   5.243  -1.197   6.109
  522   HD13  ILE  67          2HD1      ILE  67   5.338   0.236   5.101
  523    H    ASP  68           H        ASP  68   2.721  -5.236   4.822
  524    HA   ASP  68           HA       ASP  68   4.206  -7.542   4.342
  525    HB2  ASP  68           1HB      ASP  68   2.995  -7.132   6.408
  526    HB3  ASP  68           2HB      ASP  68   1.464  -7.191   5.558
  527    H    TYR  69           H        TYR  69   0.781  -6.925   3.360
  528    HA   TYR  69           HA       TYR  69   1.017  -9.349   1.902
  529    HD1  TYR  69           1HD      TYR  69  -1.303  -9.751  -0.426
  530    HD2  TYR  69           2HD      TYR  69  -1.533 -10.584   3.734
  531    HE1  TYR  69           1HE      TYR  69  -1.873 -12.096  -0.932
  532    HE2  TYR  69           2HE      TYR  69  -2.106 -12.911   3.245
  533    HH   TYR  69           HH       TYR  69  -1.676 -14.323   0.235
  534    HB2  TYR  69           1HB      TYR  69  -1.272  -8.388   3.042
  535    HB3  TYR  69           2HB      TYR  69  -1.512  -7.928   1.356
  536    H    LEU  70           H        LEU  70   1.193  -5.986   0.991
  537    HA   LEU  70           HA       LEU  70   0.831  -6.459  -1.776
  538    HG   LEU  70           HG       LEU  70   2.545  -4.640  -2.978
  539    HB2  LEU  70           1HB      LEU  70   0.807  -4.198  -0.616
  540    HB3  LEU  70           2HB      LEU  70   2.553  -4.324  -0.557
  541   HD11  LEU  70          1HD1      LEU  70   0.177  -5.276  -3.254
  542   HD12  LEU  70          2HD1      LEU  70   0.613  -3.945  -4.290
  543   HD13  LEU  70          3HD1      LEU  70  -0.308  -3.634  -2.815
  544   HD21  LEU  70          3HD2      LEU  70   2.313  -2.264  -3.516
  545   HD22  LEU  70          1HD2      LEU  70   3.146  -2.505  -1.983
  546   HD23  LEU  70          2HD2      LEU  70   1.451  -2.010  -1.999
  547    H    ILE  71           H        ILE  71   3.784  -6.544   0.237
  548    HA   ILE  71           HA       ILE  71   5.438  -6.975  -2.028
  549    HB   ILE  71           HB       ILE  71   6.001  -7.763   0.863
  550   HG12  ILE  71          1HG1      ILE  71   5.665  -5.336   0.606
  551   HG13  ILE  71          2HG1      ILE  71   7.337  -5.712   0.994
  552   HG21  ILE  71          1HG2      ILE  71   7.428  -8.999  -0.713
  553   HG22  ILE  71          2HG2      ILE  71   8.368  -7.846   0.229
  554   HG23  ILE  71          3HG2      ILE  71   7.940  -7.474  -1.439
  555   HD11  ILE  71          3HD1      ILE  71   7.937  -5.404  -1.360
  556   HD12  ILE  71          1HD1      ILE  71   7.199  -3.958  -0.661
  557   HD13  ILE  71          2HD1      ILE  71   6.250  -5.006  -1.722
  558    H    LYS  72           H        LYS  72   3.639  -9.168   0.069
  559    HA   LYS  72           HA       LYS  72   4.838 -11.429  -1.278
  560    HB2  LYS  72           1HB      LYS  72   3.498 -12.855   0.169
  561    HB3  LYS  72           2HB      LYS  72   4.387 -11.649   1.091
  562    HG2  LYS  72           1HG      LYS  72   2.379 -10.293   1.137
  563    HG3  LYS  72           2HG      LYS  72   1.464 -11.608   0.397
  564    HD2  LYS  72           1HD      LYS  72   2.925 -11.702   3.044
  565    HD3  LYS  72           2HD      LYS  72   1.181 -11.572   2.845
  566    HE2  LYS  72           1HE      LYS  72   1.185 -13.764   1.711
  567    HE3  LYS  72           2HE      LYS  72   2.920 -13.892   2.010
  568    HZ1  LYS  72           3HZ      LYS  72   0.835 -13.672   4.115
  569    HZ2  LYS  72           1HZ      LYS  72   2.482 -13.837   4.388
  570    HZ3  LYS  72           2HZ      LYS  72   1.610 -15.091   3.675
  571    H    ASN  73           H        ASN  73   2.303  -9.422  -2.203
  572    HA   ASN  73           HA       ASN  73   1.358 -11.647  -3.914
  573    HB2  ASN  73           1HB      ASN  73  -0.439 -11.069  -2.287
  574    HB3  ASN  73           2HB      ASN  73  -0.456  -9.426  -2.909
  575   HD21  ASN  73          1HD2      ASN  73  -2.734 -11.314  -2.851
  576   HD22  ASN  73          2HD2      ASN  73  -3.161 -11.568  -4.482
  577    H    GLU  74           H        GLU  74   1.371  -8.022  -3.809
  578    HA   GLU  74           HA       GLU  74   1.717  -8.273  -6.679
  579    HB2  GLU  74           1HB      GLU  74  -0.706  -7.792  -5.947
  580    HB3  GLU  74           2HB      GLU  74  -0.124  -6.165  -5.617
  581    HG2  GLU  74           1HG      GLU  74  -1.105  -6.257  -7.820
  582    HG3  GLU  74           2HG      GLU  74   0.636  -5.984  -7.949
  583    H    LEU  75           H        LEU  75   3.819  -7.883  -6.123
  584    HA   LEU  75           HA       LEU  75   4.928  -5.623  -4.924
  585    HG   LEU  75           HG       LEU  75   7.461  -5.297  -6.676
  586    HB2  LEU  75           1HB      LEU  75   6.139  -7.701  -5.430
  587    HB3  LEU  75           2HB      LEU  75   6.073  -7.321  -7.136
  588   HD11  LEU  75          1HD1      LEU  75   7.714  -6.529  -3.942
  589   HD12  LEU  75          2HD1      LEU  75   6.924  -5.002  -4.328
  590   HD13  LEU  75          3HD1      LEU  75   8.664  -5.179  -4.560
  591   HD21  LEU  75          3HD2      LEU  75   8.458  -7.357  -7.517
  592   HD22  LEU  75          1HD2      LEU  75   8.638  -7.948  -5.864
  593   HD23  LEU  75          2HD2      LEU  75   9.549  -6.534  -6.400
  594    H    GLU  76           H        GLU  76   3.461  -5.933  -7.997
  595    HA   GLU  76           HA       GLU  76   4.758  -3.993  -9.524
  596    HB2  GLU  76           1HB      GLU  76   1.868  -4.845  -9.602
  597    HB3  GLU  76           2HB      GLU  76   2.675  -3.904 -10.847
  598    HG2  GLU  76           1HG      GLU  76   3.393  -6.702 -10.005
  599    HG3  GLU  76           2HG      GLU  76   2.542  -6.240 -11.478
  600    H    ILE  77           H        ILE  77   2.159  -3.626  -7.174
  601    HA   ILE  77           HA       ILE  77   1.730  -0.867  -7.836
  602    HB   ILE  77           HB       ILE  77   0.837  -2.365  -5.360
  603   HG12  ILE  77          1HG1      ILE  77  -0.598  -1.881  -7.980
  604   HG13  ILE  77          2HG1      ILE  77   0.062  -3.427  -7.425
  605   HG21  ILE  77          1HG2      ILE  77  -0.884  -0.608  -5.187
  606   HG22  ILE  77          2HG2      ILE  77  -0.188   0.209  -6.584
  607   HG23  ILE  77          3HG2      ILE  77   0.739   0.077  -5.088
  608   HD11  ILE  77          3HD1      ILE  77  -1.501  -3.382  -5.555
  609   HD12  ILE  77          1HD1      ILE  77  -2.322  -3.341  -7.126
  610   HD13  ILE  77          2HD1      ILE  77  -2.155  -1.860  -6.176
  611    H    TRP  78           H        TRP  78   3.622  -2.654  -5.526
  612    HA   TRP  78           HA       TRP  78   4.501  -0.534  -3.900
  613    HD1  TRP  78           HD       TRP  78   6.084  -1.496  -1.273
  614    HE1  TRP  78           1HE      TRP  78   8.533  -0.971  -0.724
  615    HE3  TRP  78           3HE      TRP  78   8.185  -2.552  -5.811
  616    HZ2  TRP  78           2HZ      TRP  78  11.027  -0.994  -2.041
  617    HZ3  TRP  78           3HZ      TRP  78  10.609  -2.266  -6.089
  618    HH2  TRP  78           HH       TRP  78  12.001  -1.504  -4.240
  619    HB2  TRP  78           1HB      TRP  78   4.967  -2.869  -3.297
  620    HB3  TRP  78           2HB      TRP  78   5.923  -3.075  -4.757
  621    H    LYS  79           H        LYS  79   5.613  -1.860  -6.926
  622    HA   LYS  79           HA       LYS  79   7.823  -0.213  -7.324
  623    HB2  LYS  79           1HB      LYS  79   6.042  -1.663  -9.266
  624    HB3  LYS  79           2HB      LYS  79   7.481  -0.784  -9.768
  625    HG2  LYS  79           1HG      LYS  79   8.868  -2.214  -8.380
  626    HG3  LYS  79           2HG      LYS  79   7.433  -3.056  -7.798
  627    HD2  LYS  79           1HD      LYS  79   7.001  -3.980  -9.932
  628    HD3  LYS  79           2HD      LYS  79   8.183  -2.933 -10.712
  629    HE2  LYS  79           1HE      LYS  79   8.789  -5.093  -8.695
  630    HE3  LYS  79           2HE      LYS  79   9.035  -5.219 -10.433
  631    HZ1  LYS  79           3HZ      LYS  79  10.501  -3.433  -8.546
  632    HZ2  LYS  79           1HZ      LYS  79  10.577  -3.289 -10.235
  633    HZ3  LYS  79           2HZ      LYS  79  11.098  -4.673  -9.492
  634    H    GLU  80           H        GLU  80   4.412   0.315  -8.028
  635    HA   GLU  80           HA       GLU  80   4.818   2.727  -9.493
  636    HB2  GLU  80           1HB      GLU  80   2.373   1.952  -7.918
  637    HB3  GLU  80           2HB      GLU  80   2.457   3.115  -9.231
  638    HG2  GLU  80           1HG      GLU  80   3.126   1.207 -10.720
  639    HG3  GLU  80           2HG      GLU  80   2.718   0.140  -9.369
  640    H    LEU  81           H        LEU  81   4.086   1.999  -6.127
  641    HA   LEU  81           HA       LEU  81   3.822   4.645  -5.208
  642    HG   LEU  81           HG       LEU  81   2.422   1.904  -4.605
  643    HB2  LEU  81           1HB      LEU  81   4.701   2.177  -3.709
  644    HB3  LEU  81           2HB      LEU  81   4.224   3.682  -2.960
  645   HD11  LEU  81          1HD1      LEU  81   1.316   1.430  -2.487
  646   HD12  LEU  81          2HD1      LEU  81   2.539   2.388  -1.637
  647   HD13  LEU  81          3HD1      LEU  81   3.003   0.905  -2.475
  648   HD21  LEU  81          3HD2      LEU  81   0.618   3.367  -3.797
  649   HD22  LEU  81          1HD2      LEU  81   1.777   4.255  -4.786
  650   HD23  LEU  81          2HD2      LEU  81   1.812   4.412  -3.032
  651    H    THR  82           H        THR  82   6.623   2.487  -5.304
  652    HA   THR  82           HA       THR  82   8.372   4.372  -4.162
  653    HB   THR  82           HB       THR  82  10.179   2.852  -5.109
  654    HG1  THR  82           1HG      THR  82   8.072   1.053  -5.584
  655   HG21  THR  82          3HG2      THR  82   8.005   1.627  -3.421
  656   HG22  THR  82          1HG2      THR  82   9.321   2.653  -2.838
  657   HG23  THR  82          2HG2      THR  82   9.675   1.058  -3.521
  658    H    ALA  83           H        ALA  83   7.347   3.734  -7.423
  659    HA   ALA  83           HA       ALA  83   9.309   5.299  -8.736
  660    HB1  ALA  83           3HB      ALA  83   7.818   5.255 -10.651
  661    HB2  ALA  83           1HB      ALA  83   7.875   3.660  -9.889
  662    HB3  ALA  83           2HB      ALA  83   6.490   4.714  -9.623
  663    H    HIS  84           H        HIS  84   6.439   6.060  -7.015
  664    HA   HIS  84           HA       HIS  84   6.401   8.784  -8.010
  665    HD1  HIS  84           1HD      HIS  84   3.315   9.486  -8.736
  666    HD2  HIS  84           2HD      HIS  84   4.239  10.202  -4.748
  667    HE1  HIS  84           1HE      HIS  84   2.229  11.658  -8.180
  668    HE2  HIS  84           2HE      HIS  84   2.735  12.060  -5.766
  669    HB2  HIS  84           1HB      HIS  84   4.294   7.434  -7.518
  670    HB3  HIS  84           2HB      HIS  84   4.682   7.599  -5.813
  671    H    PHE  85           H        PHE  85   7.794   6.974  -5.466
  672    HA   PHE  85           HA       PHE  85   8.252   9.416  -3.941
  673    HD1  PHE  85           1HD      PHE  85   7.620   9.776  -1.549
  674    HD2  PHE  85           2HD      PHE  85  10.485   6.642  -1.448
  675    HE1  PHE  85           1HE      PHE  85   8.587  10.730   0.491
  676    HE2  PHE  85           2HE      PHE  85  11.458   7.592   0.597
  677    HZ   PHE  85           HZ       PHE  85  10.507   9.639   1.574
  678    HB2  PHE  85           1HB      PHE  85   7.322   7.434  -2.723
  679    HB3  PHE  85           2HB      PHE  85   8.823   6.586  -3.050
  680    H    ASP  86           H        ASP  86  10.333   6.532  -4.272
  681    HA   ASP  86           HA       ASP  86  12.439   8.237  -5.287
  682    HB2  ASP  86           1HB      ASP  86  12.909   8.482  -2.986
  683    HB3  ASP  86           2HB      ASP  86  12.620   6.783  -2.651
  684    HA   PRO  87           HA       PRO  87  12.793   4.195  -7.321
  685    HB2  PRO  87           1HB      PRO  87  12.843   5.152  -9.850
  686    HB3  PRO  87           2HB      PRO  87  11.344   4.767  -9.003
  687    HG2  PRO  87           1HG      PRO  87  12.587   7.408  -9.554
  688    HG3  PRO  87           2HG      PRO  87  10.876   6.975  -9.444
  689    HD2  PRO  87           1HD      PRO  87  12.388   8.227  -7.464
  690    HD3  PRO  87           2HD      PRO  87  10.824   7.431  -7.215
  691    H    ASP  88           H        ASP  88  14.504   7.224  -7.548
  692    HA   ASP  88           HA       ASP  88  16.661   6.049  -9.138
  693    HB2  ASP  88           1HB      ASP  88  16.250   8.910  -8.285
  694    HB3  ASP  88           2HB      ASP  88  17.509   8.333  -9.362
  695    H    GLY  89           H        GLY  89  16.098   6.998  -5.811
  696    HA2  GLY  89           1HA      GLY  89  18.944   7.296  -5.359
  697    HA3  GLY  89           2HA      GLY  89  17.649   7.589  -4.209
  698    H    LYS  90           H        LYS  90  16.723   5.842  -3.111
  699    HA   LYS  90           HA       LYS  90  18.654   3.756  -2.637
  700    HB2  LYS  90           1HB      LYS  90  15.932   4.239  -1.384
  701    HB3  LYS  90           2HB      LYS  90  17.061   2.995  -0.886
  702    HG2  LYS  90           1HG      LYS  90  17.493   5.971  -0.720
  703    HG3  LYS  90           2HG      LYS  90  17.100   4.896   0.619
  704    HD2  LYS  90           1HD      LYS  90  19.219   3.655   0.147
  705    HD3  LYS  90           2HD      LYS  90  19.614   4.893  -1.045
  706    HE2  LYS  90           1HE      LYS  90  19.475   6.612   0.722
  707    HE3  LYS  90           2HE      LYS  90  19.154   5.342   1.896
  708    HZ1  LYS  90           3HZ      LYS  90  21.632   5.701   0.315
  709    HZ2  LYS  90           1HZ      LYS  90  21.332   4.375   1.316
  710    HZ3  LYS  90           2HZ      LYS  90  21.451   5.922   1.965
  711    H    TRP  91           H        TRP  91  15.190   3.684  -3.119
  712    HA   TRP  91           HA       TRP  91  13.710   2.205  -3.919
  713    HD1  TRP  91           HD       TRP  91  11.999   2.575  -6.078
  714    HE1  TRP  91           1HE      TRP  91  10.745   0.834  -7.474
  715    HE3  TRP  91           3HE      TRP  91  15.908  -0.522  -7.175
  716    HZ2  TRP  91           2HZ      TRP  91  11.339  -1.560  -8.854
  717    HZ3  TRP  91           3HZ      TRP  91  15.480  -2.516  -8.546
  718    HH2  TRP  91           HH       TRP  91  13.245  -3.018  -9.370
  719    HB2  TRP  91           1HB      TRP  91  14.732   3.106  -6.034
  720    HB3  TRP  91           2HB      TRP  91  15.751   1.670  -6.083
  721    H    ARG  92           H        ARG  92  16.768   0.656  -4.402
  722    HA   ARG  92           HA       ARG  92  16.031  -2.040  -4.247
  723    HE   ARG  92           HE       ARG  92  19.051   1.132  -5.136
  724    HB2  ARG  92           1HB      ARG  92  18.636  -0.644  -3.652
  725    HB3  ARG  92           2HB      ARG  92  18.448  -2.374  -3.911
  726    HG2  ARG  92           1HG      ARG  92  18.030  -2.130  -6.160
  727    HG3  ARG  92           2HG      ARG  92  17.500  -0.456  -5.969
  728    HD2  ARG  92           1HD      ARG  92  20.337  -1.325  -5.499
  729    HD3  ARG  92           2HD      ARG  92  19.740  -0.781  -7.068
  730   HH11  ARG  92          1HH1      ARG  92  22.004  -0.137  -6.626
  731   HH12  ARG  92          2HH1      ARG  92  22.806   1.366  -6.641
  732   HH21  ARG  92          1HH2      ARG  92  20.171   3.217  -5.159
  733   HH22  ARG  92          2HH2      ARG  92  21.759   3.280  -5.766
  734    H    LYS  93           H        LYS  93  17.470   0.107  -1.781
  735    HA   LYS  93           HA       LYS  93  17.508  -1.657   0.365
  736    HB2  LYS  93           1HB      LYS  93  18.632   0.510   0.504
  737    HB3  LYS  93           2HB      LYS  93  17.083   1.340   0.425
  738    HG2  LYS  93           1HG      LYS  93  16.448   0.310   2.571
  739    HG3  LYS  93           2HG      LYS  93  18.030  -0.453   2.654
  740    HD2  LYS  93           1HD      LYS  93  19.094   1.748   2.694
  741    HD3  LYS  93           2HD      LYS  93  17.513   2.523   2.583
  742    HE2  LYS  93           1HE      LYS  93  18.433   0.720   4.827
  743    HE3  LYS  93           2HE      LYS  93  18.374   2.477   4.893
  744    HZ1  LYS  93           3HZ      LYS  93  16.458   1.374   5.943
  745    HZ2  LYS  93           1HZ      LYS  93  15.977   0.746   4.464
  746    HZ3  LYS  93           2HZ      LYS  93  15.981   2.404   4.702
  747    H    LYS  94           H        LYS  94  14.913   0.337  -0.857
  748    HA   LYS  94           HA       LYS  94  13.118   0.182   1.307
  749    HB2  LYS  94           1HB      LYS  94  12.521   0.365  -1.639
  750    HB3  LYS  94           2HB      LYS  94  11.383   0.714  -0.347
  751    HG2  LYS  94           1HG      LYS  94  12.703   2.625   0.319
  752    HG3  LYS  94           2HG      LYS  94  13.928   2.223  -0.896
  753    HD2  LYS  94           1HD      LYS  94  12.263   2.507  -2.670
  754    HD3  LYS  94           2HD      LYS  94  11.048   2.856  -1.456
  755    HE2  LYS  94           1HE      LYS  94  13.519   4.506  -1.909
  756    HE3  LYS  94           2HE      LYS  94  11.908   4.869  -2.539
  757    HZ1  LYS  94           3HZ      LYS  94  12.689   4.731   0.325
  758    HZ2  LYS  94           1HZ      LYS  94  11.112   4.913  -0.239
  759    HZ3  LYS  94           2HZ      LYS  94  12.289   6.103  -0.525
  760    H    TYR  95           H        TYR  95  13.544  -1.807  -1.581
  761    HA   TYR  95           HA       TYR  95  11.419  -3.571  -1.134
  762    HD1  TYR  95           1HD      TYR  95  10.490  -5.083  -3.152
  763    HD2  TYR  95           2HD      TYR  95  14.545  -6.256  -2.648
  764    HE1  TYR  95           1HE      TYR  95   9.877  -7.414  -3.643
  765    HE2  TYR  95           2HE      TYR  95  13.935  -8.586  -3.134
  766    HH   TYR  95           HH       TYR  95  10.868  -9.428  -4.385
  767    HB2  TYR  95           1HB      TYR  95  12.477  -3.441  -3.306
  768    HB3  TYR  95           2HB      TYR  95  14.011  -3.981  -2.634
  769    H    GLU  96           H        GLU  96  14.868  -3.979  -0.398
  770    HA   GLU  96           HA       GLU  96  14.570  -6.575   0.711
  771    HB2  GLU  96           1HB      GLU  96  16.766  -4.597   1.260
  772    HB3  GLU  96           2HB      GLU  96  16.834  -6.336   1.476
  773    HG2  GLU  96           1HG      GLU  96  16.627  -6.636  -0.934
  774    HG3  GLU  96           2HG      GLU  96  16.562  -4.884  -1.139
  775    H    ASP  97           H        ASP  97  15.095  -3.421   2.199
  776    HA   ASP  97           HA       ASP  97  15.236  -4.348   4.836
  777    HB2  ASP  97           1HB      ASP  97  16.228  -2.261   4.276
  778    HB3  ASP  97           2HB      ASP  97  14.698  -1.619   3.707
  779    H    ARG  98           H        ARG  98  12.494  -2.885   3.088
  780    HA   ARG  98           HA       ARG  98  10.914  -3.048   5.439
  781    HE   ARG  98           HE       ARG  98  10.079   1.494   5.116
  782    HB2  ARG  98           1HB      ARG  98  10.052  -2.510   2.600
  783    HB3  ARG  98           2HB      ARG  98   8.971  -2.476   3.982
  784    HG2  ARG  98           1HG      ARG  98  11.331  -0.669   3.489
  785    HG3  ARG  98           2HG      ARG  98   9.623  -0.225   3.446
  786    HD2  ARG  98           1HD      ARG  98   9.475  -0.863   5.870
  787    HD3  ARG  98           2HD      ARG  98  11.221  -1.107   5.853
  788   HH11  ARG  98          1HH1      ARG  98  12.173  -0.384   7.274
  789   HH12  ARG  98          2HH1      ARG  98  12.736   0.989   8.106
  790   HH21  ARG  98          1HH2      ARG  98  10.851   3.287   6.200
  791   HH22  ARG  98          2HH2      ARG  98  12.010   3.149   7.470
  792    H    ALA  99           H        ALA  99  11.347  -5.226   2.720
  793    HA   ALA  99           HA       ALA  99   9.185  -6.890   3.440
  794    HB1  ALA  99           3HB      ALA  99  10.253  -6.958   1.229
  795    HB2  ALA  99           1HB      ALA  99  11.723  -7.586   1.968
  796    HB3  ALA  99           2HB      ALA  99  10.246  -8.548   1.991
  797    H    LYS 100           H        LYS 100  12.666  -6.981   4.196
  798    HA   LYS 100           HA       LYS 100  12.555  -9.345   5.741
  799    HB2  LYS 100           1HB      LYS 100  14.552  -7.087   5.824
  800    HB3  LYS 100           2HB      LYS 100  14.755  -8.610   6.667
  801    HG2  LYS 100           1HG      LYS 100  14.573  -8.243   3.680
  802    HG3  LYS 100           2HG      LYS 100  16.048  -8.519   4.592
  803    HD2  LYS 100           1HD      LYS 100  13.721 -10.427   4.309
  804    HD3  LYS 100           2HD      LYS 100  15.277 -10.564   3.506
  805    HE2  LYS 100           1HE      LYS 100  16.333 -10.727   5.787
  806    HE3  LYS 100           2HE      LYS 100  14.709 -10.779   6.463
  807    HZ1  LYS 100           3HZ      LYS 100  14.287 -12.779   5.117
  808    HZ2  LYS 100           1HZ      LYS 100  15.559 -13.016   6.193
  809    HZ3  LYS 100           2HZ      LYS 100  15.883 -12.729   4.577
  810    H    ALA 101           H        ALA 101  12.157  -5.959   6.604
  811    HA   ALA 101           HA       ALA 101  12.162  -6.393   9.406
  812    HB1  ALA 101           3HB      ALA 101  11.289  -4.130   9.589
  813    HB2  ALA 101           1HB      ALA 101  12.596  -4.196   8.405
  814    HB3  ALA 101           2HB      ALA 101  10.920  -4.120   7.863
  815    H    LYS 102           H        LYS 102   9.742  -6.824   7.003
  816    HA   LYS 102           HA       LYS 102   7.642  -7.018   9.038
  817    HB2  LYS 102           1HB      LYS 102   7.532  -7.366   6.054
  818    HB3  LYS 102           2HB      LYS 102   6.141  -7.409   7.122
  819    HG2  LYS 102           1HG      LYS 102   7.935  -5.011   6.852
  820    HG3  LYS 102           2HG      LYS 102   6.561  -5.295   5.801
  821    HD2  LYS 102           1HD      LYS 102   5.438  -4.057   7.301
  822    HD3  LYS 102           2HD      LYS 102   5.406  -5.528   8.253
  823    HE2  LYS 102           1HE      LYS 102   7.613  -3.481   8.534
  824    HE3  LYS 102           2HE      LYS 102   6.097  -3.308   9.389
  825    HZ1  LYS 102           3HZ      LYS 102   7.655  -4.279  10.837
  826    HZ2  LYS 102           1HZ      LYS 102   8.102  -5.510   9.787
  827    HZ3  LYS 102           2HZ      LYS 102   6.565  -5.462  10.487
  828    H    GLY 103           H        GLY 103   9.884  -8.965   7.438
  829    HA2  GLY 103           1HA      GLY 103  10.351 -11.195   8.110
  830    HA3  GLY 103           2HA      GLY 103   8.683 -11.354   8.642
  831    H    ILE 104           H        ILE 104   9.033  -9.879   5.648
  832    HA   ILE 104           HA       ILE 104   7.611 -11.981   4.345
  833    HB   ILE 104           HB       ILE 104   8.795  -9.419   3.250
  834   HG12  ILE 104          1HG1      ILE 104   7.079  -9.003   4.933
  835   HG13  ILE 104          2HG1      ILE 104   6.508  -8.533   3.336
  836   HG21  ILE 104          1HG2      ILE 104   8.482 -11.048   1.477
  837   HG22  ILE 104          2HG2      ILE 104   7.346  -9.710   1.330
  838   HG23  ILE 104          3HG2      ILE 104   6.793 -11.267   1.956
  839   HD11  ILE 104          3HD1      ILE 104   4.764  -9.636   4.603
  840   HD12  ILE 104          1HD1      ILE 104   5.788 -11.054   4.814
  841   HD13  ILE 104          2HD1      ILE 104   5.221 -10.607   3.204
  842    H    VAL 105           H        VAL 105   8.501 -13.630   3.303
  843    HA   VAL 105           HA       VAL 105  11.327 -13.750   2.954
  844    HB   VAL 105           HB       VAL 105  10.123 -15.809   3.562
  845   HG11  VAL 105          1HG1      VAL 105   8.019 -15.484   2.426
  846   HG12  VAL 105          2HG1      VAL 105   8.812 -15.644   0.861
  847   HG13  VAL 105          3HG1      VAL 105   8.730 -17.027   1.951
  848   HG21  VAL 105          3HG2      VAL 105  11.425 -15.963   0.850
  849   HG22  VAL 105          1HG2      VAL 105  11.119 -17.348   1.902
  850   HG23  VAL 105          2HG2      VAL 105  12.223 -16.073   2.418
  851    H    ILE 106           H        ILE 106  12.406 -12.945   1.368
  852    HA   ILE 106           HA       ILE 106  11.307 -12.987  -1.330
  853    HB   ILE 106           HB       ILE 106  12.143 -10.779  -1.890
  854   HG12  ILE 106          1HG1      ILE 106  14.051 -10.656  -0.272
  855   HG13  ILE 106          2HG1      ILE 106  13.122  -9.173  -0.336
  856   HG21  ILE 106          1HG2      ILE 106  10.624  -9.315  -0.676
  857   HG22  ILE 106          2HG2      ILE 106  10.351 -10.606   0.494
  858   HG23  ILE 106          3HG2      ILE 106   9.874 -10.829  -1.189
  859   HD11  ILE 106          3HD1      ILE 106  13.760  -9.674   1.916
  860   HD12  ILE 106          1HD1      ILE 106  13.022 -11.276   1.808
  861   HD13  ILE 106          2HD1      ILE 106  12.008  -9.839   1.749
  862    HA   PRO 107           HA       PRO 107  15.372 -14.478  -2.214
  863    HB2  PRO 107           1HB      PRO 107  15.700 -13.561  -4.766
  864    HB3  PRO 107           2HB      PRO 107  14.744 -14.988  -4.363
  865    HG2  PRO 107           1HG      PRO 107  13.860 -12.207  -4.973
  866    HG3  PRO 107           2HG      PRO 107  13.113 -13.747  -5.438
  867    HD2  PRO 107           1HD      PRO 107  12.186 -12.205  -3.411
  868    HD3  PRO 107           2HD      PRO 107  12.039 -13.973  -3.423
  869    H    GLU 108           H        GLU 108  16.854 -13.417  -1.073
  870    HA   GLU 108           HA       GLU 108  17.428 -10.661  -1.757
  871    HB2  GLU 108           1HB      GLU 108  18.617 -10.662   0.494
  872    HB3  GLU 108           2HB      GLU 108  16.871 -10.836   0.550
  873    HG2  GLU 108           1HG      GLU 108  17.149 -13.259   0.888
  874    HG3  GLU 108           2HG      GLU 108  18.897 -13.055   0.863