*HEADER    VIRUS/VIRAL PROTEIN/RNA                 27-SEP-06   2IHX              
*TITLE     SOLUTION STRUCTURE OF THE ROUS SARCOMA VIRUS NUCLEOCAPSID             
*TITLE    2 PROTEIN:UPSI RNA PACKAGING SIGNAL COMPLEX                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NUCLEOCAPSID (NC) PROTEIN;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: NUCLEOCAPSID DOMAIN (RESIDUES 503-563);                    
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: UPSI RNA;                                                  
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 FRAGMENT: MINIMAL RNA PACKAGING SIGNAL IN THE 5'-                    
*COMPND  10 UNTRANSLATED REGION (UTR) OF ROUS SARCOMA VIRUS (RSV);               
*COMPND  11 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ROUS SARCOMA VIRUS;                             
*SOURCE   3 ORGANISM_COMMON: VIRUS;                                              
*SOURCE   4 STRAIN: PRAGUE C (PR-C);                                             
*SOURCE   5 GENE: GAG;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21 CODON PLUS (DE3)-RIL;                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PGEX-6P-1;                                
*SOURCE  11 MOL_ID: 2;                                                           
*SOURCE  12 SYNTHETIC: YES;                                                      
*SOURCE  13 OTHER_DETAILS: RNA WAS PREPARED BY IN VITRO T7 RNA                   
*SOURCE  14 TRANSCRIPTION. THE SEQUENCE OCCURS NATURALLY IN ROUS                 
*SOURCE  15 SARCOMA VIRUS (RSV)                                                  
*KEYWDS    PROTEIN-RNA COMPLEX                                                   
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.ZHOU, M.SUMMERS                                                     
*REVDAT   1   16-JAN-07 2IHX    0                                                


******************************************************************
CYANA SEQUENCE FILE
******************************************************************

#NC
GLY 15 ARG ALA ARG GLY LEU CYS- TYR THR CYS- GLY SER PRO GLY
HIS TYR GLN ALA GLN CYSZ PRO LYS LYS ARG LYS SER GLY ASN SER
ARG GLU ARG CYS- GLN LEU CYS- ASN GLY MET GLY HIS ASN ALA
LYS GLN CYSZ ARG LYS ARG ASP GLY ASN GLN GLY GLN ARG PRO
GLY LYS GLY LEU

PL 100 LL5 LL5 LL5  LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LN

#O3 (160-167)
RCYT  160
URA
RGUA
RCYT
RCYT
RCYT
URA
RCYT  167

#linker-1
RADE 168 
URA  169 
RCYT 170 

#SL-A
RCYT 171 
RGUA 172 
URA  173
RCYT 174 
URA  175 
RCYT 176 
RGUA 177 
RCYT 178
URA  179
URA  180
RADE 181
URA  182 
URA  183 
RCYT 184 
RGUA 185 
RGUA 186 
RGUA 187 
RGUA 188
RADE 189
RGUA 190
RCYT 191
RGUA 192
RGUA 193
RADE 194
RCYT 195
RGUA 196

#linker-2
RADE 197 
URA  198 
RGUA 199 
RADE 200 

#SL-B (C201-G213)  
RCYT 201 
RCYT 202 
RCYT 203
URA  204 
RADE 205
RGUA 206
URA  207
RADE 208
RGUA 209
RADE 210
RGUA 211
RGUA 212
RGUA 213

#SL-C (G214-U223)  
RGUA 214
RGUA 215
RCYT 216 
URA  217
RGUA 218
RCYT 219
RGUA 220
RGUA 221
RCYT 222
URA  223

#linker-3
URA  224
RADE 225
RGUA 226

#O3 (227-234)
RGUA 227
RADE 228
RGUA 229
RGUA 230
RGUA 231
RCYT 232
RADE 233
RGUA 234


******************************************************************
CYANA UPPER LIMIT RESTRAINT FILE
******************************************************************

##################################################################
#### Begin NC N-terminal zinc knuckle restraints
##################################################################

#-----------------------------------------------------------------
#          ZN Ligands   
#-----------------------------------------------------------------
 34 CYSZ ZN     21 CYS- CB      3.50  10.00E+00
 34 CYSZ ZN     24 CYS- CB      3.50  10.00E+00
 34 CYSZ ZN     21 CYS- SG      2.30  10.00E+00
 34 CYSZ ZN     24 CYS- SG      2.30  10.00E+00
 34 CYSZ ZN     34 CYSZ SG      2.30  10.00E+00 
 34 CYSZ ZN     29 HIS  NE2     1.95  10.00E+00

#-----------------------------------------------------------------
#                       ZN Geometry  
#-----------------------------------------------------------------
 34 CYSZ SG     21 CYS- SG      3.85  10.00E+00
 34 CYSZ SG     24 CYS- SG      3.85  10.00E+00
 21 CYS- SG     24 CYS- SG      3.85  10.00E+00

 34 CYSZ SG     29 HIS  NE2     3.85  10.00E+00
 21 CYS- SG     29 HIS  NE2     3.85  10.00E+00
 24 CYS- SG     29 HIS  NE2     3.85  10.00E+00

#-----------------------------------------------------------------
#           NC Protein Hydrogen Bonds  
#-----------------------------------------------------------------
 20 LEU  N      17 ALA  O       3.00  1.00E+00
 20 LEU  H      17 ALA  O       2.00  1.00E+00
 28 GLY  N      19 GLY  O       3.10  1.00E+00
 28 GLY  H      19 GLY  O       2.10  1.00E+00

#Zinc Finger
 21 CYS- N      26 SER  O       3.00  1.00E+00
 21 CYS- H      26 SER  O       2.00  1.00E+00
 23 THR  H      21 CYS- SG      2.75  1.00E+00 
 23 THR  N      21 CYS- SG      3.85  1.00E+00
 26 SER  H      24 CYS- SG      2.75  1.00E+00
 26 SER  N      24 CYS- SG      3.85  1.00E+00
 24 CYS- H      21 CYS- SG      2.75  1.00E+00
 24 CYS- N      21 CYS- SG      3.85  1.00E+00
 33 GLN  N      30 TYR  O       3.00  1.00E+00
 33 GLN  H      30 TYR  O       2.00  1.00E+00
 34 CYSZ N      31 GLN  O       3.00  1.00E+00
 34 CYSZ H      31 GLN  O       2.00  1.00E+00
 36 LYS  H      34 CYSZ SG      2.65  1.00E+00
 36 LYS  N      34 CYSZ SG      3.65  1.00E+00
 37 LYS  H      34 CYSZ O       2.00  1.00E+00
 37 LYS  N      34 CYSZ O       3.00  1.00E+00

#-----------------------------------------------------------------
#  NC Protien NOEs
#-----------------------------------------------------------------

# ALA 17
 17 ALA  QB     30 TYR  QE      5.80  1.00E+00

# ARG 18
 18 ARG  HA     19 GLY H        2.70  1.00E+00    
 18 ARG  HA     30 TYR QE       5.10  1.00E+00
 18 ARG  QB     30 TYR QE       5.90  1.00E+00
 18 ARG  QG     30 TYR QE       5.90  1.00E+00
 18 ARG  QD     30 TYR QE       5.90  1.00E+00
 
# GLY 19
 19 GLY H       20 LEU  H       2.70  1.00E+00 
 19 GLY QA      20 LEU  QD1     6.30  1.00E+00
 19 GLY QA      30 TYR  QE      5.90  1.00E+00

# LEU 20
 20 LEU  HA     21 CYS- H       2.70  1.00E+00 
 20 LEU  HA     27 PRO  HA      5.00  1.00E+00
 20 LEU  HA     28 GLY  H       5.00  1.00E+00 
 20 LEU  H      30 TYR  QE      5.00  1.00E+00  
 20 LEU  QD2    26 SER  HA      5.50  1.00E+00
 20 LEU  QD2    27 PRO  HA      5.50  1.00E+00
 20 LEU  HG     27 PRO  HA      5.00  1.00E+00

# CYS 21
 21 CYS- HA     22 TYR  H       2.70  1.00E+00 
 21 CYS- HA     21 CYS- HB2     2.70  1.00E+00 
 21 CYS- H      21 CYS- HB3     2.70  1.00E+00 
 21 CYS- HA     23 THR  H       5.00  1.00E+00 
 21 CYS- HA     30 TYR  HA      3.30  1.00E+00 
 21 CYS- H      27 PRO  HA      5.00  1.00E+00 
 21 CYS- HB3    25 GLY  H       5.00  1.00E+00 
 21 CYS- HB3    26 SER  H       2.70  1.00E+00 
 21 CYS- HB3    24 CYS- H       3.30  1.00E+00 
 21 CYS- HB2    29 HIS  HD2     3.30  1.00E+00 
 21 CYS- HA     31 GLN  H       5.00  1.00E+00 

# TYR 22
 22 TYR  HA     22 TYR  HD1     2.70  1.00E+00
 22 TYR  H      23 THR  H       2.90  1.00E+00 
 22 TYR  QB     23 THR  H       5.80  1.00E+00  
 22 TYR  QB     23 THR  HA      5.80  1.00E+00  
 22 TYR  H      31 GLN  QB      5.50  1.00E+00 
 22 TYR  HA     25 GLY  H       5.00  1.00E+00 
 
# THR 23
 23 THR  H      24 CYS- H       2.90  1.00E+00 
 23 THR  H      23 THR  HB      2.70  1.00E+00 
 23 THR  H      31 GLN  HA      5.00  1.00E+00 
 23 THR  H      31 GLN  QB      5.50  1.00E+00  
 23 THR  QG2    37 LYS  QE      5.80  1.00E+00
 23 THR  QG2    37 LYS  QG      5.80  1.00E+00

# CYS 24
 24 CYS- H      25 GLY  H       2.90  1.00E+00   
 24 CYS- H      23 THR  HB      2.70  1.00E+00 
 24 CYS- H      24 CYS- HB3     3.30  1.00E+00 
 24 CYS- HB2    26 SER  H       5.00  1.00E+00 
 
 24 CYS- HA     24 CYS- HB2     2.70  1.00E+00
 24 CYS- HA     24 CYS- HB3     2.70  1.00E+00
 
 24 CYS- HB2    36 LYS  QD      4.10  1.00E+00
 24 CYS- HB3    36 LYS  QD      4.10  1.00E+00

# GLY 25
 25 GLY  H      26 SER  H       2.90  1.00E+00 

# SER 26
 26 SER  H      26 SER  HB2     2.70  1.00E+00 
 26 SER  HB2    29 HIS  HE1     2.70  1.00E+00 
 26 SER  HB3    29 HIS  HE1     2.70  1.00E+00 

# PRO 27
 28 GLY  H      27 PRO  HA      2.70  1.00E+00 

# GLY 28
 28 GLY  H      29 HIS  H       2.90  1.00E+00 

# HIS 29
 29 HIS  HA     30 TYR  H       2.70  1.00E+00 
 29 HIS  HA     29 HIS  HB2     2.70  1.00E+00 
 29 HIS  HA     29 HIS  HB3     2.70  1.00E+00 
 29 HIS  HB2    30 TYR  H       2.70  1.00E+00 
 29 HIS  HB2    34 CYSZ HA      5.00  1.00E+00 
 29 HIS  HD2    31 GLN  HA      5.00  1.00E+00
 29 HIS  HD2    34 CYSZ HA      3.30  1.00E+00 
 29 HIS  HD2    34 CYSZ HB2     3.30  1.00E+00 
 29 HIS  HE1    35 PRO  HD2     3.30  1.00E+00 
 29 HIS  HE1    35 PRO  HD3     3.30  1.00E+00 

# TYR 30
 30 TYR  HA     30 TYR  HD1     2.70  1.00E+00 
 30 TYR  HA     31 GLN  H       2.70  1.00E+00 
 30 TYR  H      33 GLN  HB2     5.00  1.00E+00  
 30 TYR  H      33 GLN  HB3     5.00  1.00E+00 
 
# GLN 31
 31 GLN  H      32 ALA  H       3.30  1.00E+00 
 31 GLN  HA     34 CYSZ HB2     2.70  1.00E+00 
 31 GLN  HA     34 CYSZ H       3.30  1.00E+00 
 31 GLN  QB     32 ALA H        3.80  1.00E+00 
 
# ALA 32
 32 ALA  H      33 GLN  H       2.90  1.00E+00 
 32 ALA  QB     32 ALA  H       3.30  1.00E+00 
 32 ALA  QB     32 ALA  HA      2.70  1.00E+00
 32 ALA  HA     37 LYS  QE      5.80  1.00E+00 

# GLN 33
 33 GLN  H      34 CYSZ H       2.90  1.00E+00 
 33 GLN  H      33 GLN  HB2     2.70  1.00E+00 

# CYSZ 34
 34 CYSZ H      34 CYSZ HB2     2.70  1.00E+00 
 34 CYSZ HA     34 CYSZ HB2     2.70  1.00E+00 
 34 CYSZ HA     35 PRO  HD2     2.70  1.00E+00  
 34 CYSZ HA     35 PRO  HD3     2.70  1.00E+00 
 34 CYSZ QB     37 LYS  QG      4.30  1.00E+00 

# PRO 35 
 35 PRO  HD2    36 LYS  H       2.70  1.00E+00 
 
# LYS 36
 36 LYS  H      37 LYS  H       2.90  1.00E+00 

# LYS 37


##################################################################
##### Begin NC C-terminal zinc knuckle restraints
##################################################################

#-----------------------------------------------------------------
#          ZN Ligands   
#-----------------------------------------------------------------
 60 CYSZ ZN     47 CYS- CB      3.50  10.00E+00
 60 CYSZ ZN     50 CYS- CB      3.50  10.00E+00
 60 CYSZ ZN     47 CYS- SG      2.30  10.00E+00
 60 CYSZ ZN     50 CYS- SG      2.30  10.00E+00
 60 CYSZ ZN     60 CYSZ SG      2.30  10.00E+00 
 60 CYSZ ZN     55 HIS  NE2     1.95  10.00E+00
 
#-----------------------------------------------------------------
#                       ZN Geometry   
#-----------------------------------------------------------------
 60 CYSZ SG     47 CYS- SG      3.85  10.00E+00
 60 CYSZ SG     50 CYS- SG      3.85  10.00E+00
 47 CYS- SG     50 CYS- SG      3.85  10.00E+00

 60 CYSZ SG     55 HIS  NE2     3.85  10.00E+00
 47 CYS- SG     55 HIS  NE2     3.85  10.00E+00
 50 CYS- SG     55 HIS  NE2     3.85  10.00E+00

#-----------------------------------------------------------------
#           NC Protein Hydrogen Bonds  
#-----------------------------------------------------------------

#Zinc Finger
 54 GLY  N      45 GLU  O       3.10  1.00E+00
 54 GLY  H      45 GLU  O       2.10  1.00E+00

 47 CYS- N      52 GLY  O       3.00  1.00E+00
 47 CYS- H      52 GLY  O       2.00  1.00E+00
 49 LEU  H      47 CYS- SG      2.75  1.00E+00 
 49 LEU  N      47 CYS- SG      3.85  1.00E+00
 52 GLY  H      50 CYS- SG      2.75  1.00E+00
 52 GLY  N      50 CYS- SG      3.85  1.00E+00
 50 CYS- H      47 CYS- SG      2.75  1.00E+00
 50 CYS- N      47 CYS- SG      3.85  1.00E+00
 59 GLN  N      56 ASN  O       3.00  1.00E+00
 59 GLN  H      56 ASN  O       2.00  1.00E+00
 60 CYSZ N      57 ALA  O       3.00  1.00E+00
 60 CYSZ H      57 ALA  O       2.00  1.00E+00
 62 LYS  H      60 CYSZ SG      2.65  1.00E+00
 62 LYS  N      60 CYSZ SG      3.65  1.00E+00
 63 ARG  H      60 CYSZ O       2.00  1.00E+00
 63 ARG  N      60 CYSZ O       3.00  1.00E+00
 64 ASP  H      61 ARG  O       2.00  1.00E+00
 64 ASP  N      61 ARG  O       3.00  1.00E+00
 65 GLY  H      61 ARG  O       2.00  1.00E+00
 65 GLY  N      61 ARG  O       3.00  1.00E+00

#-----------------------------------------------------------------
#  NC Protien NOEs
#-----------------------------------------------------------------

# ARG 46
 46 ARG  HA     47 CYS- H       2.70  1.00E+00 
 46 ARG  HA     53 MET  HA      5.00  1.00E+00 
 46 ARG  HA     54 GLY  H       5.00  1.00E+00 
 46 ARG  QG     52 GLY  HA      5.50  1.00E+00 
 46 ARG  QG     53 MET  HA      5.50  1.00E+00  
 46 ARG  QB     53 MET  HA      5.00  1.00E+00  

# CYS 47
 47 CYS- HA     48 GLN  H       2.70  1.00E+00 
 47 CYS- HA     47 CYS- HB2     2.70  1.00E+00  
 47 CYS- H      47 CYS- HB3     2.70  1.00E+00  
 47 CYS- HA     49 LEU  H       5.00  1.00E+00 
 47 CYS- HA     56 ASN  HA      3.30  1.00E+00 
 47 CYS- H      53 MET  HA      5.00  1.00E+00 
 47 CYS- HB3    51 ASN  H       5.00  1.00E+00 
 47 CYS- HB3    52 GLY  H       2.70  1.00E+00 
 47 CYS- HB3    50 CYS- H       3.30  1.00E+00 
 47 CYS- HB2    55 HIS  HD2     3.30  1.00E+00 
 47 CYS- HA     57 ALA  H       5.00  1.00E+00 

# GLN 48
 48 GLN  H      49 LEU  H       2.90  1.00E+00 
 48 GLN  QB     49 LEU  H       5.50  1.00E+00 
 48 GLN  QB     57 ALA  QB      4.30  1.00E+00 
 48 GLN  H      57 ALA  QB      5.50  1.00E+00 
 48 GLN  HA     51 ASN  H       5.00  1.00E+00 

# LEU 49
 49 LEU  H      50 CYS- H       2.90  1.00E+00 
 49 LEU  H      49 LEU  HB      2.70  1.00E+00 
 49 LEU  H      57 ALA  HA      5.00  1.00E+00  
 49 LEU  H      57 ALA  QB      5.50  1.00E+00 
 49 LEU  QB     57 ALA  QB      6.00  1.00E+00
 49 LEU  QD1    57 ALA  QB      3.70  1.00E+00
 49 LEU  QD1    57 ALA  HA      3.80  1.00E+00
 49 LEU  QD2    63 ARG  QB      5.80  1.00E+00
 49 LEU  QD2    63 ARG  QD      5.80  1.00E+00

# CYS 50
 50 CYS- H      51 ASN  H       2.90  1.00E+00   
 50 CYS- H      49 LEU  QB      4.50  1.00E+00 
 50 CYS- H      50 CYS- HB3     3.30  1.00E+00 
 50 CYS- HB2    52 GLY  H       5.00  1.00E+00 
 
 50 CYS- HA     50 CYS- HB2     2.70  1.00E+00
 50 CYS- HA     50 CYS- HB3     2.70  1.00E+00

# ASN 51
 51 ASN  H      52 GLY  H       2.90  1.00E+00 

# GLY 52
 52 GLY  H      52 GLY  HA2     3.30  1.00E+00 
 52 GLY  HA2    55 HIS  HE1     3.30  1.00E+00 
 52 GLY  HA3    55 HIS  HE1     3.30  1.00E+00 

# MET 53
 54 GLY  H      53 MET  HA      2.70  1.00E+00 

# GLY 54
 54 GLY  H      55 HIS  H       2.90  1.00E+00 

# HIS 55
 55 HIS  HA     56 ASN  H       2.70  1.00E+00 
 55 HIS  HA     55 HIS  HB2     2.70  1.00E+00 
 55 HIS  HA     55 HIS  HB3     2.70  1.00E+00 
 55 HIS  HB2    56 ASN  H       2.70  1.00E+00 
 55 HIS  HB2    60 CYSZ HA      5.00  1.00E+00 
 55 HIS  HB2    59 GLN  HB3     3.30  1.00E+00 
 55 HIS  HD2    55 HIS  HB2     3.30  1.00E+00 
 55 HIS  HD2    57 ALA  HA      5.00  1.00E+00
 55 HIS  HD2    60 CYSZ HA      3.30  1.00E+00 
 55 HIS  HD2    60 CYSZ HB2     3.30  1.00E+00 

# ASN 56
 56 ASN  HA     57 ALA  H       2.70  1.00E+00 
 56 ASN  H      59 GLN  HB2     5.00  1.00E+00 
 56 ASN  H      59 GLN  HB3     5.00  1.00E+00 

# ALA 57
 57 ALA  H      58 LYS  H       3.30  1.00E+00 
 57 ALA  HA     60 CYSZ HB2     2.70  1.00E+00 
 57 ALA  HA     60 CYSZ H       3.30  1.00E+00 
 57 ALA  QB     58 LYS  H       3.80  1.00E+00 
 
# LYS 58
 58 LYS  H      59 GLN  H       2.90  1.00E+00 
 58 LYS  QB     58 LYS  H       3.30  1.00E+00 
 58 LYS  QB     58 LYS  HA      2.70  1.00E+00

# GLN 59
 59 GLN  H      60 CYSZ H       2.90  1.00E+00 
 59 GLN  H      59 GLN  HB2     2.70  1.00E+00 

# CYSZ 60
 60 CYSZ H      60 CYSZ HB2     2.70  1.00E+00 
 60 CYSZ HA     60 CYSZ HB2     2.70  1.00E+00 
 
# ARG 61 

# LYS 62 

# ARG 63

####################################################################
##### End NC restraints
####################################################################


####################################################################
##### Begin O3 stem
####################################################################

#-------------------Begin C4'-O4'bond for O3------------------------
### C4' to O4'
160 RCYT C4' 160 RCYT O4' 1.46  10.00E+00
161 URA  C4' 161 URA  O4' 1.46  10.00E+00
162 RGUA C4' 162 RGUA O4' 1.46  10.00E+00
163 RCYT C4' 163 RCYT O4' 1.46  10.00E+00
164 RCYT C4' 164 RCYT O4' 1.46  10.00E+00
165 RCYT C4' 165 RCYT O4' 1.46  10.00E+00
166 URA  C4' 166 URA  O4' 1.46  10.00E+00
167 RCYT C4' 167 RCYT O4' 1.46  10.00E+00
227 RGUA C4' 227 RGUA O4' 1.46  10.00E+00
228 RADE C4' 228 RADE O4' 1.46  10.00E+00
229 RGUA C4'    229 RGUA O4' 1.46  10.00E+00
230 RGUA C4' 230 RGUA O4' 1.46  10.00E+00
231 RGUA C4'    231 RGUA O4' 1.46  10.00E+00
232 RCYT C4' 232 RCYT O4' 1.46  10.00E+00
233 RADE C4' 233 RADE O4' 1.46  10.00E+00 
234 RGUA C4' 234 RGUA O4'  1.46  10.00E+00

### C5' to O4'
160 RCYT C5' 160 RCYT O4' 2.42  10.00E+00
161 URA  C5' 161 URA  O4' 2.42  10.00E+00
162 RGUA C5' 162 RGUA O4' 2.42  10.00E+00
163 RCYT C5' 163 RCYT O4' 2.42  10.00E+00
164 RCYT C5' 164 RCYT O4' 2.42  10.00E+00
165 RCYT C5' 165 RCYT O4' 2.42  10.00E+00
166 URA  C5' 166 URA  O4' 2.42  10.00E+00
167 RCYT C5' 167 RCYT O4' 2.42  10.00E+00
227 RGUA C5' 227 RGUA O4' 2.42  10.00E+00
228 RADE C5' 228 RADE O4' 2.42  10.00E+00
229 RGUA C5'    229 RGUA O4' 2.42  10.00E+00
230 RGUA C5' 230 RGUA O4' 2.42  10.00E+00
231 RGUA C5'    231 RGUA O4' 2.42  10.00E+00
232 RCYT C5' 232 RCYT O4' 2.42  10.00E+00
233 RADE C5' 233 RADE O4' 2.42  10.00E+00 
234 RGUA C5' 234 RGUA O4'  2.42  10.00E+00

### C5' to C3'
160 RCYT C5'    160 RCYT C3'    2.58  10.00E+00
161 URA  C5'    161 URA  C3'    2.58  10.00E+00
162 RGUA C5'    162 RGUA C3'    2.58  10.00E+00
163 RCYT C5'    163 RCYT C3'    2.58  10.00E+00
164 RCYT C5'    164 RCYT C3'    2.58  10.00E+00
165 RCYT C5'    165 RCYT C3'    2.58  10.00E+00
166 URA  C5'    166 URA  C3'    2.58  10.00E+00
167 RCYT C5'    167 RCYT C3'    2.58  10.00E+00
227 RGUA C5'    227 RGUA C3'    2.58  10.00E+00
228 RADE C5'    228 RADE C3'    2.58  10.00E+00
229 RGUA C5'    229 RGUA C3'    2.58  10.00E+00
230 RGUA C5'    230 RGUA C3'    2.58  10.00E+00
231 RGUA C5'    231 RGUA C3'    2.58  10.00E+00
232 RCYT C5'    232 RCYT C3'    2.58  10.00E+00
233 RADE C5'    233 RADE C3'    2.58  10.00E+00
234 RGUA C5'    234 RGUA C3'    2.58  10.00E+00
#-------------------End C4'-O4' bond for O3-------------------------

#----------------------Begin H-bonds for O3-------------------------
#C160-G234
 160 RCYT N3   234 RGUA H1      1.89  1.00E+00
 160 RCYT N3   234 RGUA N1      3.00  1.00E+00  
 160 RCYT O2   234 RGUA H21     1.89  1.00E+00
 160 RCYT O2   234 RGUA N2      3.00  1.00E+00
 160 RCYT H41  234 RGUA O6      1.89  1.00E+00
 160 RCYT N4   234 RGUA O6      3.00  1.00E+00  

#U161-A233
 161 URA  H3   233 RADE N1      1.89  1.00E+00
 161 URA  N3   233 RADE N1      3.00  1.00E+00  
 161 URA  O4   233 RADE H61     1.89  1.00E+00
 161 URA  O4   233 RADE N6      3.00  1.00E+00  

#G162-C232
 162 RGUA H1   232 RCYT N3      1.89  1.00E+00
 162 RGUA N1   232 RCYT N3      3.00  1.00E+00 
 162 RGUA H21  232 RCYT O2      1.89  1.00E+00
 162 RGUA N2   232 RCYT O2      3.00  1.00E+00
 162 RGUA O6   232 RCYT H41     1.89  1.00E+00
 162 RGUA O6   232 RCYT N4      3.00  1.00E+00
 
#C163-G231
 163 RCYT N3   231 RGUA H1      1.89  1.00E+00
 163 RCYT N3   231 RGUA N1      3.00  1.00E+00  
 163 RCYT O2   231 RGUA H21     1.89  1.00E+00
 163 RCYT O2   231 RGUA N2      3.00  1.00E+00
 163 RCYT H41  231 RGUA O6      1.89  1.00E+00
 163 RCYT N4   231 RGUA O6      3.00  1.00E+00

#C164-G230
 164 RCYT N3   230 RGUA H1      1.89  1.00E+00
 164 RCYT N3   230 RGUA N1      3.00  1.00E+00  
 164 RCYT O2   230 RGUA H21     1.89  1.00E+00
 164 RCYT O2   230 RGUA N2      3.00  1.00E+00
 164 RCYT H41  230 RGUA O6      1.89  1.00E+00
 164 RCYT N4   230 RGUA O6      3.00  1.00E+00

#C165-G229
 165 RCYT N3   229 RGUA H1      1.89  1.00E+00
 165 RCYT N3   229 RGUA N1      3.00  1.00E+00  
 165 RCYT O2   229 RGUA H21     1.89  1.00E+00
 165 RCYT O2   229 RGUA N2      3.00  1.00E+00
 165 RCYT H41  229 RGUA O6      1.89  1.00E+00
 165 RCYT N4   229 RGUA O6      3.00  1.00E+00

#U166-A228
 166 URA  H3   228 RADE N1      1.89  1.00E+00
 166 URA  N3   228 RADE N1      3.00  1.00E+00  
 166 URA  O4   228 RADE H61     1.89  1.00E+00
 166 URA  O4   228 RADE N6      3.00  1.00E+00 
 
#C167-G227
 167 RCYT N3   227 RGUA H1      1.89  1.00E+00
 167 RCYT N3   227 RGUA N1      3.00  1.00E+00  
 167 RCYT O2   227 RGUA H21     1.89  1.00E+00
 167 RCYT O2   227 RGUA N2      3.00  1.00E+00
 167 RCYT H41  227 RGUA O6      1.89  1.00E+00
 167 RCYT N4   227 RGUA O6      3.00  1.00E+00
#-------------------End H-bonds for O3------------------------------

#---------------Begin intraresidue and interresidue NOEs for O3-----
#C160
 160  RCYT  H6   160  RCYT  H2'          4.00    1.00E+00
 160  RCYT  H6   160  RCYT  H3'          3.00    1.00E+00
 160  RCYT  H3'         160  RCYT  H5"          3.30    1.00E+00
 160  RCYT  H4'   160  RCYT  H5'          2.70    1.00E+00
 160  RCYT  H4'   160  RCYT  H5"          2.70    1.00E+00

 160  RCYT  H2'         161  URA   H6           2.70    1.00E+00
 160  RCYT  H3'         161  URA   H6           3.30    1.00E+00

#U161
 161  URA  H6           161  URA   H2'          4.00    1.00E+00
 161  URA  H6           161  URA   H3'          3.00    1.00E+00
 161  URA  H3'          161  URA   H5"          3.30    1.00E+00
 161  URA  H4'          161  URA   H5'          2.70    1.00E+00
 161  URA  H4'          161  URA   H5"          2.70    1.00E+00

 161  URA  H2'          162  RGUA  H8           2.70    1.00E+00
 161  URA  H3'          162  RGUA  H8           3.30    1.00E+00

#G162
 162  RGUA  H8          162  RGUA  H2'          4.00    1.00E+00
 162  RGUA  H8          162  RGUA  H3'          3.00    1.00E+00
 162  RGUA  H3'         162  RGUA  H5"          3.30    1.00E+00
 162  RGUA  H4'         162  RGUA  H5'          2.70    1.00E+00
 162  RGUA  H4'         162  RGUA  H5"          2.70    1.00E+00

 162  RGUA  H8          163  RCYT  H5           5.00    1.00E+00
 162  RGUA  H2'         163  RCYT  H6           2.70    1.00E+00
 162  RGUA  H3'         163  RCYT  H6           3.30    1.00E+00

#C163
 163  RCYT  H6   163  RCYT  H2'    4.00   1.00E+00
 163  RCYT  H6   163  RCYT  H3'    3.00   1.00E+00
 163  RCYT  H3'         163  RCYT  H5"          3.30    1.00E+00
 163  RCYT  H4'   163  RCYT  H5'    2.70   1.00E+00
 163  RCYT  H4'   163  RCYT  H5"    2.70   1.00E+00

 163  RCYT  H6          164  RCYT  H5           5.00    1.00E+00
 163  RCYT  H2'         164  RCYT  H6           2.70    1.00E+00
 163  RCYT  H3'         164  RCYT  H6           3.30    1.00E+00

#C164
 164  RCYT  H6   164  RCYT  H2'    4.00   1.00E+00
 164  RCYT  H6   164  RCYT  H3'    3.00   1.00E+00
 164  RCYT  H3'         164  RCYT  H5"          3.30    1.00E+00
 164  RCYT  H4'   164  RCYT  H5'    2.70   1.00E+00
 164  RCYT  H4'   164  RCYT  H5"    2.70   1.00E+00

 164  RCYT  H6          165  RCYT  H5           5.00    1.00E+00
 164  RCYT  H2'         165  RCYT  H6           2.70    1.00E+00
 164  RCYT  H3'         165  RCYT  H6           3.30    1.00E+00

#C165
 165  RCYT  H6   165  RCYT  H2'    4.00   1.00E+00
 165  RCYT  H6   165  RCYT  H3'    3.00   1.00E+00
 165  RCYT  H3'         165  RCYT  H5"          3.30    1.00E+00
 165  RCYT  H4'   165  RCYT  H5'    2.70   1.00E+00
 165  RCYT  H4'   165  RCYT  H5"    2.70   1.00E+00

 165  RCYT  H6          166  URA   H5           5.00    1.00E+00
 165  RCYT  H2'         166  URA   H6           2.70    1.00E+00
 165  RCYT  H3'         166  URA   H6           3.30    1.00E+00

#U166
 166  URA  H6           166  URA  H2'           4.00    1.00E+00
 166  URA  H6           166  URA  H3'           3.00    1.00E+00
 166  URA  H3'          166  URA  H5"           3.30    1.00E+00
 166  URA  H4'          166  URA  H5'           2.70    1.00E+00
 166  URA  H4'          166  URA  H5"           2.70    1.00E+00

 166  URA  H2'          167  RCYT  H6           2.70    1.00E+00
 166  URA  H3'          167  RCYT  H6           3.30    1.00E+00

#C167
 167  RCYT  H6   167  RCYT  H2'    4.00   1.00E+00
 167  RCYT  H6   167  RCYT  H3'    3.00   1.00E+00
 167  RCYT  H3'         167  RCYT  H5"          3.30    1.00E+00
 167  RCYT  H4'   167  RCYT  H5'    2.70   1.00E+00
 167  RCYT  H4'   167  RCYT  H5"    2.70   1.00E+00

#G227
 227  RGUA  H8          227  RGUA  H2'          4.00    1.00E+00
 227  RGUA  H8          227  RGUA  H3'          3.00    1.00E+00
 227  RGUA  H3'         227  RGUA  H5"          3.30    1.00E+00
 227  RGUA  H4'         227  RGUA  H5'          2.70    1.00E+00
 227  RGUA  H4'         227  RGUA  H5"          2.70    1.00E+00

 227  RGUA  H2'         228  RADE  H8           2.70    1.00E+00
 227  RGUA  H3'         228  RADE  H8           3.30    1.00E+00 

#A228
 228  RADE  H8          228  RADE  H2'          4.00    1.00E+00
 228  RADE  H8          228  RADE  H3'          3.00    1.00E+00
 228  RADE  H3'         228  RADE  H5"          3.30    1.00E+00
 228  RADE  H4'         228  RADE  H5'          2.70    1.00E+00
 228  RADE  H4'         228  RADE  H5"          2.70    1.00E+00
 
 228  RADE  H2          229  RGUA  H1'          5.00    1.00E+00 
 228  RADE  H2          167  RCYT  H1'          5.00    1.00E+00 
 228  RADE  H2'         229  RGUA  H8           2.70    1.00E+00
 228  RADE  H3'         229  RGUA  H8           3.30    1.00E+00

#G229
 229  RGUA  H8          229  RGUA  H2'          4.00    1.00E+00
 229  RGUA  H8          229  RGUA  H3'          3.00    1.00E+00
 229  RGUA  H3'         229  RGUA  H5"          3.30    1.00E+00
 229  RGUA  H4'         229  RGUA  H5'          2.70    1.00E+00
 229  RGUA  H4'         229  RGUA  H5"          2.70    1.00E+00

#229  RGUA  H8          230  RGUA  H8           5.00    1.00E+00
 229  RGUA  H2'         230  RGUA  H8           2.70    1.00E+00
 229  RGUA  H3'         230  RGUA  H8           3.30    1.00E+00

#G230
 230  RGUA  H8          230  RGUA  H2'          4.00    1.00E+00
 230  RGUA  H8          230  RGUA  H3'          3.00    1.00E+00
 230  RGUA  H3'         230  RGUA  H5"          3.30    1.00E+00
 230  RGUA  H4'         230  RGUA  H5'          2.70    1.00E+00
 230  RGUA  H4'         230  RGUA  H5"          2.70    1.00E+00

#230  RGUA  H8          231  RGUA  H8           5.00    1.00E+00
 230  RGUA  H2'         231  RGUA  H8           2.70    1.00E+00
 230  RGUA  H3'         231  RGUA  H8           3.30    1.00E+00

#G231
 231  RGUA  H8          231  RGUA  H2'          4.00    1.00E+00
 231  RGUA  H8          231  RGUA  H3'          3.00    1.00E+00
 231  RGUA  H3'         231  RGUA  H5"          3.30    1.00E+00
 231  RGUA  H4'         231  RGUA  H5'          2.70    1.00E+00
 231  RGUA  H4'         231  RGUA  H5"          2.70    1.00E+00

 231  RGUA  H8          232  RCYT  H5           5.00    1.00E+00
 231  RGUA  H2'         232  RCYT  H6           2.70    1.00E+00
 231  RGUA  H3'         232  RCYT  H6           3.30    1.00E+00

#C232
 232  RCYT  H6   232  RCYT  H2'    4.00   1.00E+00
 232  RCYT  H6   232  RCYT  H3'    3.00   1.00E+00
 232  RCYT  H3'         232  RCYT  H5"          3.30    1.00E+00
 232  RCYT  H4'   232  RCYT  H5'    2.70   1.00E+00
 232  RCYT  H4'   232  RCYT  H5"    2.70   1.00E+00

 232  RCYT  H2'         233  RADE  H8           2.70    1.00E+00
 232  RCYT  H3'         233  RADE  H8           3.30    1.00E+00

#A233 
 233  RADE  H8    233  RADE  H2'   4.00   1.00E+00
 233  RADE  H8    233  RADE  H3'    3.00   1.00E+00 
 233  RADE  H3'         233  RADE  H5"          3.30    1.00E+00
 233  RADE  H4'   233  RADE  H5'    2.70   1.00E+00
 233  RADE  H4'   233  RADE  H5"    2.70   1.00E+00
 
 233  RADE  H2'         234  RGUA  H8           2.70    1.00E+00
 233  RADE  H3'         234  RGUA  H8           3.30    1.00E+00

#G234
 234  RGUA  H8          234  RGUA  H2'          4.00    1.00E+00
 234  RGUA  H8          234  RGUA  H3'          3.00    1.00E+00
 234  RGUA  H3'         234  RGUA  H5"          3.30    1.00E+00
 234  RGUA  H4'         234  RGUA  H5'          2.70    1.00E+00
 234  RGUA  H4'         234  RGUA  H5"          2.70    1.00E+00#
#--------------End intraresidue and interresidue NOEs for O3--------

#--------------Begin phosphate limit of approach for O3 ------------
 160 RCYT  P     227 RGUA   P     13.0   1.00E+00
 160 RCYT  P     228 RADE   P     10.5   1.00E+00
 160 RCYT  P     229 RGUA   P     10.5   1.00E+00
 160 RCYT  P     230 RGUA   P     13.0   1.00E+00

 161 URA   P     227 RGUA  P      10.5   1.00E+00
 161 URA   P     228 RADE  P      10.5   1.00E+00
 161 URA   P     229 RGUA  P      13.0   1.00E+00

 162 RGUA  P     227 RGUA  P      10.5   1.00E+00
 162 RGUA  P     228 RADE  P      13.0   1.00E+00

 163 RCYT  P     227 RGUA  P      13.0   1.00E+00
#--------------End phosphate limit of approach for O3 --------------

####################################################################
#### End O3 stem
####################################################################


####################################################################
#### Begin linker-1 and SL-A 
####################################################################

#---------------Begin C4'-O4'bond for linker-1 and SL-A-------------
# C4'-O4' bond is not in the DYANA residue library -this is a cov. bond
#linker-1
168 RADE C4'    168 RADE O4'    1.46  10.00E+00
169 URA  C4'    169 URA  O4'    1.46  10.00E+00
170 RCYT C4'    170 RCYT O4'    1.46  10.00E+00

#SL-A
171 RCYT C4' 171 RCYT O4' 1.46  10.00E+00
172 RGUA C4' 172 RGUA O4' 1.46  10.00E+00
173 URA  C4' 173 URA  O4' 1.46  10.00E+00
174 RCYT C4' 174 RCYT O4' 1.46  10.00E+00
175 URA  C4' 175 URA  O4' 1.46  10.00E+00
176 RCYT C4' 176 RCYT O4' 1.46  10.00E+00
177 RGUA C4' 177 RGUA O4' 1.46  10.00E+00
178 RCYT C4' 178 RCYT O4' 1.46  10.00E+00
179 URA  C4' 179 URA  O4' 1.46  10.00E+00
180 URA  C4' 180 URA  O4' 1.46  10.00E+00
181 RADE C4' 181 RADE O4' 1.46  10.00E+00
182 URA  C4' 182 URA  O4' 1.46  10.00E+00
183 URA  C4' 183 URA  O4' 1.46  10.00E+00
184 RCYT C4' 184 RCYT O4' 1.46  10.00E+00
185 RGUA C4'    185 RGUA O4' 1.46  10.00E+00
186 RGUA C4' 186 RGUA O4' 1.46  10.00E+00
187 RGUA C4'    187 RGUA O4' 1.46  10.00E+00
188 RGUA C4' 188 RGUA O4' 1.46  10.00E+00
189 RADE C4' 189 RADE O4' 1.46  10.00E+00
190 RGUA C4' 190 RGUA O4' 1.46  10.00E+00
191 RCYT C4' 191 RCYT O4' 1.46  10.00E+00
192 RGUA C4' 192 RGUA O4' 1.46  10.00E+00
193 RGUA C4' 193 RGUA O4' 1.46  10.00E+00
194 RADE C4' 194 RADE O4' 1.46  10.00E+00 
195 RCYT C4' 195 RCYT O4' 1.46  10.00E+00
196 RGUA C4' 196 RGUA O4'  1.46  10.00E+00

### C5' to O4'
#linker-1
168 RADE C5'    168 RADE O4'    2.42  10.00E+00
169 URA  C5'    169 URA  O4'    2.42  10.00E+00
170 RCYT C5'    170 RCYT O4'    2.42  10.00E+00

#SL-A
171 RCYT C5' 171 RCYT O4' 2.42  10.00E+00
172 RGUA C5' 172 RGUA O4' 2.42  10.00E+00
173 URA  C5' 173 URA  O4' 2.42  10.00E+00
174 RCYT C5' 174 RCYT O4' 2.42  10.00E+00
175 URA  C5' 175 URA  O4' 2.42  10.00E+00
176 RCYT C5' 176 RCYT O4' 2.42  10.00E+00
177 RGUA C5' 177 RGUA O4' 2.42  10.00E+00 
178 RCYT C5' 178 RCYT O4' 2.42  10.00E+00
179 URA  C5' 179 URA  O4' 2.42  10.00E+00
180 URA  C5' 180 URA  O4' 2.42  10.00E+00
181 RADE C5' 181 RADE O4' 2.42  10.00E+00
182 URA  C5' 182 URA  O4' 2.42  10.00E+00
183 URA  C5' 183 URA  O4' 2.42  10.00E+00
184 RCYT C5' 184 RCYT O4' 2.42  10.00E+00
185 RGUA C5'    185 RGUA O4' 2.42  10.00E+00
186 RGUA C5' 186 RGUA O4' 2.42  10.00E+00
187 RGUA C5'    187 RGUA O4' 2.42  10.00E+00
188 RGUA C5' 188 RGUA O4' 2.42  10.00E+00
189 RADE C5' 189 RADE O4' 2.42  10.00E+00
190 RGUA C5' 190 RGUA O4' 2.42  10.00E+00
191 RCYT C5' 191 RCYT O4' 2.42  10.00E+00
192 RGUA C5' 192 RGUA O4' 2.42  10.00E+00
193 RGUA C5' 193 RGUA O4' 2.42  10.00E+00
194 RADE C5' 194 RADE O4' 2.42  10.00E+00 
195 RCYT C5' 195 RCYT O4' 2.42  10.00E+00
196 RGUA C5' 196 RGUA O4'  2.42  10.00E+00

### C5' to C3'
#linker-1
168 RADE C5'    168 RADE C3'    2.58  10.00E+00
169 URA  C5'    169 URA  C3'    2.58  10.00E+00
170 RCYT C5'    170 RCYT C3'    2.58  10.00E+00

#SL-A
171 RCYT C5'    171 RCYT C3'    2.58  10.00E+00
172 RGUA C5'    172 RGUA C3'    2.58  10.00E+00
173 URA  C5'    173 URA  C3'    2.58  10.00E+00
174 RCYT C5'    174 RCYT C3'    2.58  10.00E+00
175 URA  C5'    175 URA  C3'    2.58  10.00E+00
176 RCYT C5'    176 RCYT C3'    2.58  10.00E+00
177 RGUA C5'    177 RGUA C3'    2.58  10.00E+00
178 RCYT C5'    178 RCYT C3'    2.58  10.00E+00
179 URA  C5'    179 URA  C3'    2.58  10.00E+00
180 URA  C5'    180 URA  C3'    2.58  10.00E+00
181 RADE C5'    181 RADE C3'    2.58  10.00E+00
182 URA  C5'    182 URA  C3'    2.58  10.00E+00
183 URA  C5'    183 URA  C3'    2.58  10.00E+00
184 RCYT C5'    184 RCYT C3'    2.58  10.00E+00
185 RGUA C5'    185 RGUA C3'    2.58  10.00E+00
186 RGUA C5'    186 RGUA C3'    2.58  10.00E+00
187 RGUA C5'    187 RGUA C3'    2.58  10.00E+00
188 RGUA C5'    188 RGUA C3'    2.58  10.00E+00
189 RADE C5'    189 RADE C3'    2.58  10.00E+00
190 RGUA C5'    190 RGUA C3'    2.58  10.00E+00
191 RCYT C5'    191 RCYT C3'    2.58  10.00E+00
192 RGUA C5'    192 RGUA C3'    2.58  10.00E+00
193 RGUA C5'    193 RGUA C3'    2.58  10.00E+00
194 RADE C5'    194 RADE C3'    2.58  10.00E+00
195 RCYT C5'    195 RCYT C3'    2.58  10.00E+00
196 RGUA C5'    196 RGUA C3'    2.58  10.00E+00
#---------------End C4'-O4' bond for linker-1 and SL-A--------------

#------------------Begin SL-A H-bonds-------------------------------
#C171-G196
 171 RCYT N3   196 RGUA H1      1.89  1.00E+00
 171 RCYT N3   196 RGUA N1      3.00  1.00E+00  
 171 RCYT O2   196 RGUA H21     1.89  1.00E+00
 171 RCYT O2   196 RGUA N2      3.00  1.00E+00
 171 RCYT H41  196 RGUA O6      1.89  1.00E+00
 171 RCYT N4   196 RGUA O6      3.00  1.00E+00

#G172-C195
 172 RGUA H1   195 RCYT N3      1.89  1.00E+00
 172 RGUA N1   195 RCYT N3      3.00  1.00E+00 
 172 RGUA H21  195 RCYT O2      1.89  1.00E+00
 172 RGUA N2   195 RCYT O2      3.00  1.00E+00
 172 RGUA O6   195 RCYT H41     1.89  1.00E+00
 172 RGUA O6   195 RCYT N4      3.00  1.00E+00 

#U173-A194
 173 URA  H3   194 RADE N1      1.89  1.00E+00
 173 URA  N3   194 RADE N1      3.00  1.00E+00  
 173 URA  O4   194 RADE H61     1.89  1.00E+00
 173 URA  O4   194 RADE N6      3.00  1.00E+00   

#C174-G193
 174 RCYT N3   193 RGUA H1      1.89  1.00E+00
 174 RCYT N3   193 RGUA N1      3.00  1.00E+00  
 174 RCYT O2   193 RGUA H21     1.89  1.00E+00
 174 RCYT O2   193 RGUA N2      3.00  1.00E+00
 174 RCYT H41  193 RGUA O6      1.89  1.00E+00
 174 RCYT N4   193 RGUA O6      3.00  1.00E+00 

#C176-G192
 176 RCYT N3   192 RGUA H1      1.89  1.00E+00
 176 RCYT N3   192 RGUA N1      3.00  1.00E+00  
 176 RCYT O2   192 RGUA H21     1.89  1.00E+00
 176 RCYT O2   192 RGUA N2      3.00  1.00E+00
 176 RCYT H41  192 RGUA O6      1.89  1.00E+00
 176 RCYT N4   192 RGUA O6      3.00  1.00E+00 

#G177-C191
 177 RGUA H1   191 RCYT N3      1.89  1.00E+00
 177 RGUA N1   191 RCYT N3      3.00  1.00E+00 
 177 RGUA H21  191 RCYT O2      1.89  1.00E+00
 177 RGUA N2   191 RCYT O2      3.00  1.00E+00
 177 RGUA O6   191 RCYT H41     1.89  1.00E+00
 177 RGUA O6   191 RCYT N4      3.00  1.00E+00 

#C178-G190
 178 RCYT N3   190 RGUA H1      1.89  1.00E+00
 178 RCYT N3   190 RGUA N1      3.00  1.00E+00  
 178 RCYT O2   190 RGUA H21     1.89  1.00E+00
 178 RCYT O2   190 RGUA N2      3.00  1.00E+00
 178 RCYT H41  190 RGUA O6      1.89  1.00E+00
 178 RCYT N4   190 RGUA O6      3.00  1.00E+00 

#U179-A189
 179 URA  H3   189 RADE N1      1.89  1.00E+00
 179 URA  N3   189 RADE N1      3.00  1.00E+00  
 179 URA  O4   189 RADE H61     1.89  1.00E+00
 179 URA  O4   189 RADE N6      3.00  1.00E+00  
 
#U180-G188
 180 URA H3    188 RGUA O6      1.89  1.00E+00 
 180 URA N3    188 RGUA O6    3.00  1.00E+00 
 180 URA O2    188 RGUA H1    1.89  1.00E+00 
 180 URA O2    188 RGUA N1    3.00  1.00E+00  

#A181-G187
 181 RADE N1   187 RGUA H1      1.89  1.00E+00
 181 RADE N1   187 RGUA N1    3.00  1.00E+00 
 181 RADE H61  187 RGUA O6    1.89  1.00E+00 
 181 RADE N6   187 RGUA O6    3.00  1.00E+00 
#-------------------End SL-A H-bonds--------------------------------

#-----Begin liker-1 and SL-A intraresidue and interresidue NOEs-----
#### Linker-1

# RADE 168
 168  RADE  H8          168  RADE  H2'          3.30    1.00E+00
 168  RADE  H8          168  RADE  H3'          5.00    1.00E+00

 168 RADE  H1'          170  RCYT  H1'          5.00    1.00E+00 #Unusual

# URA 169
 169  URA  H6           169  URA  H2'           4.00    1.00E+00
 169  URA  H6           169  URA  H3'           3.00    1.00E+00

# RCYT 170
 170  RCYT  H6          170  RCYT  H2'          4.00    1.00E+00
 170  RCYT  H6          170  RCYT  H3'          3.00    1.00E+00
 170  RCYT  H3'         170  RCYT  H5"          3.30    1.00E+00
 170  RCYT  H4'         170  RCYT  H5'          2.70    1.00E+00
 170  RCYT  H4'         170  RCYT  H5"          2.70    1.00E+00

 170  RCYT  H6          171  RCYT  H6           5.00    1.00E+00
 170  RCYT  H5          171  RCYT  H5           5.00    1.00E+00
 170  RCYT  H2'         171  RCYT  H6           2.70    1.00E+00
 170  RCYT  H3'         171  RCYT  H6           3.30    1.00E+00

#### SL-A

#C171
 171  RCYT  H6   171  RCYT  H2'    4.00   1.00E+00
 171  RCYT  H6   171  RCYT  H3'    3.00   1.00E+00
 171  RCYT  H2'         172  RGUA  H8           2.70    1.00E+00
 171  RCYT  H3'         172  RGUA  H8           3.30    1.00E+00

#G172
 172  RGUA  H8          172  RGUA  H2'          4.00    1.00E+00
 172  RGUA  H8          172  RGUA  H3'          3.00    1.00E+00
 172  RGUA  H3'         172  RGUA  H5"          3.30    1.00E+00
 172  RGUA  H4'         172  RGUA  H5'          2.70    1.00E+00
 172  RGUA  H4'         172  RGUA  H5"          2.70    1.00E+00

 172  RGUA  H8          173  URA   H5           5.00    1.00E+00
 172  RGUA  H2'         173  URA   H6           2.70    1.00E+00
 172  RGUA  H3'         173  URA   H6           3.30    1.00E+00

#U173
 173  URA  H6           173  URA  H2'           4.00    1.00E+00
 173  URA  H6           173  URA  H3'           3.00    1.00E+00
 173  URA  H3'          173  URA  H5"           3.30    1.00E+00
 173  URA  H4'          173  URA  H5'           2.70    1.00E+00
 173  URA  H4'          173  URA  H5"           2.70    1.00E+00

 173  URA  H2'          174  RCYT  H6           2.70    1.00E+00
 173  URA  H3'          174  RCYT  H6           3.30    1.00E+00

#C174
 174  RCYT  H6   174  RCYT  H2'    4.00   1.00E+00
 174  RCYT  H6   174  RCYT  H3'    3.00   1.00E+00
 174  RCYT  H3'         174  RCYT  H5"          3.30    1.00E+00
 174  RCYT  H4'   174  RCYT  H5'    2.70   1.00E+00
 174  RCYT  H4'   174  RCYT  H5"    2.70   1.00E+00

 174  RCYT  H2'         176  RCYT  H6           2.70    1.00E+00 

#U175
 175  URA  H6           175  URA  H2'           4.00    1.00E+00
 175  URA  H6           175  URA  H3'           3.00    1.00E+00
 175  URA  H6           175  URA  H5'           5.00    1.00E+00
 175  URA  H6           175  URA  H5"           5.00    1.00E+00

#C176
 176  RCYT  H6   176  RCYT  H2'    4.00   1.00E+00
 176  RCYT  H6   176  RCYT  H3'    3.00   1.00E+00

 176  RCYT  H2'         177  RGUA  H8           2.70    1.00E+00
 176  RCYT  H3'         177  RGUA  H8           3.30    1.00E+00

#G177
 177  RGUA  H8          177  RGUA  H2'          4.00    1.00E+00
 177  RGUA  H8          177  RGUA  H3'          3.00    1.00E+00
 177  RGUA  H3'         177  RGUA  H5"          3.30    1.00E+00
 177  RGUA  H4'         177  RGUA  H5'          2.70    1.00E+00
 177  RGUA  H4'         177  RGUA  H5"          2.70    1.00E+00

 177  RGUA  H8          178  RCYT  H5           5.00    1.00E+00
 177  RGUA  H2'         178  RCYT  H6           2.70    1.00E+00
 177  RGUA  H3'         178  RCYT  H6           3.30    1.00E+00

#C178
 178  RCYT  H6   178  RCYT  H2'    4.00   1.00E+00
 178  RCYT  H6   178  RCYT  H3'    3.00   1.00E+00
 178  RCYT  H3'         178  RCYT  H5"          3.30    1.00E+00
 178  RCYT  H4'   178  RCYT  H5'    2.70   1.00E+00
 178  RCYT  H4'   178  RCYT  H5"    2.70   1.00E+00

 178  RCYT  H6          179  URA   H5           5.00    1.00E+00
 178  RCYT  H2'         179  URA   H6           2.70    1.00E+00
 178  RCYT  H3'         179  URA   H6           3.30    1.00E+00
 
#U179
 179  URA  H6           179  URA  H2'           4.00    1.00E+00
 179  URA  H6           179  URA  H3'           3.00    1.00E+00
 179  URA  H3'          179  URA  H5"           3.30    1.00E+00
 179  URA  H4'          179  URA  H5'           2.70    1.00E+00
 179  URA  H4'          179  URA  H5"           2.70    1.00E+00

 179  URA  H6           180  URA  H5            5.00    1.00E+00
 179  URA  H2'          180  URA  H6            2.70    1.00E+00
 179  URA  H3'          180  URA  H6            3.30    1.00E+00

#U180
 180  URA  H6           180  URA  H2'           4.00    1.00E+00
 180  URA  H6           180  URA  H3'           3.00    1.00E+00
 180  URA  H3'          180  URA  H5"           3.30    1.00E+00
 180  URA  H4'          180  URA  H5'           2.70    1.00E+00
 180  URA  H4'          180  URA  H5"           2.70    1.00E+00

 180  URA  H2'          181  RADE  H8           2.70    1.00E+00
 180  URA  H3'          181  RADE  H8           3.30    1.00E+00 

#A181
 181  RADE  H8          181  RADE  H2'          4.00    1.00E+00
 181  RADE  H8          181  RADE  H3'          3.00    1.00E+00
 181  RADE  H3'         181  RADE  H5"          3.30    1.00E+00
 181  RADE  H4'         181  RADE  H5'          2.70    1.00E+00
 181  RADE  H4'         181  RADE  H5"          2.70    1.00E+00
 
 181  RADE  H2          188  RGUA  H1'          5.00    1.00E+00 

#U182

#U183

#C184
###It has very upfield-shifted H5', H5" @ 3.935,4.012 ppm
 
#G185

#G186

#G187 
 187  RGUA  H8          187  RGUA  H2'          4.00    1.00E+00
 187  RGUA  H8          187  RGUA  H3'          3.00    1.00E+00

 187  RGUA  H2'         188  RGUA  H8           2.70    1.00E+00
 187  RGUA  H3'         188  RGUA  H8           3.30    1.00E+00
 
#G188
 188  RGUA  H8          188  RGUA  H2'          4.00    1.00E+00
 188  RGUA  H8          188  RGUA  H3'          3.00    1.00E+00
 188  RGUA  H3'         188  RGUA  H5"          3.30    1.00E+00
 188  RGUA  H4'         188  RGUA  H5'          2.70    1.00E+00
 188  RGUA  H4'         188  RGUA  H5"          2.70    1.00E+00

 188  RGUA  H2'         189  RADE  H8           2.70    1.00E+00
 188  RGUA  H3'         189  RADE  H8           3.30    1.00E+00

#A189 
 189  RADE  H8    189  RADE  H2'   4.00   1.00E+00
 189  RADE  H8    189  RADE  H3'    3.00   1.00E+00 
 189  RADE  H3'         189  RADE  H5"          3.30    1.00E+00
 189  RADE  H4'   189  RADE  H5'    2.70   1.00E+00
 189  RADE  H4'   189  RADE  H5"    2.70   1.00E+00
 
 189  RADE  H2'         190  RGUA  H8           5.00    1.00E+00
 189  RADE  H3'         190  RGUA  H8           3.30    1.00E+00
 189  RADE  H2    190  RGUA  H1'    5.00   1.00E+00
 189  RADE  H2    180  URA   H1'    5.00   1.00E+00

#G190
 190  RGUA  H8          190  RGUA  H2'          4.00    1.00E+00
 190  RGUA  H8          190  RGUA  H3'          3.00    1.00E+00
 190  RGUA  H3'         190  RGUA  H5"          3.30    1.00E+00
 190  RGUA  H4'         190  RGUA  H5'          2.70    1.00E+00
 190  RGUA  H4'         190  RGUA  H5"          2.70    1.00E+00

 190  RGUA  H8          191  RCYT  H5           5.00    1.00E+00
 190  RGUA  H2'         191  RCYT  H6           2.70    1.00E+00
 190  RGUA  H3'         191  RCYT  H6           3.30    1.00E+00

#C191
 191  RCYT  H6   191  RCYT  H2'    4.00   1.00E+00
 191  RCYT  H6   191  RCYT  H3'    3.00   1.00E+00
 191  RCYT  H3'         191  RCYT  H5"          3.30    1.00E+00
 191  RCYT  H4'   191  RCYT  H5'    2.70   1.00E+00
 191  RCYT  H4'   191  RCYT  H5"    2.70   1.00E+00
 
 191  RCYT  H2'    192  RGUA  H8  2.70 1.00E+00
 191  RCYT  H3'    192  RGUA  H8  3.30 1.00E+00

#G192
 192  RGUA  H8          192  RGUA  H2'          4.00    1.00E+00
 192  RGUA  H8          192  RGUA  H3'          3.00    1.00E+00
 192  RGUA  H3'         192  RGUA  H5"          3.30    1.00E+00
 192  RGUA  H4'         192  RGUA  H5'          2.70    1.00E+00
 192  RGUA  H4'         192  RGUA  H5"          2.70    1.00E+00

 192  RGUA  H2'         193  RGUA  H8           2.70    1.00E+00
 192  RGUA  H3'         193  RGUA  H8           3.30    1.00E+00

#G193
 193  RGUA  H8          193  RGUA  H2'          4.00    1.00E+00
 193  RGUA  H8          193  RGUA  H3'          3.00    1.00E+00
 193  RGUA  H3'         193  RGUA  H5"          3.30    1.00E+00
 193  RGUA  H4'         193  RGUA  H5'          2.70    1.00E+00
 193  RGUA  H4'         193  RGUA  H5"          2.70    1.00E+00

 193  RGUA  H2'         194  RADE  H8           2.70    1.00E+00
 193  RGUA  H3'         194  RADE  H8           3.30    1.00E+00

#A194 
 194  RADE  H8    194  RADE  H2'   4.00   1.00E+00
 194  RADE  H8    194  RADE  H3'    3.00   1.00E+00 
 194  RADE  H3'         194  RADE  H5"          3.30    1.00E+00
 194  RADE  H4'   194  RADE  H5'    2.70   1.00E+00
 194  RADE  H4'   194  RADE  H5"    2.70   1.00E+00

 194  RADE  H8   195  RCYT  H5  5.00 1.00E+00
 194  RADE  H2   195  RCYT  H1'    5.00   1.00E+00
 194  RADE  H2   174  RCYT  H1'    5.00   1.00E+00
 194  RADE  H2'   195  RCYT  H6  2.70 1.00E+00
 194  RADE  H3'   195  RCYT  H6  3.30 1.00E+00
 
#C195
 195  RCYT  H6   195  RCYT  H2'    4.00   1.00E+00
 195  RCYT  H6   195  RCYT  H3'    3.00   1.00E+00
 195  RCYT  H3'         195  RCYT  H5"          3.30    1.00E+00
 195  RCYT  H4'   195  RCYT  H5'    2.70   1.00E+00
 195  RCYT  H4'   195  RCYT  H5"    2.70   1.00E+00
 
 195  RCYT  H2'    196  RGUA  H8  2.70 1.00E+00
 195  RCYT  H3'    196  RGUA  H8  3.30 1.00E+00

#G196
 196  RGUA  H8          196  RGUA  H2'          4.00    1.00E+00
 196  RGUA  H8          196  RGUA  H3'          3.00    1.00E+00
 196  RGUA  H3'         196  RGUA  H5"          3.30    1.00E+00
 196  RGUA  H4'         196  RGUA  H5'          2.70    1.00E+00
 196  RGUA  H4'         196  RGUA  H5"          2.70    1.00E+00
#-------End linker-1 and SL-A intraresidue and interresidue NOEs---

#--------------Begin SL-A phosphate limit of approach--------------
 171 RCYT  P     189 RADE  P      13.0   1.00E+00
 171 RCYT  P     190 RGUA  P      10.5   1.00E+00
 171 RCYT  P     191 RCYT  P      10.5   1.00E+00
 171 RCYT  P     192 RGUA  P      13.0   1.00E+00

 172 RGUA  P     188 RGUA  P      13.0   1.00E+00
 172 RGUA  P     189 RADE  P      10.5   1.00E+00
 172 RGUA  P     190 RGUA  P      10.5   1.00E+00
 172 RGUA  P     191 RCYT  P      13.0   1.00E+00

 173 URA   P     187 RGUA  P      13.0   1.00E+00
 173 URA   P     188 RGUA  P      10.5   1.00E+00
 173 URA   P     189 RADE  P      10.5   1.00E+00
 173 URA   P     190 RGUA  P      13.0   1.00E+00

 174 RCYT  P     187 RGUA  P      10.5   1.00E+00
 174 RCYT  P     188 RGUA  P      10.5   1.00E+00
 174 RCYT  P     189 RADE  P      13.0   1.00E+00

 176 RCYT  P     187 RGUA  P      10.5   1.00E+00
 176 RCYT  P     188 RGUA  P      13.0   1.00E+00

 177 RGUA  P     187 RGUA  P      13.0   1.00E+00
#----------------End SL-A phosphate limit of approach--------------

####################################################################
#### End linker-1 and SL-A 
####################################################################

####################################################################
#### Begin intermolecular interactions
####################################################################

#-------------------------------------------------------------------
# Intermolecular Hydrogen Bonds (H-bonds)
#-------------------------------------------------------------------

 197 RADE  H62     59 GLN  O      2.00  1.00E+00
 197 RADE  N6      59 GLN  O      3.00  1.00E+00
 197 RADE  N7      61 ARG  H      2.00  1.00E+00
 197 RADE  N7      61 ARG  N      3.00  1.00E+00

#197 RADE  OP1     61 ARG  NE     3.00  1.00E+00
#196 RGUA  OP2     62 LYS  HZ1    2.00  1.00E+00 #potential

#168 RADE  OP1     58 LYS  HZ1    2.00  1.00E+00
#168 RADE  OP1     58 LYS  NZ     3.00  1.00E+00

###170 RCYT  N3      63 ARG  HH22   2.00  1.00E+00
###170 RCYT  N3      63 ARG  NH2    3.00  1.00E+00
###170 RCYT  O2      63 ARG  HE     2.00  1.00E+00
###170 RCYT  O2      63 ARG  NE     3.00  1.00E+00

#-----------------------------------------------------------
# Intermolecular NOEs
#-----------------------------------------------------------

#RADE 168  
 168 RADE  H2      49 LEU  QD1    3.20  1.00E+00 #Strong
 168 RADE  H1'     49 LEU  QD1    5.50  1.00E+00 #Much weaker than H2

#168 RADE  H2      55 HIS  HD2    5.00  1.00E+00 #sd

 168 RADE  H2      58 LYS  HA     3.30  1.00E+00 #STRONG
#168 RADE  H2      58 LYS  QB     5.80  1.00E+00 #SD 
 168 RADE  H2      58 LYS  QG     5.80  1.00E+00 #SD 
#168 RADE  H2      58 LYS  QD     5.80  1.00E+00 #weaker than QE 
#168 RADE  H2      58 LYS  QE     5.80  1.00E+00 
 168 RADE  H8      58 LYS  QE     5.80  1.00E+00 #v. weak

 168 RADE  H2      63 ARG  QB     3.50  1.00E+00
 168 RADE  H2      63 ARG  QG     3.50  1.00E+00
 168 RADE  H2      63 ARG  QD     5.80  1.00E+00

#URA 169  

#RCYT 170  

#RGUA 196
#196 RGUA  H1'     61 ARG  QD     5.80  1.00E+00

#RADE 197
 197 RADE  H1'     55 HIS  HE1    5.00  1.00E+00
#197 RADE  H1'     52 GLY  QA     5.80  1.00E+00
 197 RADE  H8      55 HIS  HE1    5.00  1.00E+00 #weaker than H1'
#197 RADE  H8      55 HIS  HD2    5.00  1.00E+00 #SD via HE1
 197 RADE  H8      60 CYSZ HA     5.00  1.00E+00

#197 RADE  H8      61 ARG  HA     5.00  1.00E+00 #SD via side chain
 197 RADE  H8      61 ARG  QB     5.80  1.00E+00
 197 RADE  H8      61 ARG  QG     5.80  1.00E+00
 197 RADE  H8      61 ARG  QD     5.80  1.00E+00

#197 RADE  H8      62 LYS  QB     5.80  1.00E+00
#197 RADE  H8      62 LYS  QG     5.80  1.00E+00
#197 RADE  H8      62 LYS  HA     5.80  1.00E+00 #SD via QB

####################################################################
##### End intermolecular interactions
####################################################################


####################################################################
##### Begin linker-2 and SL-B
####################################################################

#---------------Begin C4'-O4'bond for linker-2 and SL-B-------------
### C4' to O4' 
#linker-2
197 RADE C4'    197 RADE O4'    1.46   1.00E+00
198 URA  C4'    198 URA  O4'    1.46   1.00E+00
199 RGUA C4'    199 RGUA O4'    1.46   1.00E+00
200 RADE C4'    200 RADE O4'    1.46   1.00E+00

#SL-B
201 RCYT C4' 201 RCYT O4' 1.46   1.00E+00
202 RCYT C4' 202 RCYT O4' 1.46   1.00E+00
203 RCYT C4' 203 RCYT O4' 1.46   1.00E+00
204 URA  C4' 204 URA  O4' 1.46   1.00E+00
205 RADE C4' 205 RADE O4' 1.46   1.00E+00
206 RGUA C4' 206 RGUA O4' 1.46   1.00E+00 
207 URA  C4' 207 URA  O4' 1.46   1.00E+00
208 RADE C4' 208 RADE O4' 1.46   1.00E+00
209 RGUA C4'    209 RGUA O4' 1.46   1.00E+00
210 RADE C4' 210 RADE O4' 1.46   1.00E+00
211 RGUA C4' 211 RGUA O4'  1.46   1.00E+00
212 RGUA C4' 212 RGUA O4'  1.46   1.00E+00
213 RGUA C4' 213 RGUA O4'  1.46   1.00E+00

### C5' to O4'
#linker-2
197 RADE C5'    197 RADE O4'    2.42   1.00E+00
198 URA  C5'    198 URA  O4'    2.42   1.00E+00
199 RGUA C5'    199 RGUA O4'    2.42   1.00E+00
200 RADE C5'    200 RADE O4'    2.42   1.00E+00

#SL-B
201 RCYT C5' 201 RCYT O4' 2.42   1.00E+00
202 RCYT C5' 202 RCYT O4' 2.42   1.00E+00
203 RCYT C5' 203 RCYT O4' 2.42   1.00E+00
204 URA  C5' 204 URA  O4' 2.42   1.00E+00
205 RADE C5' 205 RADE O4' 2.42   1.00E+00
206 RGUA C5' 206 RGUA O4' 2.42   1.00E+00  
207 URA  C5' 207 URA  O4' 2.42   1.00E+00
208 RADE C5' 208 RADE O4' 2.42   1.00E+00
209 RGUA C5'    209 RGUA O4' 2.42   1.00E+00
210 RADE C5' 210 RADE O4' 2.42   1.00E+00
211 RGUA C5' 211 RGUA O4'  2.42   1.00E+00
212 RGUA C5' 212 RGUA O4'    2.42   1.00E+00
213 RGUA C5' 213 RGUA O4'  2.42   1.00E+00

### C5'to C3' 
#linker-2
197 RADE C5'    197 RADE C3'    2.58   1.00E+00
198 URA  C5'    198 URA  C3'    2.58   1.00E+00
199 RGUA C5'    199 RGUA C3'    2.58   1.00E+00
200 RADE C5'    200 RADE C3'    2.58   1.00E+00

#SL-B
201 RCYT C5'    201 RCYT C3'    2.58   1.00E+00
202 RCYT C5'    202 RCYT C3'    2.58   1.00E+00
203 RCYT C5'    203 RCYT C3'    2.58   1.00E+00
204 URA  C5'    204 URA  C3'    2.58   1.00E+00
205 RADE C5'    205 RADE C3'    2.58   1.00E+00
206 RGUA C5'    206 RGUA C3'    2.58   1.00E+00
207 URA  C5'    207 URA  C3'    2.58   1.00E+00
208 RADE C5'    208 RADE C3'    2.58   1.00E+00
209 RGUA C5'    209 RGUA C3'    2.58   1.00E+00
210 RADE C5'    210 RADE C3'    2.58   1.00E+00
211 RGUA C5'    211 RGUA C3'    2.58   1.00E+00
212 RGUA C5'    212 RGUA C3'    2.58   1.00E+00
213 RGUA C5'    213 RGUA C3'    2.58   1.00E+00
#---------------END C4'-O4'bond for SL-B----------------------------

#---------------Begin H-bonds for SL-B------------------------------
#C201-G213
 201 RCYT N3   213 RGUA H1      1.89  1.00E+00
 201 RCYT N3   213 RGUA N1      3.00  1.00E+00  
 201 RCYT O2   213 RGUA H21     1.89  1.00E+00
 201 RCYT O2   213 RGUA N2      3.00  1.00E+00
 201 RCYT H41  213 RGUA O6      1.89  1.00E+00
 201 RCYT N4   213 RGUA O6      3.00  1.00E+00

#C202-G212
 202 RCYT N3   212 RGUA H1      1.89  1.00E+00
 202 RCYT N3   212 RGUA N1      3.00  1.00E+00  
 202 RCYT O2   212 RGUA H21     1.80  1.00E+00
 202 RCYT O2   212 RGUA N2      3.00  1.00E+00
 202 RCYT H41  212 RGUA O6      1.89  1.00E+00
 202 RCYT N4   212 RGUA O6      3.00  1.00E+00

#C203-G211
 203 RCYT N3   211 RGUA H1      1.89  1.00E+00
 203 RCYT N3   211 RGUA N1      3.00  1.00E+00  
 203 RCYT O2   211 RGUA H21     1.89  1.00E+00
 203 RCYT O2   211 RGUA N2      3.00  1.00E+00
 203 RCYT H41  211 RGUA O6      1.89  1.00E+00
 203 RCYT N4   211 RGUA O6      3.00  1.00E+00

#U204-A210
 204 URA  H3   210 RADE N1      1.89  1.00E+00
 204 URA  N3   210 RADE N1      3.00  1.00E+00  
 204 URA  O4   210 RADE H61     1.89  1.00E+00
 204 URA  O4   210 RADE N6      3.00  1.00E+00
 
#A205-G209            
 205 RADE N1   209 RGUA H1      1.89  1.00E+00
 205 RADE N1   209 RGUA N1    3.00  1.00E+00 
 205 RADE H61  209 RGUA O6    1.89  1.00E+00 
 205 RADE N6   209 RGUA O6    3.00  1.00E+00 
#-------------------End H-bonds for SL-B----------------------------

#---Begin intraresidue and interresidue NOEs for linker-2 and SL-B--
#linker-2
# RADE 197
 197  RADE  H8          197  RADE  H2'          3.00    1.00E+00 #Reversed
 197  RADE  H8          197  RADE  H3'          4.00    1.00E+00 #Reversed

#U198
 198  URA  H6           198  URA  H2'           3.00    1.00E+00 #Reversed
 198  URA  H6           198  URA  H3'           4.00    1.00E+00 #Reversed

 198  URA  H5           201  RCYT H6            5.00    1.00E+00 #Unusually downfield shifted H5
 198  URA  H5           201  RCYT H5            5.00    1.00E+00
 198  URA  H5           201  RCYT H1'           5.00    1.00E+00 # Medium

 198  URA  H6           200  RADE H2'           3.30    1.00E+00
 198  URA  H5           200  RADE H2'           3.30    1.00E+00
#198  URA  H6           200  RADE H1'           5.00    1.00E+00 #v. wk.; SD via H2'
#198  URA  H5           200  RADE H1'           5.00    1.00E+00 #v. wk.; SD via H2'
 198  URA  H5           200  RADE H2            6.00    1.00E+00 #wk
#198  URA  H6           200  RADE H2            6.00    1.00E+00 #wk

 198  URA  H2'          200  RADE H8            3.30    1.00E+00 #Unusually upfield shifted H2'
 198  URA  H3'          200  RADE H8            5.00    1.00E+00
 198  URA  H2'          200  RADE H2            6.00    1.00E+00
#198  URA  H2'          200  RADE H1'           5.00    1.00E+00 #SD via H2'
#198  URA  H1'          200  RADE H8            5.00    1.00E+00 #SD via H2'
#198  URA  H1'          200  RADE H2            5.00    1.00E+00 #SD via H2'

#G199
 199  RGUA  H8          199  RGUA  H2'          4.00    1.00E+00
 199  RGUA  H8          199  RGUA  H3'          3.00    1.00E+00
 199  RGUA  H3'         199  RGUA  H5"          3.30    1.00E+00
 199  RGUA  H4'         199  RGUA  H5'          2.70    1.00E+00
 199  RGUA  H4'         199  RGUA  H5"          2.70    1.00E+00

 199  RGUA  H3'         200  RADE  H8           3.30    1.00E+00 #unusual
#199  RGUA  H8          200  RADE  H8           5.00    1.00E+00 #SD via H3'

#A200 
 200  RADE  H8          200  RADE  H2'          4.00    1.00E+00
 200  RADE  H8          200  RADE  H3'          3.00    1.00E+00
 200  RADE  H3'         200  RADE  H5"          3.30    1.00E+00
 200  RADE  H4'         200  RADE  H5'          2.70    1.00E+00
 200  RADE  H4'         200  RADE  H5"          2.70    1.00E+00
 200  RADE  H1'         201  RCYT  H1'          3.30    1.00E+00 #unusual
 200  RADE  H2          201  RCYT  H1'          5.00    1.00E+00
 200  RADE  H2          214  RGUA  H1'          5.00    1.00E+00 #LONG RANGE, STRONG

#SL-B
#C201
 201  RCYT  H6   201  RCYT  H2'    4.00   1.00E+00
 201  RCYT  H6   201  RCYT  H3'    3.00   1.00E+00
 
 201  RCYT  H6          202  RCYT  H5           5.00    1.00E+00
 201  RCYT  H2'         202  RCYT  H6           2.70    1.00E+00
 201  RCYT  H3'         202  RCYT  H6           3.30    1.00E+00

#C202
 202  RCYT  H6   202  RCYT  H2'    4.00   1.00E+00
 202  RCYT  H6   202  RCYT  H3'    3.00   1.00E+00
 202  RCYT  H3'         202  RCYT  H5"          3.30    1.00E+00
 202  RCYT  H4'   202  RCYT  H5'    2.70   1.00E+00
 202  RCYT  H4'   202  RCYT  H5"    2.70   1.00E+00
 
 202  RCYT  H6          203  RCYT  H5           5.00    1.00E+00
 202  RCYT  H2'         203  RCYT  H6           2.70    1.00E+00
 202  RCYT  H3'         203  RCYT  H6           3.30    1.00E+00

#C203
 203  RCYT  H6   203  RCYT  H2'    4.00   1.00E+00
 203  RCYT  H6   203  RCYT  H3'    3.00   1.00E+00
 203  RCYT  H3'         203  RCYT  H5"          3.30    1.00E+00
 203  RCYT  H4'   203  RCYT  H5'    2.70   1.00E+00
 203  RCYT  H4'   203  RCYT  H5"    2.70   1.00E+00

 203  RCYT  H6          204  URA  H5            5.00    1.00E+00
 203  RCYT  H2'         204  URA  H6            2.70    1.00E+00
 203  RCYT  H3'         204  URA  H6            3.30    1.00E+00

#U204
 204  URA  H6           204  URA  H2'           4.00    1.00E+00
 204  URA  H6           204  URA  H3'           3.00    1.00E+00
 204  URA  H3'          204  URA  H5"           3.30    1.00E+00
 204  URA  H4'          204  URA  H5'           2.70    1.00E+00
 204  URA  H4'          204  URA  H5"           2.70    1.00E+00

 204  URA   H2'         205  RADE  H8           2.70    1.00E+00   
 204  URA   H3'         205  RADE  H8           3.30    1.00E+00

#A205 
 205  RADE  H8    205  RADE  H2'   4.00   1.00E+00
 205  RADE  H8    205  RADE  H3'    3.00   1.00E+00 
 205  RADE  H3'         205  RADE  H5"          3.30    1.00E+00 
 205  RADE  H4'   205  RADE  H5'    2.70   1.00E+00 
 205  RADE  H4'   205  RADE  H5"    2.70   1.00E+00 
      
 205  RADE  H2    210  RADE  H1'    5.00   1.00E+00  

#G206 
 206  RGUA  H8          206  RGUA  H2'          4.00    1.00E+00
 206  RGUA  H8          206  RGUA  H3'          3.00    1.00E+00
 
#U207
 207  URA  H6           207  URA  H2'           4.00    1.00E+00
 207  URA  H6           207  URA  H3'           3.00    1.00E+00
 207  URA  H3'          207  URA  H5"           3.30    1.00E+00 
 207  URA  H4'          207  URA  H5'           2.70    1.00E+00
 207  URA  H4'          207  URA  H5"           2.70    1.00E+00

 207  URA  H3'          208  RADE  H8           5.00    1.00E+00 
 207  URA  H5'          208  RADE  H8           5.00    1.00E+00 
 207  URA  H5"          208  RADE  H8           5.00    1.00E+00 

#A208 
 208  RADE  H8    208  RADE  H2'   4.00   1.00E+00
 208  RADE  H8    208  RADE  H3'    3.00   1.00E+00 
 208  RADE  H3'         208  RADE  H5"          3.30    1.00E+00
 208  RADE  H4'   208  RADE  H5'    2.70   1.00E+00
 208  RADE  H4'   208  RADE  H5"    2.70   1.00E+00

 208  RADE  H3'     209  RGUA  H8  4.00 1.00E+00 
 
#G209
 209  RGUA  H8          209  RGUA  H2'          4.00    1.00E+00
 209  RGUA  H8          209  RGUA  H3'          3.00    1.00E+00
 209  RGUA  H3'         209  RGUA  H5"          3.30    1.00E+00
 209  RGUA  H4'         209  RGUA  H5'          2.70    1.00E+00
 209  RGUA  H4'         209  RGUA  H5"          2.70    1.00E+00

 209  RGUA  H2'         210  RADE  H8           2.70    1.00E+00
 209  RGUA  H3'         210  RADE  H8           3.30    1.00E+00

#A210 
 210  RADE  H8    210  RADE  H2'   4.00   1.00E+00
 210  RADE  H8    210  RADE  H3'    3.00   1.00E+00 
 210  RADE  H3'         210  RADE  H5"          3.30    1.00E+00
 210  RADE  H4'   210  RADE  H5'    2.70   1.00E+00
 210  RADE  H4'   210  RADE  H5"    2.70   1.00E+00
 
 210  RADE  H2'         211  RGUA  H8           2.70    1.00E+00
 210  RADE  H3'         211  RGUA  H8           3.30    1.00E+00
 210  RADE  H2    211  RGUA  H1'    5.00   1.00E+00
 210  RADE  H2    205  RADE  H1'    5.00   1.00E+00 

#G211
 211  RGUA  H8          211  RGUA  H2'          4.00    1.00E+00
 211  RGUA  H8          211  RGUA  H3'          3.00    1.00E+00
 211  RGUA  H3'         211  RGUA  H5"          3.30    1.00E+00
 211  RGUA  H4'         211  RGUA  H5'          2.70    1.00E+00
 211  RGUA  H4'         211  RGUA  H5"          2.70    1.00E+00

 211  RGUA  H2'         212  RGUA  H8           2.70    1.00E+00
 211  RGUA  H3'         212  RGUA  H8           3.30    1.00E+00
 
#G212
 212  RGUA  H8          212  RGUA  H2'          4.00    1.00E+00
 212  RGUA  H8          212  RGUA  H3'          3.00    1.00E+00
 212  RGUA  H3'         212  RGUA  H5"          3.30    1.00E+00
 212  RGUA  H4'         212  RGUA  H5'          2.70    1.00E+00
 212  RGUA  H4'         212  RGUA  H5"          2.70    1.00E+00

 212  RGUA  H2'         213  RGUA  H8           2.70    1.00E+00
 212  RGUA  H3'         213  RGUA  H8           3.30    1.00E+00 
 
#G213
 213  RGUA  H8          213  RGUA  H2'          4.00    1.00E+00
 213  RGUA  H8          213  RGUA  H3'          3.00    1.00E+00
 213  RGUA  H3'         213  RGUA  H5"          3.30    1.00E+00
 213  RGUA  H4'         213  RGUA  H5'          2.70    1.00E+00
 213  RGUA  H4'         213  RGUA  H5"          2.70    1.00E+00

 213  RGUA  H2'         214  RGUA  H8           3.30    1.00E+00
#----End intraresidue and interresidue NOEs for linker-2 and SL-B--

###################################################################
#### End linker-2 and SL-B
###################################################################


###################################################################
#### Begin SL-C and linker-3
###################################################################


#---------------Begin C4'-O4' bond for SL-C------------------------
# C4'-O4' bond is not in the DYANA residue library -this is a cov. bond
#SL-C
214 RGUA C4' 214 RGUA O4'  1.46   1.00E+00
215 RGUA C4' 215 RGUA O4'  1.46   1.00E+00
216 RCYT C4' 216 RCYT O4' 1.46   1.00E+00
217 URA  C4' 217 URA  O4' 1.46   1.00E+00
218 RGUA C4' 218 RGUA O4' 1.46   1.00E+00
219 RCYT C4' 219 RCYT O4' 1.46   1.00E+00
220 RGUA C4' 220 RGUA O4'  1.46   1.00E+00
221 RGUA C4' 221 RGUA O4'  1.46   1.00E+00
222 RCYT C4' 222 RCYT O4' 1.46   1.00E+00
223 URA  C4' 223 URA  O4' 1.46   1.00E+00
#linker-3
224 URA  C4' 224 URA  O4' 1.46   1.00E+00
225 RADE C4' 225 RADE O4' 1.46   1.00E+00
226 RGUA C4' 226 RGUA O4'  1.46   1.00E+00

### C5' to O4'
#SL-C
214 RGUA C5' 214 RGUA O4'  2.42   1.00E+00
215 RGUA C5' 215 RGUA O4'  2.42   1.00E+00
216 RCYT C5' 216 RCYT O4' 2.42   1.00E+00
217 URA  C5' 217 URA  O4' 2.42   1.00E+00
218 RGUA C5' 218 RGUA O4' 2.42   1.00E+00
219 RCYT C5' 219 RCYT O4' 2.42   1.00E+00
220 RGUA C5' 220 RGUA O4'  2.42   1.00E+00
221 RGUA C5' 221 RGUA O4'  2.42   1.00E+00
222 RCYT C5' 222 RCYT O4' 2.42   1.00E+00
223 URA  C5' 223 URA  O4' 2.42   1.00E+00
#linker-3
224 URA  C5' 224 URA  O4' 2.42   1.00E+00
225 RADE C5' 225 RADE O4' 2.42   1.00E+00
226 RGUA C5' 226 RGUA O4'  2.42   1.00E+00

### C5' to C3'
#SL-C
214 RGUA C5'    214 RGUA C3'    2.58   1.00E+00
215 RGUA C5'    215 RGUA C3'    2.58   1.00E+00
216 RCYT C5'    216 RCYT C3'    2.58   1.00E+00
217 URA  C5'    217 URA  C3'    2.58   1.00E+00
218 RGUA C5'    218 RGUA C3'    2.58   1.00E+00
219 RCYT C5'    219 RCYT C3'    2.58   1.00E+00
220 RGUA C5'    220 RGUA C3'    2.58   1.00E+00
221 RGUA C5'    221 RGUA C3'    2.58   1.00E+00
222 RCYT C5'    222 RCYT C3'    2.58   1.00E+00
223 URA  C5'    223 URA  C3'    2.58   1.00E+00
#linker-3
224 URA  C5'    224 URA  C3'    2.58   1.00E+00
225 RADE C5'    225 RADE C3'    2.58   1.00E+00
226 RGUA C5'    226 RGUA C3'    2.58   1.00E+00
#---------------End C4'-O4' bond for SL-C and linker-3--------------

#-------------Begin H-bonds for SL-C--------------------------------
#G214-U223
 214 RGUA O6   223 URA H3       1.89  1.00E+00 
 214 RGUA O6   223 URA N3       3.00  1.00E+00 
 214 RGUA H1   223 URA O2       1.89  1.00E+00 
 214 RGUA N1   223 URA O2       3.00  1.00E+00 

#G215-C222
 215 RGUA H1   222 RCYT N3      1.89  1.00E+00
 215 RGUA N1   222 RCYT N3      3.00  1.00E+00
 215 RGUA H21  222 RCYT O2      1.89  1.00E+00
 215 RGUA N2   222 RCYT O2      3.00  1.00E+00
 215 RGUA O6   222 RCYT H41     1.89  1.00E+00
 215 RGUA O6   222 RCYT N4      3.00  1.00E+00

#C216-G221
 216 RCYT N3   221 RGUA H1      1.89  1.00E+00
 216 RCYT N3   221 RGUA N1      3.00  1.00E+00
 216 RCYT O2   221 RGUA H21     1.89  1.00E+00
 216 RCYT O2   221 RGUA N2      3.00  1.00E+00
 216 RCYT H41  221 RGUA O6      1.89  1.00E+00
 216 RCYT N4   221 RGUA O6      3.00  1.00E+00

#U217-G220                                       #Reverse G*U Wobble
 
 217 URA  O2   220 RGUA H1      1.89 1.00E+00
 217 URA  O2   220 RGUA N1      3.00 1.00E+00
 217 URA  O2   220 RGUA H21 1.89 1.00E+00
 217 URA  O2   220 RGUA N2 3.00 1.00E+00

 217 URA  HO2' 220 RGUA O6 1.89 1.00E+00 #Ribose H-bond
 217 URA  O2'  220 RGUA O6 3.00 1.00E+00

# Other H-bonds
 219 RCYT H42  218 RGUA OP2 1.89 1.00E+00
 219 RCYT N4   218 RGUA OP2 3.00 1.00E+00

### Potential Bend H-bonds
 224 URA O2    215 RGUA H22     1.89    1.00E+00
 224 URA O2    215 RGUA N2      3.00    1.00E+00
#--------------End H-bonds for SL-C------------------------------------

#------Begin intraresidue and interresidue NOEs for SL-C and linker-3--
 #G214
 214  RGUA  H8          214  RGUA  H2'          4.00    1.00E+00
 214  RGUA  H8          214  RGUA  H3'          3.00    1.00E+00
 214  RGUA  H3'         214  RGUA  H5"          3.30    1.00E+00
 214  RGUA  H4'         214  RGUA  H5'          2.70    1.00E+00
 214  RGUA  H4'         214  RGUA  H5"          2.70    1.00E+00

 214  RGUA  H2'         215  RGUA  H8           2.70    1.00E+00
 214  RGUA  H3'         215  RGUA  H8           3.30    1.00E+00 

#G215
 215  RGUA  H8          215  RGUA  H2'          4.00    1.00E+00
 215  RGUA  H8          215  RGUA  H3'          3.00    1.00E+00
 215  RGUA  H3'         215  RGUA  H5"          3.30    1.00E+00
 215  RGUA  H4'         215  RGUA  H5'          2.70    1.00E+00
 215  RGUA  H4'         215  RGUA  H5"          2.70    1.00E+00

 215  RGUA  H8          216  RCYT  H5           5.00    1.00E+00
 215  RGUA  H2'         216  RCYT  H6           2.70    1.00E+00
 215  RGUA  H3'         216  RCYT  H6           3.30    1.00E+00 
    
#C216
 216  RCYT  H6   216  RCYT  H2'    4.00   1.00E+00
 216  RCYT  H6   216  RCYT  H3'    3.00   1.00E+00
 216  RCYT  H3'         216  RCYT  H5"          3.30    1.00E+00
 216  RCYT  H4'   216  RCYT  H5'    2.70   1.00E+00
 216  RCYT  H4'   216  RCYT  H5"    2.70   1.00E+00

 216  RCYT  H2'         217  URA   H6           2.70    1.00E+00
 216  RCYT  H3'         217  URA   H6           3.30    1.00E+00
 216  RCYT  H6          217  URA   H5           5.00    1.00E+00

 216  RCYT  H1'         225  RADE  H2           5.00    1.00E+00

#-----------------------Begin SL-C UGCG tetraloop------------------
#U217
#{NOTE: U217 H2' exhibits upfield shift @ 4.005 ppm}
 217  URA  H6           217  URA  H2'           4.00    1.00E+00
 217  URA  H6           217  URA  H3'           3.00    1.00E+00
 217  URA  H3'          217  URA  H5"           3.30    1.00E+00
 217  URA  H4'          217  URA  H5'           2.70    1.00E+00
 217  URA  H4'          217  URA  H5"           2.70    1.00E+00

 217  URA  H2'          219  RCYT H5            2.70    1.00E+00
 217  URA  H3'          219  RCYT H5            3.30    1.00E+00

#G218
 218  RGUA  H8          218  RGUA  H2'          4.00    1.00E+00 
 218  RGUA  H8          218  RGUA  H3'          3.00    1.00E+00 

 218  RGUA  H2'         219  RCYT  H5           5.00    1.00E+00
 218  RGUA  H2'         219  RCYT  H6           5.00    1.00E+00
 218  RGUA  H3'         219  RCYT  H5           3.30    1.00E+00 #stronger than H2'
 218  RGUA  H3'         219  RCYT  H6           2.70    1.00E+00 #stronger than H2'
 218  RGUA  H5"         219  RCYT  H5           3.30    1.00E+00
 
#C219
 219  RCYT  H6   219  RCYT  H2'    4.00   1.00E+00
 219  RCYT  H6   219  RCYT  H3'    5.00   1.00E+00 #Ribose pucker

 219  RCYT  H4'   220  RGUA  H1'    5.00   1.00E+00
#219  RCYT  H4'   220  RGUA  H8    5.00   1.00E+00 #SD via H1'
 
#G220 
#This residue is in the SYN conformation, H3' exhibits large downfield shift @5,761 ppm 
 220  RGUA  H8          220  RGUA  H1'          2.70    1.00E+00   ##VERY INTENSE
 
 220  RGUA  H2'         221  RGUA  H8           5.00    1.00E+00  
 220  RGUA  H3'         221  RGUA  H8           5.00    1.00E+00  
 220  RGUA  H2'         221  RGUA  H4'          3.30    1.00E+00
 220  RGUA  H2'         221  RGUA  H5'          3.30    1.00E+00
#-----------------------End SL-C UGCG tetraloop--------------------

#G221
 221  RGUA  H8          221  RGUA  H2'          4.00    1.00E+00
 221  RGUA  H8          221  RGUA  H3'          3.00    1.00E+00
 221  RGUA  H3'         221  RGUA  H5"          3.30    1.00E+00
 221  RGUA  H4'         221  RGUA  H5'          2.70    1.00E+00
 221  RGUA  H4'         221  RGUA  H5"          2.70    1.00E+00
 
 221  RGUA  H8          222  RCYT  H5           5.00    1.00E+00
 221  RGUA  H2'         222  RCYT  H6           2.70    1.00E+00 
 221  RGUA  H3'         222  RCYT  H6           3.30    1.00E+00  

#C222
 222  RCYT  H6   222  RCYT  H2'    4.00   1.00E+00
 222  RCYT  H6   222  RCYT  H3'    3.00   1.00E+00
 222  RCYT  H3'         222  RCYT  H5"          3.30    1.00E+00
 222  RCYT  H4'   222  RCYT  H5'    2.70   1.00E+00
 222  RCYT  H4'   222  RCYT  H5"    2.70   1.00E+00

 222  RCYT  H2'         223  URA   H6           2.70    1.00E+00
 222  RCYT  H3'         223  URA   H6           3.30    1.00E+00
 
#U223
 223  URA  H6           223  URA  H2'           4.00    1.00E+00
 223  URA  H6           223  URA  H3'           3.00    1.00E+00
 223  URA  H3'          223  URA  H5"           3.30    1.00E+00
 223  URA  H4'          223  URA  H5'           2.70    1.00E+00
 223  URA  H4'          223  URA  H5"           2.70    1.00E+00
 
 223  URA  H1'          224  URA  H5            5.00    1.00E+00  #Kink
 223  URA  H1'          224  URA  H6            5.00    1.00E+00  #Kink

#linker-3
 #U224
 224  URA  H6           224  URA  H2'           4.00    1.00E+00
 224  URA  H6           224  URA  H3'           3.00    1.00E+00
 224  URA  H3'          224  URA  H5"           3.30    1.00E+00
 224  URA  H4'          224  URA  H5'           2.70    1.00E+00
 224  URA  H4'          224  URA  H5"           2.70    1.00E+00

 224  URA  H2'          225  RADE  H8           3.30    1.00E+00
 224  URA  H3'          225  RADE  H8           3.30    1.00E+00
 224  URA  H6           225  RADE  H8           5.00    1.00E+00

#A225
 225  RADE  H8          225  RADE  H2'          4.00    1.00E+00
 225  RADE  H8          225  RADE  H3'          3.00    1.00E+00
 225  RADE  H3'         225  RADE  H5"          3.30    1.00E+00
 225  RADE  H4'         225  RADE  H5'          2.70    1.00E+00
 225  RADE  H4'         225  RADE  H5"          2.70    1.00E+00
 
 225  RADE  H2          226  RGUA  H1'          5.00    1.00E+00 #weaker than usual
 225  RADE  H2'         226  RGUA  H8           3.30    1.00E+00 
 225  RADE  H3'         226  RGUA  H8           3.30    1.00E+00
 225  RADE  H8          226  RGUA  H8           5.00    1.00E+00

 225  RADE  H2          216  RCYT  H1'          5.00    1.00E+00 # Long range

#G226
 226  RGUA  H8          226  RGUA  H2'          4.00    1.00E+00
 226  RGUA  H8          226  RGUA  H3'          3.00    1.00E+00
 221  RGUA  H3'         221  RGUA  H5"          3.30    1.00E+00
 221  RGUA  H4'         221  RGUA  H5'          2.70    1.00E+00
 221  RGUA  H4'         221  RGUA  H5"          2.70    1.00E+00

# G226-H8 OVERLAPS with G227-H8.  It is therefore impossible to
# distinguish intermolecular from intramolecular NOEs.
#----End intraresidue and interresidue NOEs for SL-C and linker-3---

####################################################################
#### End SL-C and linker-3
####################################################################


####################################################################
##### Begin intermolecular interactions
####################################################################

#-------------------------------------------------------------------
# Intermolecular Hydrogen Bonds (H-bonds)
#-------------------------------------------------------------------
## GUA 218
 218 RGUA O6    22 TYR  H        2.00  1.00E+00
 218 RGUA O6    22 TYR  N        3.00  1.00E+00
 218 RGUA O6    31 GLN  H        2.00  1.00E+00
 218 RGUA O6    31 GLN  N        3.00  1.00E+00

 218 RGUA H1    20 LEU  O        2.00  1.00E+00
 218 RGUA N1    20 LEU  O        3.00  1.00E+00
 218 RGUA H21   20 LEU  O        2.00  1.00E+00
 218 RGUA N2    20 LEU  O        3.00  1.00E+00

#-------------------------------------------------------------------
# Potential Salt Bridges
#-------------------------------------------------------------------
 61  ARG  NE     197 RADE  P      4.00  1.00E+00

##------------------------------------------------------------------
##  Intermolecular NOEs
##------------------------------------------------------------------
#RCTY 216
 216 RCYT H1'     32 ALA  QB      5.50  1.00E+00
 216 RCYT H2'     32 ALA  QB      5.50  1.00E+00 #similar intensity to H1', but broader

# URA 217
 217 URA  H1'     32 ALA  QB      5.50  1.00E+00

# RGUA 218
 218 RGUA H8      22 TYR  HD2     5.0   1.00E+00
 218 RGUA H8      22 TYR  HE2     5.0   1.00E+00
 218 RGUA H1'     22 TYR  HE2     5.0   1.00E+00

 218 RGUA H8      30 TYR  HD2     5.0   1.00E+00
 218 RGUA H8      30 TYR  HE2     5.0   1.00E+00
 218 RGUA H1'     30 TYR  HE2     5.0   1.00E+00

#RGUA 220

 220 RGUA H8      30 TYR  QE      7.30  1.00E+00
 220 RGUA H8      16 ARG  HA      3.30  1.00E+00 #stronter than 35TRY QE,22HA
 220 RGUA H8      16 ARG  QB      5.80  1.00E+00 
 220 RGUA H8      17 ALA  QB      5.50  1.00E+00

#RADE 225
 225 RADE H2      32 ALA  QB      5.50  1.00E+00

#RGUA 226
 226 RGUA H1'     33 GLN  HA      5.00  1.00E+00
 226 RGUA H1'     33 GLN  QG      5.80  1.00E+00
  
####################################################################
#### End intermolecular interactions
####################################################################



********************************************************************
CYANA LOWER LIMIT RESTRAINT FILE
********************************************************************

####################################################################
#### Begin NC N-termial zinc knuckle restraints
####################################################################

#-------------------------------------------------------------------
#          ZN Ligands
#-------------------------------------------------------------------
 34 CYSZ ZN     21 CYS- CB      3.10  10.00E+00
 34 CYSZ ZN     24 CYS- CB      3.10  10.00E+00
 34 CYSZ ZN     34 CYSZ CB      3.10  10.00E+00
 34 CYSZ ZN     21 CYS- SG      2.25  10.00E+00
 34 CYSZ ZN     24 CYS- SG      2.25  10.00E+00
 34 CYSZ ZN     34 CYSZ SG      2.25  10.00E+00 
 34 CYSZ ZN     29 HIS  NE2     1.90  10.00E+00
 34 CYSZ ZN     29 HIS  ND1     4.13  5.00E+00 
 34 CYSZ ZN     29 HIS  CG      4.13  5.00E+00 
 
#------------------------------------------------------------------- 
#                       ZN Geometry
#-------------------------------------------------------------------
 34 CYSZ SG     21 CYS- SG      3.70  10.00E+00
 34 CYSZ SG     24 CYS- SG      3.70  10.00E+00
 21 CYS- SG     24 CYS- SG      3.70  10.00E+00

 34 CYSZ SG     29 HIS  NE2     3.50  10.00E+00
 21 CYS- SG     29 HIS  NE2     3.50  10.00E+00
 24 CYS- SG     29 HIS  NE2     3.50  10.00E+00

#-------------------------------------------------------------------
#   Hydrogen Bonds
#-------------------------------------------------------------------

 20 LEU  N      17 ALA  O       2.70  1.00E+00
 20 LEU  H      17 ALA  O       1.80  1.00E+00
 28 GLY  N      19 GLY  O       2.70  1.00E+00
 28 GLY  H      19 GLY  O       1.80  1.00E+00

 21 CYS- N      26 SER  O       2.70  1.00E+00
 21 CYS- H      26 SER  O       1.80  1.00E+00
 23 THR  H      21 CYS- SG      2.25  1.00E+00
 23 THR  N      21 CYS- SG      3.25  1.00E+00
 26 SER  H      24 CYS- SG      2.25  1.00E+00
 26 SER  N      24 CYS- SG      3.25  1.00E+00
 24 CYS- H      21 CYS- SG      2.25  1.00E+00
 24 CYS- N      21 CYS- SG      3.25  1.00E+00
 33 GLN  N      30 TYR  O       2.70  1.00E+00
 33 GLN  H      30 TYR  O       1.80  1.00E+00
 34 CYSZ N      31 GLN  O       2.70  1.00E+00
 34 CYSZ H      31 GLN  O       1.80  1.00E+00
 36 LYS  H      34 CYSZ SG      2.25  1.00E+00
 36 LYS  N      34 CYSZ SG      3.25  1.00E+00
 37 LYS  H      34 CYSZ O       1.80  1.00E+00
 37 LYS  N      34 CYSZ O       2.70  1.00E+00

####################################################################
#### End NC N-termial zinc knuckle restraints
####################################################################

####################################################################
#### Begin NC C-termial zinc knuckle restraints
####################################################################

#-------------------------------------------------------------------
#          ZN Ligands
#-------------------------------------------------------------------
 60 CYSZ ZN     47 CYS- CB      3.10  10.00E+00
 60 CYSZ ZN     50 CYS- CB      3.10  10.00E+00
 60 CYSZ ZN     60 CYSZ CB      3.10  10.00E+00
 60 CYSZ ZN     47 CYS- SG      2.25  10.00E+00
 60 CYSZ ZN     50 CYS- SG      2.25  10.00E+00
 60 CYSZ ZN     60 CYSZ SG      2.25  10.00E+00 
 60 CYSZ ZN     55 HIS  NE2     1.90  10.00E+00
 60 CYSZ ZN     55 HIS  ND1     4.13  5.00E+00 
 60 CYSZ ZN     55 HIS  CG      4.13  5.00E+00 
 
#------------------------------------------------------------------- 
#                       ZN Geometry
#-------------------------------------------------------------------
 60 CYSZ SG     47 CYS- SG      3.70  10.00E+00
 60 CYSZ SG     50 CYS- SG      3.70  10.00E+00
 47 CYS- SG     50 CYS- SG      3.70  10.00E+00

 60 CYSZ SG     55 HIS  NE2     3.50  10.00E+00
 47 CYS- SG     55 HIS  NE2     3.50  10.00E+00
 50 CYS- SG     55 HIS  NE2     3.50  10.00E+00
#------------------------------------------------------------------
#   Hydrogen Bonds
#------------------------------------------------------------------

 54 GLY  N      45 GLU  O       2.70  1.00E+00
 54 GLY  H      45 GLU  O       1.80  1.00E+00

 47 CYS- N      52 GLY  O       2.70  1.00E+00
 47 CYS- H      52 GLY  O       1.80  1.00E+00
 49 LEU  H      47 CYS- SG      2.25  1.00E+00
 49 LEU  N      47 CYS- SG      3.25  1.00E+00
 52 GLY  H      50 CYS- SG      2.25  1.00E+00
 52 GLY  N      50 CYS- SG      3.25  1.00E+00
 50 CYS- H      47 CYS- SG      2.25  1.00E+00
 50 CYS- N      47 CYS- SG      3.25  1.00E+00
 59 GLN  N      56 ASN  O       2.70  1.00E+00
 59 GLN  H      56 ASN  O       1.80  1.00E+00
 60 CYSZ N      57 ALA  O       2.70  1.00E+00
 60 CYSZ H      57 ALA  O       1.80  1.00E+00
 62 LYS  H      60 CYSZ SG      2.25  1.00E+00
 62 LYS  N      60 CYSZ SG      3.25  1.00E+00
 63 ARG  H      60 CYSZ O       1.80  1.00E+00
 63 ARG  N      60 CYSZ O       2.70  1.00E+00
 64 ASP  H      61 ARG  O       1.80  1.00E+00
 64 ASP  N      61 ARG  O       2.70  1.00E+00
 65 GLY  H      61 ARG  O       1.80  1.00E+00
 65 GLY  N      61 ARG  O       2.70  1.00E+00

####################################################################
##### END NC C-termial zinc knuckle restraints
####################################################################


####################################################################
#### Begin o3 
####################################################################

#----------------------Begin C4'-O4' bond for O3--------------------
### C4' to O4'
160 RCYT C4' 160 RCYT O4' 1.44  10.00E+00
161 URA  C4' 161 URA  O4' 1.44  10.00E+00
162 RGUA C4' 162 RGUA O4' 1.44  10.00E+00
163 RCYT C4' 163 RCYT O4' 1.44  10.00E+00
164 RCYT C4' 164 RCYT O4' 1.44  10.00E+00
165 RCYT C4' 165 RCYT O4' 1.44  10.00E+00
166 URA  C4' 166 URA  O4' 1.44  10.00E+00
167 RCYT C4' 167 RCYT O4' 1.44  10.00E+00
227 RGUA C4' 227 RGUA O4' 1.44  10.00E+00
228 RADE C4' 228 RADE O4' 1.44  10.00E+00
229 RGUA C4'    229 RGUA O4' 1.44  10.00E+00
230 RGUA C4' 230 RGUA O4' 1.44  10.00E+00
231 RGUA C4'    231 RGUA O4' 1.44  10.00E+00
232 RCYT C4' 232 RCYT O4' 1.44  10.00E+00
233 RADE C4' 233 RADE O4' 1.44  10.00E+00 
234 RGUA C4' 234 RGUA O4'  1.44  10.00E+00

### C5' to O4'
160 RCYT C5' 160 RCYT O4' 2.32  10.00E+00
161 URA  C5' 161 URA  O4' 2.32  10.00E+00
162 RGUA C5' 162 RGUA O4' 2.32  10.00E+00
163 RCYT C5' 163 RCYT O4' 2.32  10.00E+00
164 RCYT C5' 164 RCYT O4' 2.32  10.00E+00
165 RCYT C5' 165 RCYT O4' 2.32  10.00E+00
166 URA  C5' 166 URA  O4' 2.32  10.00E+00
167 RCYT C5' 167 RCYT O4' 2.32  10.00E+00
227 RGUA C5' 227 RGUA O4' 2.32  10.00E+00
228 RADE C5' 228 RADE O4' 2.32  10.00E+00
229 RGUA C5'    229 RGUA O4' 2.32  10.00E+00
230 RGUA C5' 230 RGUA O4' 2.32  10.00E+00
231 RGUA C5'    231 RGUA O4' 2.32  10.00E+00
232 RCYT C5' 232 RCYT O4' 2.32  10.00E+00
233 RADE C5' 233 RADE O4' 2.32  10.00E+00 
234 RGUA C5' 234 RGUA O4'  2.32  10.00E+00

### C5' to C3'
160 RCYT C5'    160 RCYT C3'    2.48  10.00E+00
161 URA  C5'    161 URA  C3'    2.48  10.00E+00
162 RGUA C5'    162 RGUA C3'    2.48  10.00E+00
163 RCYT C5'    163 RCYT C3'    2.48  10.00E+00
164 RCYT C5'    164 RCYT C3'    2.48  10.00E+00
165 RCYT C5'    165 RCYT C3'    2.48  10.00E+00
166 URA  C5'    166 URA  C3'    2.48  10.00E+00
167 RCYT C5'    167 RCYT C3'    2.48  10.00E+00
227 RGUA C5'    227 RGUA C3'    2.48  10.00E+00
228 RADE C5'    228 RADE C3'    2.48  10.00E+00
229 RGUA C5'    229 RGUA C3'    2.48  10.00E+00
230 RGUA C5'    230 RGUA C3'    2.48  10.00E+00
231 RGUA C5'    231 RGUA C3'    2.48  10.00E+00
232 RCYT C5'    232 RCYT C3'    2.48  10.00E+00
233 RADE C5'    233 RADE C3'    2.48  10.00E+00
234 RGUA C5'    234 RGUA C3'    2.48  10.00E+00
#--------------------End C4'-O4' bond for O3------------------------

#--------------------Begin H-bonds for O3---------------------------
#C160-G234
 160 RCYT N3   234 RGUA H1      1.80  1.00E+00
 160 RCYT N3   234 RGUA N1      2.90  1.00E+00  
 160 RCYT O2   234 RGUA H21     1.80  1.00E+00
 160 RCYT O2   234 RGUA N2      2.90  1.00E+00
 160 RCYT H41  234 RGUA O6      1.80  1.00E+00
 160 RCYT N4   234 RGUA O6      2.90  1.00E+00 

#U161-A233
 161 URA  H3   233 RADE N1      1.80  1.00E+00
 161 URA  N3   233 RADE N1      2.90  1.00E+00  
 161 URA  O4   233 RADE H61     1.80  1.00E+00
 161 URA  O4   233 RADE N6      2.90  1.00E+00

#G162-C232
 162 RGUA H1   232 RCYT N3      1.80  1.00E+00
 162 RGUA N1   232 RCYT N3      2.90  1.00E+00 
 162 RGUA H21  232 RCYT O2      1.80  1.00E+00
 162 RGUA N2   232 RCYT O2      2.90  1.00E+00
 162 RGUA O6   232 RCYT H41     1.80  1.00E+00
 162 RGUA O6   232 RCYT N4      2.90  1.00E+00
 
#C163-G231
 163 RCYT N3   231 RGUA H1      1.80  1.00E+00
 163 RCYT N3   231 RGUA N1      2.90  1.00E+00  
 163 RCYT O2   231 RGUA H21     1.80  1.00E+00
 163 RCYT O2   231 RGUA N2      2.90  1.00E+00
 163 RCYT H41  231 RGUA O6      1.80  1.00E+00
 163 RCYT N4   231 RGUA O6      2.90  1.00E+00

#C164-G230
 164 RCYT N3   230 RGUA H1      1.80  1.00E+00
 164 RCYT N3   230 RGUA N1      2.90  1.00E+00  
 164 RCYT O2   230 RGUA H21     1.80  1.00E+00
 164 RCYT O2   230 RGUA N2      2.90  1.00E+00
 164 RCYT H41  230 RGUA O6      1.80  1.00E+00
 164 RCYT N4   230 RGUA O6      2.90  1.00E+00

#C165-G229
 165 RCYT N3   229 RGUA H1      1.80  1.00E+00
 165 RCYT N3   229 RGUA N1      2.90  1.00E+00  
 165 RCYT O2   229 RGUA H21     1.80  1.00E+00
 165 RCYT O2   229 RGUA N2      2.90  1.00E+00
 165 RCYT H41  229 RGUA O6      1.80  1.00E+00
 165 RCYT N4   229 RGUA O6      2.90  1.00E+00 

#U166-A228
 166 URA  H3   228 RADE N1      1.80  1.00E+00
 166 URA  N3   228 RADE N1      2.90  1.00E+00  
 166 URA  O4   228 RADE H61     1.80  1.00E+00
 166 URA  O4   228 RADE N6      2.90  1.00E+00   

#C167-G227
 167 RCYT N3   227 RGUA H1      1.80  1.00E+00
 167 RCYT N3   227 RGUA N1      2.90  1.00E+00  
 167 RCYT O2   227 RGUA H21     1.80  1.00E+00
 167 RCYT O2   227 RGUA N2      2.90  1.00E+00
 167 RCYT H41  227 RGUA O6      1.80  1.00E+00
 167 RCYT N4   227 RGUA O6      2.90  1.00E+00  
#----------------------End H-bonds for O3----------------------------

#---------- Begin phosphate limit of approach for O3 ----------------  
 160 RCYT  P     227 RGUA   P     11.0   1.00E+00
 160 RCYT  P     228 RADE   P      8.5   1.00E+00
 160 RCYT  P     229 RGUA   P      8.5   1.00E+00
 160 RCYT  P     230 RGUA   P     11.0   1.00E+00

 161 URA   P     227 RGUA  P       8.5   1.00E+00
 161 URA   P     228 RADE  P       8.5   1.00E+00
 161 URA   P     229 RGUA  P      11.0   1.00E+00

 162 RGUA  P     227 RGUA  P       8.5   1.00E+00
 162 RGUA  P     228 RADE  P      11.0   1.00E+00

 163 RCYT  P     227 RGUA  P      11.0   1.00E+00
#---------- End phosphate limit of approach for O3------------------

####################################################################
#### End o3 
####################################################################


####################################################################
#### Begin linker-1 and SL-A
####################################################################

#---------------Begin C4'-O4',C5'-O4' bonds for linker-1 and SL-A---
# C4'-O4' bond is not in the DYANA residue library -this is a cov. bond

#linker-1
168 RADE C4'    168 RADE O4'    1.44  10.00E+00
169 URA  C4'    169 URA  O4'    1.44  10.00E+00
170 RCYT C4'    170 RCYT O4'    1.44  10.00E+00

#sla
171 RCYT C4' 171 RCYT O4' 1.44  10.00E+00
172 RGUA C4' 172 RGUA O4' 1.44  10.00E+00
173 URA  C4' 173 URA  O4' 1.44  10.00E+00
174 RCYT C4' 174 RCYT O4' 1.44  10.00E+00
175 URA  C4' 175 URA  O4' 1.44  10.00E+00
176 RCYT C4' 176 RCYT O4' 1.44  10.00E+00
177 RGUA C4' 177 RGUA O4' 1.44  10.00E+00
178 RCYT C4' 178 RCYT O4' 1.44  10.00E+00
179 URA  C4' 179 URA  O4' 1.44  10.00E+00
180 URA  C4' 180 URA  O4' 1.44  10.00E+00
181 RADE C4' 181 RADE O4' 1.44  10.00E+00
182 URA  C4' 182 URA  O4' 1.44  10.00E+00
183 URA  C4' 183 URA  O4' 1.44  10.00E+00
184 RCYT C4' 184 RCYT O4' 1.44  10.00E+00
185 RGUA C4'    185 RGUA O4' 1.44  10.00E+00
186 RGUA C4' 186 RGUA O4' 1.44  10.00E+00
187 RGUA C4'    187 RGUA O4' 1.44  10.00E+00
188 RGUA C4' 188 RGUA O4' 1.44  10.00E+00
189 RADE C4' 189 RADE O4' 1.44  10.00E+00
190 RGUA C4' 190 RGUA O4' 1.44  10.00E+00
191 RCYT C4' 191 RCYT O4' 1.44  10.00E+00
192 RGUA C4' 192 RGUA O4' 1.44  10.00E+00
193 RGUA C4' 193 RGUA O4' 1.44  10.00E+00
194 RADE C4' 194 RADE O4' 1.44  10.00E+00 
195 RCYT C4' 195 RCYT O4' 1.44  10.00E+00
196 RGUA C4' 196 RGUA O4'  1.44  10.00E+00

### C5' to O4'
#linker-1
168 RADE C5'    168 RADE O4'    2.32  10.00E+00
169 URA  C5'    169 URA  O4'    2.32  10.00E+00
170 RCYT C5'    170 RCYT O4'    2.32  10.00E+00

#sla
171 RCYT C5' 171 RCYT O4' 2.32  10.00E+00
172 RGUA C5' 172 RGUA O4' 2.32  10.00E+00
173 URA  C5' 173 URA  O4' 2.32  10.00E+00
174 RCYT C5' 174 RCYT O4' 2.32  10.00E+00
175 URA  C5' 175 URA  O4' 2.32  10.00E+00
176 RCYT C5' 176 RCYT O4' 2.32  10.00E+00
177 RGUA C5' 177 RGUA O4' 2.32  10.00E+00 
178 RCYT C5' 178 RCYT O4' 2.32  10.00E+00
179 URA  C5' 179 URA  O4' 2.32  10.00E+00
180 URA  C5' 180 URA  O4' 2.32  10.00E+00
181 RADE C5' 181 RADE O4' 2.32  10.00E+00
182 URA  C5' 182 URA  O4' 2.32  10.00E+00
183 URA  C5' 183 URA  O4' 2.32  10.00E+00
184 RCYT C5' 184 RCYT O4' 2.32  10.00E+00
185 RGUA C5'    185 RGUA O4' 2.32  10.00E+00
186 RGUA C5' 186 RGUA O4' 2.32  10.00E+00
187 RGUA C5'    187 RGUA O4' 2.32  10.00E+00
188 RGUA C5' 188 RGUA O4' 2.32  10.00E+00
189 RADE C5' 189 RADE O4' 2.32  10.00E+00
190 RGUA C5' 190 RGUA O4' 2.32  10.00E+00
191 RCYT C5' 191 RCYT O4' 2.32  10.00E+00
192 RGUA C5' 192 RGUA O4' 2.32  10.00E+00
193 RGUA C5' 193 RGUA O4' 2.32  10.00E+00
194 RADE C5' 194 RADE O4' 2.32  10.00E+00 
195 RCYT C5' 195 RCYT O4' 2.32  10.00E+00
196 RGUA C5' 196 RGUA O4'  2.32  10.00E+00

### C5' to C3'
#linker-1
168 RADE C5'    168 RADE C3'    2.48  10.00E+00
169 URA  C5'    169 URA  C3'    2.48  10.00E+00
170 RCYT C5'    170 RCYT C3'    2.48  10.00E+00

#sla
171 RCYT C5'    171 RCYT C3'    2.48  10.00E+00
172 RGUA C5'    172 RGUA C3'    2.48  10.00E+00
173 URA  C5'    173 URA  C3'    2.48  10.00E+00
174 RCYT C5'    174 RCYT C3'    2.48  10.00E+00
175 URA  C5'    175 URA  C3'    2.48  10.00E+00
176 RCYT C5'    176 RCYT C3'    2.48  10.00E+00
177 RGUA C5'    177 RGUA C3'    2.48  10.00E+00
178 RCYT C5'    178 RCYT C3'    2.48  10.00E+00
179 URA  C5'    179 URA  C3'    2.48  10.00E+00
180 URA  C5'    180 URA  C3'    2.48  10.00E+00
181 RADE C5'    181 RADE C3'    2.48  10.00E+00
182 URA  C5'    182 URA  C3'    2.48  10.00E+00
183 URA  C5'    183 URA  C3'    2.48  10.00E+00
184 RCYT C5'    184 RCYT C3'    2.48  10.00E+00
185 RGUA C5'    185 RGUA C3'    2.48  10.00E+00
186 RGUA C5'    186 RGUA C3'    2.48  10.00E+00
187 RGUA C5'    187 RGUA C3'    2.48  10.00E+00
188 RGUA C5'    188 RGUA C3'    2.48  10.00E+00
189 RADE C5'    189 RADE C3'    2.48  10.00E+00
190 RGUA C5'    190 RGUA C3'    2.48  10.00E+00
191 RCYT C5'    191 RCYT C3'    2.48  10.00E+00
192 RGUA C5'    192 RGUA C3'    2.48  10.00E+00
193 RGUA C5'    193 RGUA C3'    2.48  10.00E+00
194 RADE C5'    194 RADE C3'    2.48  10.00E+00
195 RCYT C5'    195 RCYT C3'    2.48  10.00E+00
196 RGUA C5'    196 RGUA C3'    2.48  10.00E+00
#---------------End C4'-O4' bond for linker-1 and SL-A-------------

#----------------------Begin SL-A H-bonds---------------------------
#C171-G196
 171 RCYT N3   196 RGUA H1      1.80  1.00E+00
 171 RCYT N3   196 RGUA N1      2.90  1.00E+00  
 171 RCYT O2   196 RGUA H21     1.80  1.00E+00
 171 RCYT O2   196 RGUA N2      2.90  1.00E+00
 171 RCYT H41  196 RGUA O6      1.80  1.00E+00
 171 RCYT N4   196 RGUA O6      2.90  1.00E+00
  
#G172-C195
 172 RGUA H1   195 RCYT N3      1.80  1.00E+00
 172 RGUA N1   195 RCYT N3      2.90  1.00E+00 
 172 RGUA H21  195 RCYT O2      1.80  1.00E+00
 172 RGUA N2   195 RCYT O2      2.90  1.00E+00
 172 RGUA O6   195 RCYT H41     1.80  1.00E+00
 172 RGUA O6   195 RCYT N4      2.90  1.00E+00

#U173-A194
 173 URA  H3   194 RADE N1      1.80  1.00E+00
 173 URA  N3   194 RADE N1      2.90  1.00E+00  
 173 URA  O4   194 RADE H61     1.80  1.00E+00
 173 URA  O4   194 RADE N6      2.90  1.00E+00 

#C174-G193
 174 RCYT N3   193 RGUA H1      1.80  1.00E+00
 174 RCYT N3   193 RGUA N1      2.90  1.00E+00  
 174 RCYT O2   193 RGUA H21     1.80  1.00E+00
 174 RCYT O2   193 RGUA N2      2.90  1.00E+00
 174 RCYT H41  193 RGUA O6      1.80  1.00E+00
 174 RCYT N4   193 RGUA O6      2.90  1.00E+00

#C176-G192
 176 RCYT N3   192 RGUA H1      1.80  1.00E+00
 176 RCYT N3   192 RGUA N1      2.90  1.00E+00  
 176 RCYT O2   192 RGUA H21     1.80  1.00E+00
 176 RCYT O2   192 RGUA N2      2.90  1.00E+00
 176 RCYT H41  192 RGUA O6      1.80  1.00E+00
 176 RCYT N4   192 RGUA O6      2.90  1.00E+00 

#G177-C191
 177 RGUA H1   191 RCYT N3      1.80  1.00E+00
 177 RGUA N1   191 RCYT N3      2.90  1.00E+00 
 177 RGUA H21  191 RCYT O2      1.80  1.00E+00
 177 RGUA N2   191 RCYT O2      2.90  1.00E+00
 177 RGUA O6   191 RCYT H41     1.80  1.00E+00
 177 RGUA O6   191 RCYT N4      2.90  1.00E+00 

#C178-G190
 178 RCYT N3   190 RGUA H1      1.80  1.00E+00
 178 RCYT N3   190 RGUA N1      2.90  1.00E+00  
 178 RCYT O2   190 RGUA H21     1.80  1.00E+00
 178 RCYT O2   190 RGUA N2      2.90  1.00E+00
 178 RCYT H41  190 RGUA O6      1.80  1.00E+00
 178 RCYT N4   190 RGUA O6      2.90  1.00E+00
 

#U179-A189
 179 URA  H3   189 RADE N1      1.80  1.00E+00
 179 URA  N3   189 RADE N1      2.90  1.00E+00  
 179 URA  O4   189 RADE H61     1.80  1.00E+00
 179 URA  O4   189 RADE N6      2.90  1.00E+00 
 
#U180-G188
 180 URA H3    188 RGUA O6      1.80  1.00E+00 
 180 URA N3    188 RGUA O6    2.90  1.00E+00 
 180 URA O2    188 RGUA H1    1.80  1.00E+00 
 180 URA O2    188 RGUA N1    2.90  1.00E+00               

#A181-G187
 181 RADE N1   187 RGUA H1      1.80  1.00E+00
 181 RADE N1   187 RGUA N1    2.90  1.00E+00 
 181 RADE H61  187 RGUA O6    1.80  1.00E+00 
 181 RADE N6   187 RGUA O6    2.90  1.00E+00            
#---------------End SL-A H-bond restraints--------------------------

#---------------Begin SL-A phosphate limit of approach--------------
 171 RCYT  P   189 RADE  P      11.0   1.00E+00
 171 RCYT  P   190 RGUA  P       8.5   1.00E+00
 171 RCYT  P   191 RCYT  P       8.5   1.00E+00
 171 RCYT  P   192 RGUA  P      11.0   1.00E+00

 172 RGUA  P   188 RGUA  P      11.0   1.00E+00
 172 RGUA  P   189 RADE  P       8.5   1.00E+00
 172 RGUA  P   190 RGUA  P       8.5   1.00E+00
 172 RGUA  P   191 RCYT  P      11.0   1.00E+00

 173 URA   P   187 RGUA  P      11.0   1.00E+00
 173 URA   P   188 RGUA  P       8.5   1.00E+00
 173 URA   P   189 RADE  P       8.5   1.00E+00
 173 URA   P   190 RGUA  P      11.0   1.00E+00

 174 RCYT  P   187 RGUA  P       8.5   1.00E+00
 174 RCYT  P   188 RGUA  P       8.5   1.00E+00
 174 RCYT  P   189 RADE  P      11.0   1.00E+00

 176 RCYT  P   187 RGUA  P       8.5   1.00E+00
 176 RCYT  P   188 RGUA  P      11.0   1.00E+00

 177 RGUA  P   187 RGUA  P      11.0   1.00E+00
#---------------Begin SL-A phosphate limit of approach--------------

####################################################################
##### End linker-1 and SL-A 
####################################################################

####################################################################
#### Intermolecular H-bonds
####################################################################

 168 RADE  H62     59 GLN  O      1.80  1.00E+00
 168 RADE  N6      59 GLN  O      2.70  1.00E+00
 168 RADE  N7      61 ARG  H      1.80  1.00E+00
 168 RADE  N7      61 ARG  N      2.70  1.00E+00

#197 RADE  OP1     61 ARG  NE     2.70  1.00E+00
#196 RGUA  OP2     62 LYS  HZ1    1.80  1.00E+00 #potential

#168 RADE  OP1     58 LYS  HZ1    1.80  1.00E+00
#168 RADE  OP1     58 LYS  NZ     2.70  1.00E+00

#170 RCYT  N3      63 ARG  HH22   1.80  1.00E+00
#170 RCYT  N3      63 ARG  NH2    2.70  1.00E+00
#170 RCYT  O2      63 ARG  HE     1.80  1.00E+00
#170 RCYT  O2      63 ARG  NE     2.70  1.00E+00

####################################################################
#### Begin linker-2 and SL-B
####################################################################

#---------------Begin C4'-O4' bond for linker-2 and SL-B------------
### C4' to O4'
#linker-2
197 RADE C4'    197 RADE O4'    1.44   1.00E+00
198 URA  C4'    198 URA  O4'    1.44   1.00E+00
199 RGUA C4' 199 RGUA O4' 1.44   1.00E+00 
200 RADE C4' 200 RADE O4' 1.44   1.00E+00

#SL-B
201 RCYT C4' 201 RCYT O4' 1.44   1.00E+00
202 RCYT C4' 202 RCYT O4' 1.44   1.00E+00
203 RCYT C4' 203 RCYT O4' 1.44   1.00E+00
204 URA  C4' 204 URA  O4' 1.44   1.00E+00
205 RADE C4' 205 RADE O4' 1.44   1.00E+00
206 RGUA C4' 206 RGUA O4' 1.44   1.00E+00  
207 URA  C4' 207 URA  O4' 1.44   1.00E+00
208 RADE C4' 208 RADE O4' 1.44   1.00E+00
209 RGUA C4'    209 RGUA O4' 1.44   1.00E+00
210 RADE C4' 210 RADE O4' 1.44   1.00E+00
211 RGUA C4' 211 RGUA O4'  1.44   1.00E+00
212 RGUA C4' 212 RGUA O4'  1.44   1.00E+00
213 RGUA C4' 213 RGUA O4'  1.44   1.00E+00

### C5' to O4'
#linker-2
197 RADE C5'    197 RADE O4'    2.32   1.00E+00
198 URA  C5'    198 URA  O4'    2.32   1.00E+00
199 RGUA C5' 199 RGUA O4' 2.32   1.00E+00 
200 RADE C5' 200 RADE O4' 2.32   1.00E+00

#SL-B
201 RCYT C5' 201 RCYT O4' 2.32   1.00E+00
202 RCYT C5' 202 RCYT O4' 2.32   1.00E+00
203 RCYT C5' 203 RCYT O4' 2.32   1.00E+00
204 URA  C5' 204 URA  O4' 2.32   1.00E+00
205 RADE C5' 205 RADE O4' 2.32   1.00E+00
206 RGUA C5' 206 RGUA O4' 2.32   1.00E+00  
207 URA  C5' 207 URA  O4' 2.32   1.00E+00
208 RADE C5' 208 RADE O4' 2.32   1.00E+00
209 RGUA C5'    209 RGUA O4' 2.32   1.00E+00
210 RADE C5' 210 RADE O4' 2.32   1.00E+00
211 RGUA C5' 211 RGUA O4'  2.32   1.00E+00
212 RGUA C5' 212 RGUA O4'    2.32   1.00E+00
213 RGUA C5' 213 RGUA O4'  2.32   1.00E+00

### C5' to C3'
#linker-2
197 RADE C5'    197 RADE C3'    2.48   1.00E+00
198 URA  C5'    198 URA  C3'    2.48   1.00E+00
199 RGUA C5'    199 RGUA C3'    2.48   1.00E+00
200 RADE C5'    200 RADE C3'    2.48   1.00E+00

#SL-B
201 RCYT C5'    201 RCYT C3'    2.48   1.00E+00
202 RCYT C5'    202 RCYT C3'    2.48   1.00E+00
203 RCYT C5'    203 RCYT C3'    2.48   1.00E+00
204 URA  C5'    204 URA  C3'    2.48   1.00E+00
205 RADE C5'    205 RADE C3'    2.48   1.00E+00
206 RGUA C5'    206 RGUA C3'    2.48   1.00E+00
207 URA  C5'    207 URA  C3'    2.48   1.00E+00
208 RADE C5'    208 RADE C3'    2.48   1.00E+00
209 RGUA C5'    209 RGUA C3'    2.48   1.00E+00
210 RADE C5'    210 RADE C3'    2.48   1.00E+00
211 RGUA C5'    211 RGUA C3'    2.48   1.00E+00
212 RGUA C5'    212 RGUA C3'    2.48   1.00E+00
213 RGUA C5'    213 RGUA C3'    2.48   1.00E+00
#---------------End C4'-O4' bond for linker-2 and SL-B-------------

#---------------Begin H-bonds for SL-B-----------------------------
#C201-G213
 201 RCYT N3   213 RGUA H1      1.80  1.00E+00
 201 RCYT N3   213 RGUA N1      2.90  1.00E+00  
 201 RCYT O2   213 RGUA H21     1.80  1.00E+00
 201 RCYT O2   213 RGUA N2      2.90  1.00E+00
 201 RCYT H41  213 RGUA O6      1.80  1.00E+00
 201 RCYT N4   213 RGUA O6      2.90  1.00E+00

#C202-G212
 202 RCYT N3   212 RGUA H1      1.80  1.00E+00
 202 RCYT N3   212 RGUA N1      2.90  1.00E+00  
 202 RCYT O2   212 RGUA H21     1.80  1.00E+00
 202 RCYT O2   212 RGUA N2      2.90  1.00E+00
 202 RCYT H41  212 RGUA O6      1.80  1.00E+00
 202 RCYT N4   212 RGUA O6      2.90  1.00E+00

#C203-G211
 203 RCYT N3   211 RGUA H1      1.80  1.00E+00
 203 RCYT N3   211 RGUA N1      2.90  1.00E+00  
 203 RCYT O2   211 RGUA H21     1.80  1.00E+00
 203 RCYT O2   211 RGUA N2      2.90  1.00E+00
 203 RCYT H41  211 RGUA O6      1.80  1.00E+00
 203 RCYT N4   211 RGUA O6      2.90  1.00E+00

#U204-A210
 204 URA  H3   210 RADE N1      1.80  1.00E+00
 204 URA  N3   210 RADE N1      2.90  1.00E+00  
 204 URA  O4   210 RADE H61     1.80  1.00E+00
 204 URA  O4   210 RADE N6      2.90  1.00E+00
 
#A205-G209                           
 205 RADE N1   209 RGUA H1      1.80  1.00E+00
 205 RADE N1   209 RGUA N1    2.90  1.00E+00 
 205 RADE H61  209 RGUA O6    1.80  1.00E+00 
 205 RADE N6   209 RGUA O6    2.90  1.00E+00 
#----------------------End H-bonds for SL-B-------------------------

####################################################################
#### End linker-2 and SL-B 
####################################################################


####################################################################
#### Begin SL-C and linker-3
####################################################################

#---------------Begin C4'-O4' bond for SL-C and linker-3------------
### C4' to O4' 
#SL-C
214 RGUA C4' 214 RGUA O4'  1.44  10.00E+00
215 RGUA C4' 215 RGUA O4'  1.44  10.00E+00
216 RCYT C4' 216 RCYT O4' 1.44  10.00E+00
217 URA  C4' 217 URA  O4' 1.44  10.00E+00
218 RGUA C4' 218 RGUA O4' 1.44  10.00E+00
219 RCYT C4' 219 RCYT O4' 1.44  10.00E+00
220 RGUA C4' 220 RGUA O4'  1.44  10.00E+00
221 RGUA C4' 221 RGUA O4'  1.44  10.00E+00
222 RCYT C4' 222 RCYT O4' 1.44  10.00E+00
223 URA  C4' 223 URA  O4' 1.44  10.00E+00

#linker-3
224 URA  C4' 224 URA  O4' 1.44  10.00E+00
225 RADE C4' 225 RADE O4' 1.44  10.00E+00
226 RGUA C4' 226 RGUA O4'  1.44  10.00E+00

### C5' to O4'
#SL-C
214 RGUA C5' 214 RGUA O4'  2.32  10.00E+00
215 RGUA C5' 215 RGUA O4'  2.32  10.00E+00
216 RCYT C5' 216 RCYT O4' 2.32  10.00E+00
217 URA  C5' 217 URA  O4' 2.32  10.00E+00
218 RGUA C5' 218 RGUA O4' 2.32  10.00E+00
219 RCYT C5' 219 RCYT O4' 2.32  10.00E+00
220 RGUA C5' 220 RGUA O4'  2.32  10.00E+00
221 RGUA C5' 221 RGUA O4'  2.32  10.00E+00
222 RCYT C5' 222 RCYT O4' 2.32  10.00E+00
223 URA  C5' 223 URA  O4' 2.32  10.00E+00

#linker-3
224 URA  C5' 224 URA  O4' 2.32  10.00E+00
225 RADE C5' 225 RADE O4' 2.32  10.00E+00
226 RGUA C5' 226 RGUA O4'  2.32  10.00E+00

### C5' to C3'
#SL-C
214 RGUA C5'    214 RGUA C3'    2.48  10.00E+00
215 RGUA C5'    215 RGUA C3'    2.48  10.00E+00
216 RCYT C5'    216 RCYT C3'    2.48  10.00E+00
217 URA  C5'    217 URA  C3'    2.48  10.00E+00
218 RGUA C5'    218 RGUA C3'    2.48  10.00E+00
219 RCYT C5'    219 RCYT C3'    2.48  10.00E+00
220 RGUA C5'    220 RGUA C3'    2.48  10.00E+00
221 RGUA C5'    221 RGUA C3'    2.48  10.00E+00
222 RCYT C5'    222 RCYT C3'    2.48  10.00E+00
223 URA  C5'    223 URA  C3'    2.48  10.00E+00

#linker-3
224 URA  C5'    224 URA  C3'    2.48  10.00E+00
225 RADE C5'    225 RADE C3'    2.48  10.00E+00
226 RGUA C5'    226 RGUA C3'    2.48  10.00E+00
#---------------End C4'-O4' bond for SL-C and linker-3---------------

#-------------Begin H-bonds for SL-C---------------------------------
#G214-U223
 214 RGUA O6   223 URA H3       1.80  1.00E+00 
 214 RGUA O6   223 URA N3       2.90  1.00E+00 
 214 RGUA H1   223 URA O2       1.80  1.00E+00 
 214 RGUA N1   223 URA O2       2.90  1.00E+00 

#G215-C222
 215 RGUA H1   222 RCYT N3      1.80  1.00E+00
 215 RGUA N1   222 RCYT N3      2.90  1.00E+00
 215 RGUA H21  222 RCYT O2      1.80  1.00E+00
 215 RGUA N2   222 RCYT O2      2.90  1.00E+00
 215 RGUA O6   222 RCYT H41     1.80  1.00E+00
 215 RGUA O6   222 RCYT N4      2.90  1.00E+00

#C216-G221
 216 RCYT N3   221 RGUA H1      1.80  1.00E+00
 216 RCYT N3   221 RGUA N1      2.90  1.00E+00
 216 RCYT O2   221 RGUA H21     1.80  1.00E+00
 216 RCYT O2   221 RGUA N2      2.90  1.00E+00
 216 RCYT H41  221 RGUA O6      1.80  1.00E+00
 216 RCYT N4   221 RGUA O6      2.90  1.00E+00

#U217-G220                                       #Reverse G*U Wobble

 217 URA  O2   220 RGUA H1      1.80    1.00E+00
 217 URA  O2   220 RGUA N1      2.90    1.00E+00
 217 URA  O2   220 RGUA H21     1.80    1.00E+00
 217 URA  O2   220 RGUA N2      2.90    1.00E+00

 217 URA  HO2' 220 RGUA O6      1.80    1.00E+00 #Ribose H-bond
 217 URA  O2'  220 RGUA O6      2.90    1.00E+00

# Other H-bonds
 219 RCYT H42  218 RGUA OP2     1.80    1.00E+00
 219 RCYT N4   218 RGUA OP2     2.90    1.00E+00

### Potential Bend H-bonds
 224 URA O2    215 RGUA H22     1.80    1.00E+00
 224 URA O2    215 RGUA N2      2.90    1.00E+00
#--------------END H-bonds for SL-C-------------------------------


####################################################################
#### End SL-C and linker-3
####################################################################

##################################################################
#### Begin Intermolecular NC-F1+ RNA H-bond Restraints
##################################################################

# GUA 218
 218 RGUA O6    22 TYR  H        1.80  1.00E+00
 218 RGUA O6    22 TYR  N        2.70  1.00E+00
 218 RGUA O6    31 GLN  H        1.80  1.00E+00
 218 RGUA O6    31 GLN  N        2.70  1.00E+00

 218 RGUA H1    20 LEU  O        1.80  1.00E+00
 218 RGUA N1    20 LEU  O        2.70  1.00E+00
 218 RGUA H21   20 LEU  O        1.80  1.00E+00
 218 RGUA N2    20 LEU  O        2.70  1.00E+00

##################################################################
######  End Intermolecular NC-F1+ RNA H-bond Restraints
##################################################################

##################################################################
### Unusual RNA H-bond
##################################################################

#198 URA   H3     201 RCYT  O2'    1.80  1.00E+00
#198 URA   N3     201 RCYT  O2'    2.70  1.00E+00

#### END ###

##################################################################
#### Phosphate-push
##################################################################

#### Original

  224 URA   P     210 RADE  P     6.0   1.00E+00
  224 URA   P     211 RGUA  P     6.0   1.00E+00

  223 URA   P     209 RGUA  P     6.0   1.00E+00
  223 URA   P     210 RADE  P     6.0   1.00E+00
  223 URA   P     211 RGUA  P     6.0   1.00E+00
  223 URA   P     212 RGUA  P     6.0   1.00E+00

  222 RCYT  P     210 RADE  P     6.0   1.00E+00
  222 RCYT  P     211 RGUA  P     6.0   1.00E+00
  222 RCYT  P     212 RGUA  P     6.0   1.00E+00

  221 RGUA  P     210 RADE  P     6.0   1.00E+00
  221 RGUA  P     211 RGUA  P     6.0   1.00E+00
  221 RGUA  P     212 RGUA  P     6.0   1.00E+00
  221 RGUA  P     213 RGUA  P     6.0   1.00E+00

  220 RGUA  P     211 RGUA  P     6.0   1.00E+00
  220 RGUA  P     212 RGUA  P     6.0   1.00E+00
  220 RGUA  P     213 RGUA  P     6.0   1.00E+00

#Others
  202 RCYT  P     224 URA   P     6.0   1.00E+00
  202 RCYT  P     225 RADE  P     6.0   1.00E+00
  202 RCYT  P     226 RGUA  P     6.0   1.00E+00

  201 RCYT  P     225 RADE  P     6.0   1.00E+00
  201 RCYT  P     226 RGUA  P     6.0   1.00E+00
  201 RCYT  P     227 RGUA  P     6.0   1.00E+00

  200 RADE  P     225 RADE  P     6.0   1.00E+00
  200 RADE  P     226 RGUA  P     6.0   1.00E+00
  200 RADE  P     227 RGUA  P     6.0   1.00E+00

##### Added 3Jun06:
 162 RGUA P 191 RCYT P 6.0 1.00E+00
 162 RGUA P 192 RGUA P 6.0 1.00E+00
 163 RCYT P 191 RCYT P 6.0 1.00E+00
 163 RCYT P 190 RGUA P 6.0 1.00E+00

 170 RCYT P 226 RGUA P 6.0 1.00E+00
 170 RCYT P 227 RGUA P 6.0 1.00E+00
 170 RCYT P 228 RADE P 6.0 1.00E+00

 195 RCYT P 225 RADE P 6.0 1.00E+00
 194 RADE P 224 URA P 6.0 1.00E+00
 195 RCYT P 224 URA  P 6.0 1.00E+00
 196 RGUA P 224 URA  P 6.0 1.00E+00



*****************************************************************
# CYANA ANGLE RESTRAINT FILE
*****************************************************************

#----------------------------------------------------------------
# Angle Constraints for RNA Phosphodiester Linkages
# Note:  alpha, beta, gamma, zeta define torsion angles
#        associated with the 5' phosphodiester linkage
#        and epsi is associated with the 3'linkage.
#----------------------------------------------------------------

#------------------Begin O3--------------------------------------
#RCYT 160
160 RCYT  ALPHA    -118.0   -18.0  1.00E+00
160 RCYT  BETA     118.0   218.0  1.00E+00
160 RCYT  GAMMA     4.0   104.0   1.00E+00
160 RCYT  EPSI    -203.0   -103.0  1.00E+00
#160 RCYT  ZETA     -121.0   -1.0  1.00E+00

#URA 161
161 URA   ALPHA   -118.0   -18.0  1.00E+00
161 URA   BETA    118.0   218.0  1.00E+00
161 URA   GAMMA    4.0   104.0   1.00E+00
161 URA   EPSI   -203.0   -103.0  1.00E+00
161 URA   ZETA    -121.0   -1.0  1.00E+00

#RGUA 162 
162 RGUA  ZETA     -121.0   -1.0 1.00E+00
162 RGUA  ALPHA  -118.0   -18.0  1.00E+00
162 RGUA  BETA    118.0   218.0  1.00E+00
162 RGUA  GAMMA    4.0   104.0  1.00E+00
162 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RCYT 163
163 RCYT  ALPHA    -118.0   -18.0  1.00E+00
163 RCYT  BETA     118.0   218.0  1.00E+00
163 RCYT  GAMMA     4.0   104.0   1.00E+00
163 RCYT  EPSI    -203.0   -103.0  1.00E+00
163 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RCYT 164
164 RCYT  ALPHA    -118.0   -18.0  1.00E+00
164 RCYT  BETA     118.0   218.0  1.00E+00
164 RCYT  GAMMA     4.0   104.0   1.00E+00
164 RCYT  EPSI    -203.0   -103.0  1.00E+00
164 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RCYT 165
165 RCYT  ALPHA    -118.0   -18.0  1.00E+00
165 RCYT  BETA     118.0   218.0  1.00E+00
165 RCYT  GAMMA     4.0   104.0   1.00E+00
165 RCYT  EPSI    -203.0   -103.0  1.00E+00
165 RCYT  ZETA     -121.0   -1.0  1.00E+00

#URA 166
166 URA   ALPHA   -118.0   -18.0  1.00E+00
166 URA   BETA    118.0   218.0  1.00E+00
166 URA   GAMMA    4.0   104.0   1.00E+00
166 URA   EPSI   -203.0   -103.0  1.00E+00
166 URA   ZETA    -121.0   -1.0  1.00E+00

#RCYT 167
167 RCYT  ALPHA    -118.0   -18.0  1.00E+00
167 RCYT  BETA     118.0   218.0  1.00E+00
167 RCYT  GAMMA     4.0   104.0   1.00E+00
#167 RCYT  EPSI    -203.0   -103.0  1.00E+00
167 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RGUA 227 
#227 RGUA  ZETA     -121.0   -1.0 1.00E+00
#227 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#227 RGUA  BETA    118.0   218.0  1.00E+00
#227 RGUA  GAMMA    4.0   104.0  1.00E+00
227 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RADE 228
228 RADE  ALPHA   -118.0   -18.0  1.00E+00
228 RADE  BETA   118.0   218.0   1.00E+00
228 RADE  GAMMA     4.0   104.0  1.00E+00
228 RADE  ZETA     -121.0   -1.0 1.00E+00
228 RADE  EPSI   -203.0   -103.0  1.00E+00

#RGUA 229 
229 RGUA  ZETA     -121.0   -1.0 1.00E+00
229 RGUA  ALPHA  -118.0   -18.0  1.00E+00
229 RGUA  BETA    118.0   218.0  1.00E+00
229 RGUA  GAMMA    4.0   104.0  1.00E+00
229 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 230 
230 RGUA  ZETA     -121.0   -1.0 1.00E+00
230 RGUA  ALPHA  -118.0   -18.0  1.00E+00
230 RGUA  BETA    118.0   218.0  1.00E+00
230 RGUA  GAMMA    4.0   104.0  1.00E+00
230 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 231 
231 RGUA  ZETA     -121.0   -1.0 1.00E+00
231 RGUA  ALPHA  -118.0   -18.0  1.00E+00
231 RGUA  BETA    118.0   218.0  1.00E+00
231 RGUA  GAMMA    4.0   104.0  1.00E+00
231 RGUA  EPSI   -203.0   -103.0  1.00E+0

#RCYT 232
232 RCYT  ALPHA    -118.0   -18.0  1.00E+00
232 RCYT  BETA     118.0   218.0  1.00E+00
232 RCYT  GAMMA     4.0   104.0   1.00E+00
232 RCYT  EPSI    -203.0   -103.0  1.00E+00
232 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RADE 233
233 RADE  ALPHA   -118.0   -18.0  1.00E+00
233 RADE  BETA   118.0   218.0   1.00E+00
233 RADE  GAMMA     4.0   104.0  1.00E+00
233 RADE  ZETA     -121.0   -1.0 1.00E+00
233 RADE  EPSI   -203.0   -103.0  1.00E+00

#RGUA 234   
234 RGUA  ZETA     -121.0   -1.0 1.00E+00
234 RGUA  ALPHA  -118.0   -18.0  1.00E+00
234 RGUA  BETA    118.0   218.0  1.00E+00
234 RGUA  GAMMA    4.0   104.0  1.00E+00
#234 RGUA  EPSI   -203.0   -103.0  1.00E+00
#----------------End O3-------------------------------------------

#----------------Begin linker-1 and SL-A--------------------------
#RADE 168

#URA  169

#RCYT 170

#RCYT 171
#171 RCYT  ALPHA    -118.0   -18.0  1.00E+00
#171 RCYT  BETA     118.0   218.0  1.00E+00
#171 RCYT  GAMMA     4.0   104.0   1.00E+00
171 RCYT  EPSI    -203.0   -103.0  1.00E+00
#171 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RGUA 172 
172 RGUA  ZETA     -121.0   -1.0 1.00E+00
172 RGUA  ALPHA  -118.0   -18.0  1.00E+00
172 RGUA  BETA    118.0   218.0  1.00E+00
172 RGUA  GAMMA    4.0   104.0  1.00E+00
172 RGUA  EPSI   -203.0   -103.0  1.00E+00

#URA 173
173 URA   ALPHA   -118.0   -18.0  1.00E+00
173 URA   BETA    118.0   218.0  1.00E+00
173 URA   GAMMA    4.0   104.0   1.00E+00
173 URA   EPSI   -203.0   -103.0  1.00E+00
173 URA   ZETA    -121.0   -1.0  1.00E+00

#RCYT 174
174 RCYT  ZETA     -121.0   -1.0  1.00E+00
174 RCYT  ALPHA    -118.0   -18.0  1.00E+00
174 RCYT  BETA     118.0   218.0  1.00E+00
174 RCYT  GAMMA     4.0   104.0   1.00E+00
#174 RCYT  EPSI    -203.0   -103.0  1.00E+00

#URA 175                                     Bulge
#175 URA   ALPHA   -118.0   -18.0  1.00E+00
#175 URA   BETA    118.0   218.0  1.00E+00
#175 URA   GAMMA    4.0   104.0   1.00E+00
#175 URA   EPSI   -203.0   -103.0  1.00E+00
#175 URA   ZETA    -121.0   -1.0  1.00E+00

#RCYT 176
#176 RCYT  ZETA     -121.0   -1.0  1.00E+00
#176 RCYT  ALPHA    -118.0   -18.0  1.00E+00 
#176 RCYT  BETA     118.0   218.0  1.00E+00
#176 RCYT  GAMMA     4.0   104.0   1.00E+00
176 RCYT  EPSI    -203.0   -103.0  1.00E+00

#RGUA 177 
177 RGUA  ZETA     -121.0   -1.0 1.00E+00
177 RGUA  ALPHA  -118.0   -18.0  1.00E+00
177 RGUA  BETA    118.0   218.0  1.00E+00
177 RGUA  GAMMA    4.0   104.0  1.00E+00
177 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RCYT 178
178 RCYT  ALPHA    -118.0   -18.0  1.00E+00
178 RCYT  BETA     118.0   218.0  1.00E+00
178 RCYT  GAMMA     4.0   104.0   1.00E+00
178 RCYT  EPSI    -203.0   -103.0  1.00E+00
178 RCYT  ZETA     -121.0   -1.0  1.00E+00

#URA 179
179 URA   ALPHA   -118.0   -18.0  1.00E+00
179 URA   BETA    118.0   218.0  1.00E+00
179 URA   GAMMA    4.0   104.0   1.00E+00
179 URA   EPSI   -203.0   -103.0  1.00E+00
179 URA   ZETA    -121.0   -1.0  1.00E+00

#URA 180
180 URA   ALPHA   -118.0   -18.0  1.00E+00
180 URA   BETA    118.0   218.0  1.00E+00
180 URA   GAMMA    4.0   104.0   1.00E+00
180 URA   EPSI   -203.0   -103.0  1.00E+00
180 URA   ZETA    -121.0   -1.0  1.00E+00

#RADE 181
181 RADE  ALPHA   -118.0   -18.0  1.00E+00
181 RADE  BETA   118.0   218.0   1.00E+00
181 RADE  GAMMA     4.0   104.0  1.00E+00
181 RADE  ZETA    -121.0   -1.0  1.00E+00
#181 RADE  EPSI   -203.0   -103.0  1.00E+00

#URA 182                                      Loop
#182 URA   ALPHA   -118.0   -18.0  1.00E+00
#182 URA   BETA    118.0   218.0  1.00E+00
#182 URA   GAMMA    4.0   104.0   1.00E+00
#182 URA   EPSI   -203.0   -103.0  1.00E+00
#182 URA   ZETA    -121.0   -1.0  1.00E+00
#
#URA 183                                     Loop
#183 URA   ALPHA   -118.0   -18.0  1.00E+00
#183 URA   BETA    118.0   218.0  1.00E+00
#183 URA   GAMMA    4.0   104.0   1.00E+00
#183 URA   EPSI   -203.0   -103.0  1.00E+00
#183 URA   ZETA    -121.0   -1.0  1.00E+00
#
##RCYT 184                                    Loop
#184 RCYT  ALPHA    -118.0   -18.0  1.00E+00
#184 RCYT  BETA     118.0   218.0  1.00E+00
#184 RCYT  GAMMA     4.0   104.0   1.00E+00
#184 RCYT  EPSI    -203.0   -103.0  1.00E+00
#184 RCYT  ZETA     -121.0   -1.0  1.00E+00
#
#RGUA 185                                     Loop
#185 RGUA  ZETA     -121.0   -1.0 1.00E+00
#185 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#185 RGUA  BETA    118.0   218.0  1.00E+00
#185 RGUA  GAMMA    4.0   104.0  1.00E+00
#185 RGUA  EPSI   -203.0   -103.0  1.00E+00
#
#RGUA 186                                     Loop  
#186 RGUA  ZETA     -121.0   -1.0 1.00E+00
#186 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#186 RGUA  BETA    118.0   218.0  1.00E+00
#186 RGUA  GAMMA    4.0   104.0  1.00E+00
#186 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 187 
#187 RGUA  ZETA     -121.0   -1.0 1.00E+00
#187 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#187 RGUA  BETA    118.0   218.0  1.00E+00
#187 RGUA  GAMMA    4.0   104.0  1.00E+00
187 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 188 
188 RGUA  ZETA     -121.0   -1.0 1.00E+00
188 RGUA  ALPHA  -118.0   -18.0  1.00E+00
188 RGUA  BETA    118.0   218.0  1.00E+00
188 RGUA  GAMMA    4.0   104.0  1.00E+00
188 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RADE 189
189 RADE  ALPHA   -118.0   -18.0  1.00E+00
189 RADE  BETA   118.0   218.0   1.00E+00
189 RADE  GAMMA     4.0   104.0  1.00E+00
189 RADE  EPSI   -203.0   -103.0  1.00E+00
189 RADE  ZETA   -121.0   -1.0   1.00E+00

#RGUA 190 
190 RGUA  ZETA     -121.0   -1.0 1.00E+00
190 RGUA  ALPHA  -118.0   -18.0  1.00E+00
190 RGUA  BETA    118.0   218.0  1.00E+00
190 RGUA  GAMMA    4.0   104.0  1.00E+00
190 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RCYT 191
191 RCYT  ALPHA    -118.0   -18.0  1.00E+00
191 RCYT  BETA     118.0   218.0  1.00E+00
191 RCYT  GAMMA     4.0   104.0   1.00E+00
191 RCYT  EPSI    -203.0   -103.0  1.00E+00
191 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RGUA 192 
192 RGUA  ZETA     -121.0   -1.0 1.00E+00
192 RGUA  ALPHA  -118.0   -18.0  1.00E+00
192 RGUA  BETA    118.0   218.0  1.00E+00
192 RGUA  GAMMA    4.0   104.0  1.00E+00
192 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 193 
193 RGUA  ZETA     -121.0   -1.0 1.00E+00
193 RGUA  ALPHA  -118.0   -18.0  1.00E+00
193 RGUA  BETA    118.0   218.0  1.00E+00
193 RGUA  GAMMA    4.0   104.0  1.00E+00
193 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RADE 194
194 RADE  ALPHA   -118.0   -18.0  1.00E+00
194 RADE  BETA   118.0   218.0   1.00E+00
194 RADE  GAMMA     4.0   104.0  1.00E+00
194 RADE  EPSI   -203.0   -103.0  1.00E+00
194 RADE  ZETA   -121.0   -1.0   1.00E+00

#RCYT 195
195 RCYT  ALPHA    -118.0   -18.0  1.00E+00
195 RCYT  BETA     118.0   218.0  1.00E+00
195 RCYT  GAMMA     4.0   104.0   1.00E+00
195 RCYT  EPSI    -203.0   -103.0  1.00E+00
195 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RGUA 196 
196 RGUA  ZETA     -121.0   -1.0 1.00E+00
196 RGUA  ALPHA  -118.0   -18.0  1.00E+00
196 RGUA  BETA    118.0   218.0  1.00E+00
196 RGUA  GAMMA    4.0   104.0  1.00E+00
#196 RGUA  EPSI   -203.0   -103.0  1.00E+00
#----------------End linker-1 and SL-A----------------------------

#----------------Begin linker-2 and SL-B--------------------------
#RADE 197

#URA 198

#RGUA 199

#RADE 200

#RCYT 201
#201 RCYT  ALPHA    -118.0   -18.0  1.00E+00
#201 RCYT  BETA     118.0   218.0  1.00E+00
#201 RCYT  GAMMA     4.0   104.0   1.00E+00
#201 RCYT  ZETA     -121.0   -1.0  1.00E+00
 201 RCYT  EPSI    -203.0   -103.0  1.00E+00

#RCYT 202
202 RCYT  ALPHA    -118.0   -18.0  1.00E+00
202 RCYT  BETA     118.0   218.0  1.00E+00
202 RCYT  GAMMA     4.0   104.0   1.00E+00
202 RCYT  EPSI    -203.0   -103.0  1.00E+00
202 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RCYT 203
203 RCYT  ALPHA    -118.0   -18.0  1.00E+00
203 RCYT  BETA     118.0   218.0  1.00E+00
203 RCYT  GAMMA     4.0   104.0   1.00E+00
203 RCYT  EPSI    -203.0   -103.0  1.00E+00
203 RCYT  ZETA     -121.0   -1.0  1.00E+00

#URA 204
204 URA   ALPHA   -118.0   -18.0  1.00E+00
204 URA   BETA    118.0   218.0  1.00E+00
204 URA   GAMMA    4.0   104.0   1.00E+00
204 URA   EPSI   -203.0   -103.0  1.00E+00
204 URA   ZETA    -121.0   -1.0  1.00E+00

#RADE 205
205 RADE  ALPHA   -118.0   -18.0  1.00E+00
205 RADE  BETA   118.0   218.0   1.00E+00
205 RADE  GAMMA     4.0   104.0  1.00E+00
#205 RADE  EPSI   -203.0   -103.0  1.00E+00
205 RADE  ZETA   -121.0   -1.0   1.00E+00

#RGUA 206 
#206 RGUA  ZETA   -121.0   -1.0   1.00E+00
#206 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#206 RGUA  BETA    118.0   218.0  1.00E+00
#206 RGUA  GAMMA    4.0   104.0  1.00E+00
#206 RGUA  EPSI   -203.0   -103.0  1.00E+00

#URA 207
#207 URA   ALPHA   -118.0   -18.0  1.00E+00
#207 URA   BETA    118.0   218.0  1.00E+00
#207 URA   GAMMA    4.0   104.0   1.00E+00
#207 URA   EPSI   -203.0   -103.0  1.00E+00
#207 URA   ZETA    -121.0   -1.0  1.00E+00

#RADE 208
#208 RADE  ALPHA   -118.0   -18.0  1.00E+00
#208 RADE  BETA   118.0   218.0   1.00E+00
#208 RADE  GAMMA     4.0   104.0  1.00E+00
#208 RADE  EPSI   -203.0   -103.0  1.00E+00
#208 RADE  ZETA   -121.0   -1.0   1.00E+00

#RGUA 209 
#209 RGUA  ZETA   -121.0   -1.0   1.00E+00
209 RGUA  ALPHA  -118.0   -18.0  1.00E+00
209 RGUA  BETA    118.0   218.0  1.00E+00
209 RGUA  GAMMA    4.0   104.0  1.00E+00
209 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RADE 210
210 RADE  ALPHA   -118.0   -18.0  1.00E+00
210 RADE  BETA   118.0   218.0   1.00E+00
210 RADE  GAMMA     4.0   104.0  1.00E+00
210 RADE  EPSI   -203.0   -103.0  1.00E+00
210 RADE  ZETA   -121.0   -1.0   1.00E+00

#RGUA 211 
211 RGUA  ZETA     -121.0   -1.0 1.00E+00
211 RGUA  ALPHA  -118.0   -18.0  1.00E+00
211 RGUA  BETA    118.0   218.0  1.00E+00
211 RGUA  GAMMA    4.0   104.0  1.00E+00
211 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 212 
212 RGUA  ZETA   -121.0   -1.0   1.00E+00
212 RGUA  ALPHA  -118.0   -18.0  1.00E+00
212 RGUA  BETA    118.0   218.0  1.00E+00
212 RGUA  GAMMA    4.0   104.0  1.00E+00
212 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 213 
213 RGUA  ZETA     -121.0   -1.0 1.00E+00
213 RGUA  ALPHA  -118.0   -18.0  1.00E+00
213 RGUA  BETA    118.0   218.0  1.00E+00
213 RGUA  GAMMA    4.0   104.0  1.00E+00
213 RGUA  EPSI   -203.0   -103.0  1.00E+00
#----------------End linker-2 and SL-B-----------------------------

#----------------Begin SL-C and linker-3---------------------------
#RGUA 214 
214 RGUA  ZETA     -121.0   -1.0 1.00E+00
214 RGUA  ALPHA  -118.0   -18.0  1.00E+00
214 RGUA  BETA    118.0   218.0  1.00E+00
214 RGUA  GAMMA    4.0   104.0  1.00E+00
214 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 215 
215 RGUA  ZETA     -121.0   -1.0 1.00E+00
215 RGUA  ALPHA  -118.0   -18.0  1.00E+00
215 RGUA  BETA    118.0   218.0  1.00E+00
215 RGUA  GAMMA    4.0   104.0  1.00E+00
215 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RCYT 216
216 RCYT  ALPHA    -118.0   -18.0  1.00E+00
216 RCYT  BETA     118.0   218.0  1.00E+00
216 RCYT  GAMMA     4.0   104.0   1.00E+00
216 RCYT  EPSI    -203.0   -103.0  1.00E+00
216 RCYT  ZETA     -121.0   -1.0  1.00E+00

#URA 217
217 URA   ALPHA   -118.0   -18.0  1.00E+00
217 URA   BETA    118.0   218.0  1.00E+00
217 URA   GAMMA    4.0   104.0   1.00E+00
217 URA   ZETA    -121.0   -1.0  1.00E+00
#217 URA   EPSI   -203.0   -103.0  1.00E+00

#RGUA 218 
#218 RGUA  ZETA     -121.0   -1.0 1.00E+00
#218 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#218 RGUA  BETA    118.0   218.0  1.00E+00
#218 RGUA  GAMMA    4.0   104.0  1.00E+00
#218 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RCYT 219
#219 RCYT  ALPHA    -118.0   -18.0  1.00E+00
#219 RCYT  BETA     118.0   218.0  1.00E+00
#219 RCYT  GAMMA     4.0   104.0   1.00E+00
#219 RCYT  EPSI    -203.0   -103.0  1.00E+00
#219 RCYT  ZETA     -121.0   -1.0  1.00E+00

#RGUA 220 
#220 RGUA  ZETA     -121.0   -1.0 1.00E+00
#220 RGUA  ALPHA  -118.0   -18.0  1.00E+00
#220 RGUA  BETA    118.0   218.0  1.00E+00
#220 RGUA  GAMMA    4.0   104.0  1.00E+00
#220 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RGUA 221 
#221 RGUA  ZETA     -121.0   -1.0 1.00E+00
221 RGUA  ALPHA  -118.0   -18.0  1.00E+00
221 RGUA  BETA    118.0   218.0  1.00E+00
221 RGUA  GAMMA    4.0   104.0  1.00E+00
221 RGUA  EPSI   -203.0   -103.0  1.00E+00

#RCYT 222
222 RCYT  ALPHA    -118.0   -18.0  1.00E+00
222 RCYT  BETA     118.0   218.0  1.00E+00
222 RCYT  GAMMA     4.0   104.0   1.00E+00
222 RCYT  EPSI    -203.0   -103.0  1.00E+00
222 RCYT  ZETA     -121.0   -1.0  1.00E+00

#URA 223
223 URA   ALPHA   -118.0   -18.0  1.00E+00
223 URA   BETA    118.0   218.0  1.00E+00
223 URA   GAMMA    4.0   104.0   1.00E+00
223 URA   ZETA    -121.0   -1.0  1.00E+00
#223 URA   EPSI   -203.0   -103.0  1.00E+00

#Liker-3
#URA 224
#224 URA   ALPHA   -118.0   -18.0  1.00E+00
#224 URA   BETA    118.0   218.0  1.00E+00
#224 URA   GAMMA    4.0   104.0   1.00E+00
#224 URA   ZETA    -121.0   -1.0  1.00E+00
 224 URA   EPSI   -203.0   -103.0  1.00E+00

#RADE 225
 225 RADE   ALPHA   -118.0   -18.0  1.00E+00
 225 RADE   BETA    118.0   218.0  1.00E+00
 225 RADE   GAMMA    4.0   104.0   1.00E+00
 225 RADE   ZETA    -121.0   -1.0  1.00E+00
 225 RADE   EPSI   -203.0   -103.0  1.00E+00

#RGUA 226
 226 RGUA   ALPHA   -118.0   -18.0  1.00E+00
 226 RGUA   BETA    118.0   218.0  1.00E+00
 226 RGUA   GAMMA    4.0   104.0   1.00E+00
 226 RGUA   ZETA    -121.0   -1.0  1.00E+00
#226 RGUA   EPSI   -203.0   -103.0  1.00E+00
#----------------End SL-C and linker-3------------------------------

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    C 160          1H5*        C 160  27.736  23.623 -10.751
    2   2H5*    C 160          2H5*        C 160  26.185  23.130 -10.073
    3    H4*    C 160           H4*        C 160  27.718  22.526  -8.439
    4    H3*    C 160           H3*        C 160  26.432  25.150  -7.744
    5    H2*    C 160           H2*        C 160  27.631  25.200  -5.687
    6   2HO*    C 160          2HO*        C 160  28.857  23.247  -5.167
    7    H1*    C 160           H1*        C 160  30.088  24.671  -6.888
    8   1H4     C 160          1H4         C 160  29.608  31.053  -6.633
    9   2H4     C 160          2H4         C 160  28.921  31.023  -8.242
   10    H5     C 160           H5         C 160  28.363  29.040  -9.397
   11    H6     C 160           H6         C 160  28.324  26.573  -9.292
   12   1H5*    U 161          1H5*        U 161  23.993  22.480  -4.919
   13   2H5*    U 161          2H5*        U 161  22.390  23.215  -4.899
   14    H4*    U 161           H4*        U 161  23.672  23.424  -2.768
   15    H3*    U 161           H3*        U 161  22.634  25.859  -4.199
   16    H2*    U 161           H2*        U 161  23.345  27.213  -2.379
   17   2HO*    U 161          2HO*        U 161  24.521  25.354  -0.803
   18    H1*    U 161           H1*        U 161  25.891  26.035  -2.283
   19    H3     U 161           H3         U 161  26.182  30.393  -3.799
   20    H5     U 161           H5         U 161  25.650  28.010  -7.201
   21    H6     U 161           H6         U 161  25.165  26.138  -5.693
   22   1H5*    G 162          1H5*        G 162  21.277  25.994  -0.184
   23   2H5*    G 162          2H5*        G 162  19.514  26.047  -0.168
   24    H4*    G 162           H4*        G 162  20.141  27.678   1.365
   25    H3*    G 162           H3*        G 162  19.392  28.879  -1.269
   26    H2*    G 162           H2*        G 162  19.837  31.075  -0.459
   27   2HO*    G 162          2HO*        G 162  20.824  30.509   1.994
   28    H1*    G 162           H1*        G 162  22.366  30.393   0.505
   29    H8     G 162           H8         G 162  21.838  28.511  -2.644
   30    H1     G 162           H1         G 162  23.525  34.679  -3.641
   31   1H2     G 162          1H2         G 162  23.416  35.719  -1.864
   32   2H2     G 162          2H2         G 162  22.939  35.023  -0.331
   33   1H5*    C 163          1H5*        C 163  17.460  31.006   1.680
   34   2H5*    C 163          2H5*        C 163  15.745  31.315   1.405
   35    H4*    C 163           H4*        C 163  16.745  33.412   1.795
   36    H3*    C 163           H3*        C 163  16.101  32.940  -1.099
   37    H2*    C 163           H2*        C 163  16.843  35.132  -1.638
   38   2HO*    C 163          2HO*        C 163  17.709  36.039   0.729
   39    H1*    C 163           H1*        C 163  19.229  34.851  -0.169
   40   1H4     C 163          1H4         C 163  20.881  33.496  -6.187
   41   2H4     C 163          2H4         C 163  20.272  31.869  -5.975
   42    H5     C 163           H5         C 163  19.144  31.128  -4.037
   43    H6     C 163           H6         C 163  18.316  31.772  -1.802
   44   1H5*    C 164          1H5*        C 164  14.366  36.563   0.009
   45   2H5*    C 164          2H5*        C 164  12.730  36.815  -0.599
   46    H4*    C 164           H4*        C 164  14.051  38.652  -1.315
   47    H3*    C 164           H3*        C 164  13.320  36.724  -3.492
   48    H2*    C 164           H2*        C 164  14.424  38.065  -5.105
   49   2HO*    C 164          2HO*        C 164  15.009  40.203  -4.471
   50    H1*    C 164           H1*        C 164  16.707  38.405  -3.449
   51   1H4     C 164          1H4         C 164  18.326  33.896  -7.684
   52   2H4     C 164          2H4         C 164  17.566  32.697  -6.661
   53    H5     C 164           H5         C 164  16.335  33.219  -4.714
   54    H6     C 164           H6         C 164  15.521  35.038  -3.255
   55   1H5*    C 165          1H5*        C 165  11.650  40.652  -4.830
   56   2H5*    C 165          2H5*        C 165  10.226  40.316  -5.815
   57    H4*    C 165           H4*        C 165  12.000  41.543  -7.022
   58    H3*    C 165           H3*        C 165  11.107  38.850  -8.030
   59    H2*    C 165           H2*        C 165  12.469  39.139  -9.952
   60   2HO*    C 165          2HO*        C 165  13.615  41.397  -9.856
   61    H1*    C 165           H1*        C 165  14.690  39.999  -8.446
   62   1H4     C 165          1H4         C 165  15.653  33.770  -9.544
   63   2H4     C 165          2H4         C 165  14.746  33.407  -8.093
   64    H5     C 165           H5         C 165  13.607  35.032  -6.812
   65    H6     C 165           H6         C 165  13.053  37.429  -6.606
   66   1H5*    U 166          1H5*        U 166  10.390  41.633 -11.273
   67   2H5*    U 166          2H5*        U 166   8.816  41.297 -11.993
   68    H4*    U 166           H4*        U 166  10.492  41.285 -13.710
   69    H3*    U 166           H3*        U 166   9.286  38.609 -13.058
   70    H2*    U 166           H2*        U 166  10.499  37.634 -14.859
   71   2HO*    U 166          2HO*        U 166  11.220  39.012 -16.439
   72    H1*    U 166           H1*        U 166  12.924  38.788 -14.074
   73    H3     U 166           H3         U 166  13.117  34.272 -13.237
   74    H5     U 166           H5         U 166  11.353  35.965  -9.837
   75    H6     U 166           H6         U 166  11.207  38.072 -11.084
   76   1H5*    C 167          1H5*        C 167   8.667  38.973 -17.352
   77   2H5*    C 167          2H5*        C 167   6.914  38.946 -17.541
   78    H4*    C 167           H4*        C 167   7.661  37.433 -19.133
   79    H3*    C 167           H3*        C 167   6.702  36.025 -16.675
   80    H2*    C 167           H2*        C 167   7.234  33.904 -17.604
   81   2HO*    C 167          2HO*        C 167   6.699  34.216 -19.728
   82    H1*    C 167           H1*        C 167   9.807  34.718 -18.398
   83   1H4     C 167          1H4         C 167  10.594  31.775 -12.772
   84   2H4     C 167          2H4         C 167  10.304  33.302 -11.969
   85    H5     C 167           H5         C 167   9.642  35.273 -13.089
   86    H6     C 167           H6         C 167   9.091  36.275 -15.277
   87   1H5*    A 168          1H5*        A 168   2.841  34.688 -16.104
   88   2H5*    A 168          2H5*        A 168   1.520  35.345 -17.071
   89    H4*    A 168           H4*        A 168   1.327  37.225 -15.799
   90    H3*    A 168           H3*        A 168   4.256  37.216 -15.682
   91    H2*    A 168           H2*        A 168   4.459  37.900 -13.442
   92   2HO*    A 168          2HO*        A 168   1.654  38.116 -13.140
   93    H1*    A 168           H1*        A 168   2.714  36.144 -12.332
   94    H8     A 168           H8         A 168   5.688  36.486 -14.437
   95   1H6     A 168          1H6         A 168   7.189  30.606 -12.978
   96   2H6     A 168          2H6         A 168   7.781  32.080 -13.712
   97    H2     A 168           H2         A 168   3.015  31.347 -11.646
   98   1H5*    U 169          1H5*        U 169   2.505  37.240 -19.598
   99   2H5*    U 169          2H5*        U 169   3.424  38.718 -19.879
  100    H4*    U 169           H4*        U 169   1.594  39.881 -20.662
  101    H3*    U 169           H3*        U 169  -0.140  38.012 -19.043
  102    H2*    U 169           H2*        U 169  -1.965  38.577 -20.436
  103   2HO*    U 169          2HO*        U 169  -1.876  40.651 -21.063
  104    H1*    U 169           H1*        U 169  -0.324  38.451 -22.787
  105    H3     U 169           H3         U 169  -2.013  34.548 -24.175
  106    H5     U 169           H5         U 169  -2.521  34.323 -20.025
  107    H6     U 169           H6         U 169  -1.361  36.477 -19.865
  108   1H5*    C 170          1H5*        C 170   0.768  42.945 -17.010
  109   2H5*    C 170          2H5*        C 170   1.421  41.324 -17.244
  110    H4*    C 170           H4*        C 170   0.301  41.451 -14.622
  111    H3*    C 170           H3*        C 170   1.936  43.874 -15.351
  112    H2*    C 170           H2*        C 170   2.963  43.812 -13.235
  113   2HO*    C 170          2HO*        C 170   1.704  43.052 -11.613
  114    H1*    C 170           H1*        C 170   3.083  40.918 -13.303
  115   1H4     C 170          1H4         C 170   9.169  42.732 -13.887
  116   2H4     C 170          2H4         C 170   8.851  43.283 -15.516
  117    H5     C 170           H5         C 170   6.707  43.291 -16.507
  118    H6     C 170           H6         C 170   4.317  42.768 -16.174
  119   1H5*    C 171          1H5*        C 171  -0.080  47.771 -15.406
  120   2H5*    C 171          2H5*        C 171   1.658  47.811 -15.704
  121    H4*    C 171           H4*        C 171   0.184  47.651 -13.191
  122    H3*    C 171           H3*        C 171   2.962  48.489 -14.028
  123    H2*    C 171           H2*        C 171   3.582  48.528 -11.750
  124   2HO*    C 171          2HO*        C 171   1.731  49.518 -10.959
  125    H1*    C 171           H1*        C 171   2.128  46.109 -11.216
  126   1H4     C 171          1H4         C 171   8.273  44.374 -11.149
  127   2H4     C 171          2H4         C 171   8.284  44.387 -12.899
  128    H5     C 171           H5         C 171   6.464  45.108 -14.221
  129    H6     C 171           H6         C 171   4.162  46.001 -14.189
  130   1H5*    G 172          1H5*        G 172   1.408  52.949 -13.060
  131   2H5*    G 172          2H5*        G 172   2.516  53.804 -14.134
  132    H4*    G 172           H4*        G 172   2.886  54.226 -11.708
  133    H3*    G 172           H3*        G 172   5.089  53.151 -13.448
  134    H2*    G 172           H2*        G 172   6.609  53.329 -11.622
  135   2HO*    G 172          2HO*        G 172   5.502  54.248  -9.597
  136    H1*    G 172           H1*        G 172   4.903  52.001  -9.854
  137    H8     G 172           H8         G 172   4.646  50.483 -13.256
  138    H1     G 172           H1         G 172   9.684  48.303  -9.829
  139   1H2     G 172          1H2         G 172   9.915  49.456  -8.135
  140   2H2     G 172          2H2         G 172   8.896  50.811  -7.706
  141   1H5*    U 173          1H5*        U 173   6.817  56.251 -11.571
  142   2H5*    U 173          2H5*        U 173   7.378  57.503 -12.680
  143    H4*    U 173           H4*        U 173   9.235  57.114 -11.363
  144    H3*    U 173           H3*        U 173   9.478  55.489 -13.886
  145    H2*    U 173           H2*        U 173  11.642  54.788 -13.205
  146   2HO*    U 173          2HO*        U 173  12.219  55.866 -10.980
  147    H1*    U 173           H1*        U 173  10.805  54.147 -10.602
  148    H3     U 173           H3         U 173  11.631  50.080 -12.423
  149    H5     U 173           H5         U 173   8.014  51.252 -14.180
  150    H6     U 173           H6         U 173   8.317  53.438 -13.111
  151   1H5*    C 174          1H5*        C 174  12.953  57.719 -13.706
  152   2H5*    C 174          2H5*        C 174  13.425  58.435 -15.247
  153    H4*    C 174           H4*        C 174  15.233  57.092 -14.505
  154    H3*    C 174           H3*        C 174  13.690  55.830 -16.768
  155    H2*    C 174           H2*        C 174  15.350  54.137 -16.897
  156   2HO*    C 174          2HO*        C 174  17.274  54.502 -15.515
  157    H1*    C 174           H1*        C 174  15.380  53.807 -14.071
  158   1H4     C 174          1H4         C 174  11.896  48.970 -16.411
  159   2H4     C 174          2H4         C 174  10.478  49.989 -16.293
  160    H5     C 174           H5         C 174  10.546  52.275 -15.704
  161    H6     C 174           H6         C 174  12.006  54.165 -15.077
  162   1H5*    U 175          1H5*        U 175  17.425  57.382 -19.086
  163   2H5*    U 175          2H5*        U 175  17.229  58.619 -17.844
  164    H4*    U 175           H4*        U 175  16.877  59.684 -20.540
  165    H3*    U 175           H3*        U 175  19.306  58.042 -20.020
  166    H2*    U 175           H2*        U 175  20.763  59.719 -20.845
  167   2HO*    U 175          2HO*        U 175  19.864  61.318 -22.138
  168    H1*    U 175           H1*        U 175  19.708  61.765 -19.338
  169    H3     U 175           H3         U 175  23.543  60.633 -17.170
  170    H5     U 175           H5         U 175  20.756  57.776 -15.902
  171    H6     U 175           H6         U 175  19.209  58.689 -17.571
  172   1H5*    C 176          1H5*        C 176  17.510  54.886 -20.244
  173   2H5*    C 176          2H5*        C 176  18.565  55.739 -19.116
  174    H4*    C 176           H4*        C 176  20.462  54.297 -19.999
  175    H3*    C 176           H3*        C 176  18.226  53.075 -21.537
  176    H2*    C 176           H2*        C 176  18.974  50.862 -21.079
  177   2HO*    C 176          2HO*        C 176  21.043  50.699 -19.933
  178    H1*    C 176           H1*        C 176  19.150  51.265 -18.340
  179   1H4     C 176          1H4         C 176  13.213  49.113 -19.449
  180   2H4     C 176          2H4         C 176  12.669  50.775 -19.453
  181    H5     C 176           H5         C 176  14.121  52.635 -19.354
  182    H6     C 176           H6         C 176  16.476  53.365 -19.224
  183   1H5*    G 177          1H5*        G 177  21.834  50.745 -23.419
  184   2H5*    G 177          2H5*        G 177  21.418  51.123 -25.091
  185    H4*    G 177           H4*        G 177  21.719  48.713 -24.697
  186    H3*    G 177           H3*        G 177  19.064  49.739 -25.653
  187    H2*    G 177           H2*        G 177  18.261  47.504 -25.840
  188   2HO*    G 177          2HO*        G 177  19.876  45.806 -25.445
  189    H1*    G 177           H1*        G 177  19.085  46.810 -23.267
  190    H8     G 177           H8         G 177  17.923  50.291 -23.003
  191    H1     G 177           H1         G 177  13.027  46.072 -23.341
  192   1H2     G 177          1H2         G 177  13.748  44.222 -23.898
  193   2H2     G 177          2H2         G 177  15.430  43.867 -24.225
  194   1H5*    C 178          1H5*        C 178  20.357  46.701 -28.301
  195   2H5*    C 178          2H5*        C 178  19.975  47.032 -29.990
  196    H4*    C 178           H4*        C 178  19.033  44.911 -29.309
  197    H3*    C 178           H3*        C 178  17.096  47.111 -29.970
  198    H2*    C 178           H2*        C 178  15.278  45.612 -29.674
  199   2HO*    C 178          2HO*        C 178  15.736  43.412 -29.727
  200    H1*    C 178           H1*        C 178  16.304  44.617 -27.238
  201   1H4     C 178          1H4         C 178  11.951  48.995 -25.576
  202   2H4     C 178          2H4         C 178  13.173  50.237 -25.738
  203    H5     C 178           H5         C 178  15.351  49.840 -26.562
  204    H6     C 178           H6         C 178  16.907  48.136 -27.441
  205   1H5*    U 179          1H5*        U 179  15.948  43.802 -32.580
  206   2H5*    U 179          2H5*        U 179  15.624  44.477 -34.177
  207    H4*    U 179           H4*        U 179  13.722  43.206 -33.404
  208    H3*    U 179           H3*        U 179  13.355  46.172 -33.681
  209    H2*    U 179           H2*        U 179  11.068  45.970 -33.084
  210   2HO*    U 179          2HO*        U 179  10.892  43.318 -32.601
  211    H1*    U 179           H1*        U 179  11.637  44.293 -30.883
  212    H3     U 179           H3         U 179   9.977  48.300 -29.334
  213    H5     U 179           H5         U 179  14.098  48.881 -29.796
  214    H6     U 179           H6         U 179  14.175  46.716 -30.943
  215   1H5*    U 180          1H5*        U 180  10.442  44.193 -35.567
  216   2H5*    U 180          2H5*        U 180   9.879  44.706 -37.157
  217    H4*    U 180           H4*        U 180   7.993  44.670 -35.725
  218    H3*    U 180           H3*        U 180   8.959  47.419 -36.419
  219    H2*    U 180           H2*        U 180   7.211  48.405 -35.155
  220   2HO*    U 180          2HO*        U 180   5.424  47.147 -34.764
  221    H1*    U 180           H1*        U 180   7.653  46.684 -32.947
  222    H3     U 180           H3         U 180   8.785  50.746 -31.287
  223    H5     U 180           H5         U 180  11.956  49.789 -33.849
  224    H6     U 180           H6         U 180  10.654  47.841 -34.572
  225   1H5*    A 181          1H5*        A 181   5.618  47.144 -39.985
  226   2H5*    A 181          2H5*        A 181   6.357  48.402 -40.974
  227    H4*    A 181           H4*        A 181   4.106  48.930 -39.939
  228    H3*    A 181           H3*        A 181   6.498  50.736 -39.688
  229    H2*    A 181           H2*        A 181   5.157  52.351 -38.578
  230   2HO*    A 181          2HO*        A 181   3.258  52.172 -39.702
  231    H1*    A 181           H1*        A 181   4.033  50.493 -36.819
  232    H8     A 181           H8         A 181   7.638  49.716 -37.477
  233   1H6     A 181          1H6         A 181   8.987  53.604 -32.785
  234   2H6     A 181          2H6         A 181   9.661  52.421 -33.884
  235    H2     A 181           H2         A 181   4.653  53.971 -33.691
  236   1H5*    U 182          1H5*        U 182   6.604  51.086 -44.355
  237   2H5*    U 182          2H5*        U 182   5.251  51.640 -45.341
  238    H4*    U 182           H4*        U 182   4.996  49.445 -43.280
  239    H3*    U 182           H3*        U 182   5.941  49.260 -46.118
  240    H2*    U 182           H2*        U 182   4.700  47.260 -46.440
  241   2HO*    U 182          2HO*        U 182   3.444  46.937 -44.117
  242    H1*    U 182           H1*        U 182   2.373  48.366 -45.268
  243    H3     U 182           H3         U 182   1.436  47.611 -49.689
  244    H5     U 182           H5         U 182   3.454  51.280 -49.609
  245    H6     U 182           H6         U 182   3.940  50.849 -47.245
  246   1H5*    U 183          1H5*        U 183  11.165  47.645 -44.298
  247   2H5*    U 183          2H5*        U 183  10.291  46.514 -45.332
  248    H4*    U 183           H4*        U 183   9.238  46.046 -42.800
  249    H3*    U 183           H3*        U 183  12.164  46.727 -42.556
  250    H2*    U 183           H2*        U 183  12.442  44.974 -41.026
  251   2HO*    U 183          2HO*        U 183  10.346  44.046 -40.186
  252    H1*    U 183           H1*        U 183  10.519  43.337 -42.495
  253    H3     U 183           H3         U 183  14.270  40.761 -41.811
  254    H5     U 183           H5         U 183  15.178  43.231 -45.068
  255    H6     U 183           H6         U 183  13.113  44.462 -44.584
  256   1H5*    C 184          1H5*        C 184  10.548  51.373 -39.411
  257   2H5*    C 184          2H5*        C 184  12.019  51.088 -40.341
  258    H4*    C 184           H4*        C 184  11.527  50.296 -37.462
  259    H3*    C 184           H3*        C 184  13.043  52.564 -38.721
  260    H2*    C 184           H2*        C 184  14.661  52.457 -36.982
  261   2HO*    C 184          2HO*        C 184  13.616  51.905 -35.155
  262    H1*    C 184           H1*        C 184  14.909  49.653 -37.206
  263   1H4     C 184          1H4         C 184  19.798  52.097 -40.532
  264   2H4     C 184          2H4         C 184  18.758  52.183 -41.936
  265    H5     C 184           H5         C 184  16.447  51.699 -41.894
  266    H6     C 184           H6         C 184  14.546  51.006 -40.479
  267   1H5*    G 185          1H5*        G 185  11.700  55.750 -34.290
  268   2H5*    G 185          2H5*        G 185  13.120  56.313 -35.171
  269    H4*    G 185           H4*        G 185  13.036  54.643 -32.657
  270    H3*    G 185           H3*        G 185  13.773  57.470 -33.259
  271    H2*    G 185           H2*        G 185  15.590  57.413 -31.719
  272   2HO*    G 185          2HO*        G 185  14.742  56.109 -30.136
  273    H1*    G 185           H1*        G 185  16.657  55.073 -32.795
  274    H8     G 185           H8         G 185  17.370  58.164 -32.555
  275    H1     G 185           H1         G 185  17.424  57.227 -38.959
  276   1H2     G 185          1H2         G 185  16.383  55.506 -39.412
  277   2H2     G 185          2H2         G 185  15.611  54.470 -38.232
  278   1H5*    G 186          1H5*        G 186  11.324  59.188 -28.478
  279   2H5*    G 186          2H5*        G 186  12.600  60.243 -29.085
  280    H4*    G 186           H4*        G 186  12.832  58.228 -26.841
  281    H3*    G 186           H3*        G 186  12.517  61.206 -26.887
  282    H2*    G 186           H2*        G 186  13.973  61.425 -25.013
  283   2HO*    G 186          2HO*        G 186  14.587  59.464 -23.935
  284    H1*    G 186           H1*        G 186  15.964  59.841 -26.157
  285    H8     G 186           H8         G 186  14.465  61.800 -28.909
  286    H1     G 186           H1         G 186  18.614  65.259 -25.344
  287   1H2     G 186          1H2         G 186  19.083  64.216 -23.628
  288   2H2     G 186          2H2         G 186  18.447  62.639 -23.216
  289   1H5*    G 187          1H5*        G 187   8.277  59.955 -23.721
  290   2H5*    G 187          2H5*        G 187   9.080  58.947 -24.925
  291    H4*    G 187           H4*        G 187   6.646  60.684 -25.233
  292    H3*    G 187           H3*        G 187   7.239  57.761 -25.527
  293    H2*    G 187           H2*        G 187   5.577  57.566 -27.224
  294   2HO*    G 187          2HO*        G 187   5.027  60.323 -27.201
  295    H1*    G 187           H1*        G 187   6.566  59.727 -28.684
  296    H8     G 187           H8         G 187   9.547  58.049 -27.337
  297    H1     G 187           H1         G 187   6.984  54.864 -32.354
  298   1H2     G 187          1H2         G 187   5.114  55.627 -32.771
  299   2H2     G 187          2H2         G 187   4.354  56.935 -31.893
  300   1H5*    G 188          1H5*        G 188   3.091  57.870 -26.067
  301   2H5*    G 188          2H5*        G 188   2.465  57.093 -24.613
  302    H4*    G 188           H4*        G 188   1.282  56.059 -26.310
  303    H3*    G 188           H3*        G 188   3.624  54.340 -25.536
  304    H2*    G 188           H2*        G 188   2.882  52.663 -27.056
  305   2HO*    G 188          2HO*        G 188   0.750  52.718 -27.592
  306    H1*    G 188           H1*        G 188   2.586  54.476 -29.165
  307    H8     G 188           H8         G 188   5.601  55.572 -27.373
  308    H1     G 188           H1         G 188   6.679  50.338 -31.024
  309   1H2     G 188          1H2         G 188   4.878  49.550 -31.648
  310   2H2     G 188          2H2         G 188   3.309  50.210 -31.243
  311   1H5*    A 189          1H5*        A 189   0.381  51.503 -25.092
  312   2H5*    A 189          2H5*        A 189   0.814  50.472 -23.729
  313    H4*    A 189           H4*        A 189   0.607  49.276 -25.899
  314    H3*    A 189           H3*        A 189   3.193  49.190 -24.358
  315    H2*    A 189           H2*        A 189   4.032  47.592 -25.908
  316   2HO*    A 189          2HO*        A 189   2.535  46.482 -27.124
  317    H1*    A 189           H1*        A 189   3.212  49.109 -28.134
  318    H8     A 189           H8         A 189   4.586  51.324 -25.465
  319   1H6     A 189          1H6         A 189  10.231  50.241 -27.897
  320   2H6     A 189          2H6         A 189   9.348  51.216 -26.743
  321    H2     A 189           H2         A 189   7.332  47.484 -29.830
  322   1H5*    G 190          1H5*        G 190   2.003  45.080 -25.078
  323   2H5*    G 190          2H5*        G 190   2.043  44.252 -23.522
  324    H4*    G 190           H4*        G 190   3.227  42.886 -25.034
  325    H3*    G 190           H3*        G 190   5.033  44.390 -23.162
  326    H2*    G 190           H2*        G 190   6.916  43.242 -24.064
  327   2HO*    G 190          2HO*        G 190   6.491  41.441 -25.421
  328    H1*    G 190           H1*        G 190   6.206  43.800 -26.705
  329    H8     G 190           H8         G 190   5.331  46.757 -24.637
  330    H1     G 190           H1         G 190  11.619  46.486 -26.146
  331   1H2     G 190          1H2         G 190  12.054  44.640 -26.958
  332   2H2     G 190          2H2         G 190  10.888  43.357 -27.194
  333   1H5*    C 191          1H5*        C 191   6.079  40.111 -22.680
  334   2H5*    C 191          2H5*        C 191   6.858  39.926 -21.109
  335    H4*    C 191           H4*        C 191   8.281  39.434 -23.135
  336    H3*    C 191           H3*        C 191   9.145  41.364 -20.991
  337    H2*    C 191           H2*        C 191  11.260  41.559 -22.052
  338   2HO*    C 191          2HO*        C 191  11.649  40.047 -23.845
  339    H1*    C 191           H1*        C 191  10.134  41.909 -24.605
  340   1H4     C 191          1H4         C 191  11.369  47.780 -22.356
  341   2H4     C 191          2H4         C 191   9.736  47.832 -21.729
  342    H5     C 191           H5         C 191   8.256  45.992 -21.761
  343    H6     C 191           H6         C 191   7.975  43.626 -22.409
  344   1H5*    G 192          1H5*        G 192  12.579  38.854 -21.737
  345   2H5*    G 192          2H5*        G 192  12.736  37.985 -20.211
  346    H4*    G 192           H4*        G 192  14.909  38.634 -20.698
  347    H3*    G 192           H3*        G 192  13.663  40.500 -18.713
  348    H2*    G 192           H2*        G 192  15.678  41.767 -18.588
  349   2HO*    G 192          2HO*        G 192  17.320  40.711 -20.300
  350    H1*    G 192           H1*        G 192  15.895  42.018 -21.358
  351    H8     G 192           H8         G 192  12.294  42.195 -20.460
  352    H1     G 192           H1         G 192  15.427  47.779 -19.519
  353   1H2     G 192          1H2         G 192  17.459  47.466 -19.688
  354   2H2     G 192          2H2         G 192  18.202  45.921 -20.033
  355   1H5*    G 193          1H5*        G 193  17.695  40.128 -17.467
  356   2H5*    G 193          2H5*        G 193  17.585  39.338 -15.894
  357    H4*    G 193           H4*        G 193  19.038  41.115 -15.530
  358    H3*    G 193           H3*        G 193  16.269  41.817 -14.600
  359    H2*    G 193           H2*        G 193  17.076  43.904 -13.781
  360   2HO*    G 193          2HO*        G 193  19.676  43.363 -14.754
  361    H1*    G 193           H1*        G 193  18.377  44.532 -16.168
  362    H8     G 193           H8         G 193  15.153  42.727 -16.808
  363    H1     G 193           H1         G 193  14.454  49.104 -15.953
  364   1H2     G 193          1H2         G 193  16.235  49.910 -15.296
  365   2H2     G 193          2H2         G 193  17.699  48.995 -15.018
  366   1H5*    A 194          1H5*        A 194  19.023  42.712 -11.770
  367   2H5*    A 194          2H5*        A 194  18.807  41.921 -10.208
  368    H4*    A 194           H4*        A 194  19.254  44.119  -9.634
  369    H3*    A 194           H3*        A 194  16.288  43.643  -9.605
  370    H2*    A 194           H2*        A 194  15.926  45.870  -8.862
  371   2HO*    A 194          2HO*        A 194  17.606  46.821  -7.808
  372    H1*    A 194           H1*        A 194  17.582  47.006 -10.793
  373    H8     A 194           H8         A 194  15.782  44.063 -12.232
  374   1H6     A 194          1H6         A 194  11.095  47.972 -13.539
  375   2H6     A 194          2H6         A 194  11.701  46.351 -13.792
  376    H2     A 194           H2         A 194  14.028  50.122 -10.985
  377   1H5*    C 195          1H5*        C 195  17.003  45.442  -6.014
  378   2H5*    C 195          2H5*        C 195  16.514  44.430  -4.655
  379    H4*    C 195           H4*        C 195  15.506  46.477  -4.218
  380    H3*    C 195           H3*        C 195  13.551  44.551  -5.420
  381    H2*    C 195           H2*        C 195  11.815  46.166  -5.297
  382   2HO*    C 195          2HO*        C 195  13.636  48.056  -4.204
  383    H1*    C 195           H1*        C 195  13.462  48.193  -6.407
  384   1H4     C 195          1H4         C 195   9.947  46.246 -11.356
  385   2H4     C 195          2H4         C 195  10.874  44.765 -11.440
  386    H5     C 195           H5         C 195  12.554  44.174  -9.890
  387    H6     C 195           H6         C 195  13.771  44.865  -7.855
  388   1H5*    G 196          1H5*        G 196  12.275  44.001  -0.881
  389   2H5*    G 196          2H5*        G 196  11.557  42.392  -0.955
  390    H4*    G 196           H4*        G 196   9.943  44.278  -0.621
  391    H3*    G 196           H3*        G 196   9.646  42.315  -2.877
  392    H2*    G 196           H2*        G 196   7.577  43.329  -3.482
  393   2HO*    G 196          2HO*        G 196   7.065  43.700  -1.231
  394    H1*    G 196           H1*        G 196   8.642  45.909  -3.476
  395    H8     G 196           H8         G 196  11.273  43.678  -4.807
  396    H1     G 196           H1         G 196   6.722  45.076  -9.190
  397   1H2     G 196          1H2         G 196   5.121  45.980  -8.256
  398   2H2     G 196          2H2         G 196   5.026  46.311  -6.541
  399   1H5*    A 197          1H5*        A 197   5.621  40.755  -2.256
  400   2H5*    A 197          2H5*        A 197   5.301  42.005  -1.054
  401    H4*    A 197           H4*        A 197   4.270  40.433   0.427
  402    H3*    A 197           H3*        A 197   5.421  38.320  -1.371
  403    H2*    A 197           H2*        A 197   3.520  37.033  -1.201
  404   2HO*    A 197          2HO*        A 197   2.223  37.769   0.920
  405    H1*    A 197           H1*        A 197   1.943  39.473  -0.484
  406    H8     A 197           H8         A 197   3.189  38.266  -3.889
  407   1H6     A 197          1H6         A 197  -2.785  36.889  -5.056
  408   2H6     A 197          2H6         A 197  -1.180  36.937  -5.750
  409    H2     A 197           H2         A 197  -2.477  38.287  -0.850
  410   1H5*    U 198          1H5*        U 198   7.482  36.234   3.850
  411   2H5*    U 198          2H5*        U 198   8.511  36.573   2.459
  412    H4*    U 198           H4*        U 198   7.537  34.300   1.561
  413    H3*    U 198           H3*        U 198   6.864  34.166   4.485
  414    H2*    U 198           H2*        U 198   7.749  32.049   4.668
  415   2HO*    U 198          2HO*        U 198   6.710  30.872   3.168
  416    H1*    U 198           H1*        U 198   9.439  32.558   2.250
  417    H3     U 198           H3         U 198  13.223  31.122   4.132
  418    H5     U 198           H5         U 198  10.949  32.241   7.466
  419    H6     U 198           H6         U 198   9.205  32.973   5.906
  420   1H5*    G 199          1H5*        G 199   3.558  36.210   2.621
  421   2H5*    G 199          2H5*        G 199   4.638  37.375   3.387
  422    H4*    G 199           H4*        G 199   2.595  37.936   4.288
  423    H3*    G 199           H3*        G 199   3.973  36.053   6.193
  424    H2*    G 199           H2*        G 199   2.190  36.362   7.739
  425   2HO*    G 199          2HO*        G 199   1.915  38.577   7.299
  426    H1*    G 199           H1*        G 199   0.225  35.947   5.761
  427    H8     G 199           H8         G 199   3.265  34.368   7.376
  428    H1     G 199           H1         G 199  -1.594  30.260   6.195
  429   1H2     G 199          1H2         G 199  -3.051  31.215   5.092
  430   2H2     G 199          2H2         G 199  -2.968  32.881   4.565
  431   1H5*    A 200          1H5*        A 200   6.574  35.618   6.679
  432   2H5*    A 200          2H5*        A 200   5.186  35.243   7.701
  433    H4*    A 200           H4*        A 200   7.259  36.241   9.383
  434    H3*    A 200           H3*        A 200   8.304  34.530   7.204
  435    H2*    A 200           H2*        A 200   9.379  33.010   8.669
  436   2HO*    A 200          2HO*        A 200   8.415  34.595  10.850
  437    H1*    A 200           H1*        A 200   7.212  32.518  10.250
  438    H8     A 200           H8         A 200   5.755  33.364   6.948
  439   1H6     A 200          1H6         A 200   6.802  27.447   5.260
  440   2H6     A 200          2H6         A 200   6.004  28.934   4.796
  441    H2     A 200           H2         A 200   8.873  28.178   9.123
  442   1H5*    C 201          1H5*        C 201  12.822  36.176   8.312
  443   2H5*    C 201          2H5*        C 201  13.336  34.512   8.031
  444    H4*    C 201           H4*        C 201  11.386  35.591  10.034
  445    H3*    C 201           H3*        C 201  13.858  33.893  10.123
  446    H2*    C 201           H2*        C 201  13.064  32.781  12.060
  447   2HO*    C 201          2HO*        C 201  10.702  33.868  12.528
  448    H1*    C 201           H1*        C 201  10.449  32.500  10.927
  449   1H4     C 201          1H4         C 201  12.934  26.664  10.339
  450   2H4     C 201          2H4         C 201  14.052  27.248   9.126
  451    H5     C 201           H5         C 201  14.234  29.515   8.487
  452    H6     C 201           H6         C 201  13.379  31.801   8.858
  453   1H5*    C 202          1H5*        C 202  13.662  35.956  14.022
  454   2H5*    C 202          2H5*        C 202  15.222  35.878  14.841
  455    H4*    C 202           H4*        C 202  13.365  34.567  15.905
  456    H3*    C 202           H3*        C 202  15.952  33.221  15.121
  457    H2*    C 202           H2*        C 202  15.227  31.280  16.262
  458   2HO*    C 202          2HO*        C 202  13.583  31.528  17.801
  459    H1*    C 202           H1*        C 202  12.581  31.517  15.206
  460   1H4     C 202          1H4         C 202  15.365  26.818  11.877
  461   2H4     C 202          2H4         C 202  16.061  28.022  10.815
  462    H5     C 202           H5         C 202  15.893  30.350  11.176
  463    H6     C 202           H6         C 202  15.005  32.114  12.658
  464   1H5*    C 203          1H5*        C 203  15.262  33.099  19.256
  465   2H5*    C 203          2H5*        C 203  16.632  32.890  20.347
  466    H4*    C 203           H4*        C 203  15.053  31.042  20.525
  467    H3*    C 203           H3*        C 203  17.797  30.397  19.450
  468    H2*    C 203           H2*        C 203  17.249  28.089  19.568
  469   2HO*    C 203          2HO*        C 203  14.659  28.589  20.539
  470    H1*    C 203           H1*        C 203  14.690  28.533  18.403
  471   1H4     C 203          1H4         C 203  18.407  26.201  13.740
  472   2H4     C 203          2H4         C 203  18.892  27.839  13.362
  473    H5     C 203           H5         C 203  18.283  29.721  14.652
  474    H6     C 203           H6         C 203  17.047  30.503  16.641
  475   1H5*    U 204          1H5*        U 204  16.794  28.382  22.953
  476   2H5*    U 204          2H5*        U 204  18.049  27.981  24.126
  477    H4*    U 204           H4*        U 204  16.822  25.998  23.466
  478    H3*    U 204           H3*        U 204  19.716  26.145  22.663
  479    H2*    U 204           H2*        U 204  19.588  23.919  21.829
  480   2HO*    U 204          2HO*        U 204  17.762  22.687  22.417
  481    H1*    U 204           H1*        U 204  17.264  24.420  20.360
  482    H3     U 204           H3         U 204  20.848  23.919  17.497
  483    H5     U 204           H5         U 204  20.707  27.992  18.461
  484    H6     U 204           H6         U 204  19.038  27.429  20.167
  485   1H5*    A 205          1H5*        A 205  20.360  23.823  26.814
  486   2H5*    A 205          2H5*        A 205  22.113  23.969  26.935
  487    H4*    A 205           H4*        A 205  21.086  21.715  26.218
  488    H3*    A 205           H3*        A 205  23.443  23.047  24.902
  489    H2*    A 205           H2*        A 205  23.713  21.151  23.500
  490   2HO*    A 205          2HO*        A 205  21.498  19.979  24.891
  491    H1*    A 205           H1*        A 205  21.001  21.026  22.822
  492    H8     A 205           H8         A 205  21.840  24.608  22.957
  493   1H6     A 205          1H6         A 205  24.188  24.057  17.201
  494   2H6     A 205          2H6         A 205  23.717  25.203  18.435
  495    H2     A 205           H2         A 205  23.412  19.978  18.782
  496   1H5*    G 206          1H5*        G 206  27.326  22.577  25.428
  497   2H5*    G 206          2H5*        G 206  26.731  23.208  23.893
  498    H4*    G 206           H4*        G 206  28.692  21.634  23.759
  499    H3*    G 206           H3*        G 206  26.170  21.216  22.181
  500    H2*    G 206           H2*        G 206  27.167  19.352  21.082
  501   2HO*    G 206          2HO*        G 206  29.349  19.389  21.001
  502    H1*    G 206           H1*        G 206  28.000  18.167  23.462
  503    H8     G 206           H8         G 206  24.939  19.681  21.822
  504    H1     G 206           H1         G 206  23.814  14.212  25.094
  505   1H2     G 206          1H2         G 206  25.513  13.664  26.126
  506   2H2     G 206          2H2         G 206  27.019  14.555  26.107
  507   1H5*    U 207          1H5*        U 207  26.736  21.964  17.626
  508   2H5*    U 207          2H5*        U 207  28.396  21.678  17.105
  509    H4*    U 207           H4*        U 207  27.056  23.734  16.214
  510    H3*    U 207           H3*        U 207  29.955  23.671  17.011
  511    H2*    U 207           H2*        U 207  30.185  25.939  16.350
  512   2HO*    U 207          2HO*        U 207  28.684  26.726  14.911
  513    H1*    U 207           H1*        U 207  27.903  26.790  17.704
  514    H3     U 207           H3         U 207  30.978  28.470  20.514
  515    H5     U 207           H5         U 207  31.488  24.335  20.938
  516    H6     U 207           H6         U 207  29.840  24.047  19.145
  517   1H5*    A 208          1H5*        A 208  31.967  24.174  12.085
  518   2H5*    A 208          2H5*        A 208  30.614  24.217  10.955
  519    H4*    A 208           H4*        A 208  32.128  22.547  10.206
  520    H3*    A 208           H3*        A 208  29.557  21.539  11.338
  521    H2*    A 208           H2*        A 208  30.201  19.273  10.993
  522   2HO*    A 208          2HO*        A 208  32.283  18.974   9.862
  523    H1*    A 208           H1*        A 208  32.679  19.610  12.247
  524    H8     A 208           H8         A 208  29.450  21.269  13.481
  525   1H6     A 208          1H6         A 208  29.365  16.753  17.788
  526   2H6     A 208          2H6         A 208  28.550  18.199  17.233
  527    H2     A 208           H2         A 208  32.817  16.031  15.086
  528   1H5*    G 209          1H5*        G 209  28.819  20.117   7.980
  529   2H5*    G 209          2H5*        G 209  27.124  20.098   7.494
  530    H4*    G 209           H4*        G 209  27.831  18.200   8.959
  531    H3*    G 209           H3*        G 209  25.541  19.998   9.704
  532    H2*    G 209           H2*        G 209  25.081  18.624  11.596
  533   2HO*    G 209          2HO*        G 209  27.305  16.971  11.042
  534    H1*    G 209           H1*        G 209  27.732  18.646  12.469
  535    H8     G 209           H8         G 209  27.049  22.009  11.099
  536    H1     G 209           H1         G 209  24.599  21.179  17.032
  537   1H2     G 209          1H2         G 209  24.681  19.181  17.538
  538   2H2     G 209          2H2         G 209  25.319  17.919  16.508
  539   1H5*    A 210          1H5*        A 210  24.269  16.088  10.862
  540   2H5*    A 210          2H5*        A 210  22.728  15.889  10.027
  541    H4*    A 210           H4*        A 210  22.438  15.437  12.369
  542    H3*    A 210           H3*        A 210  21.138  17.971  11.385
  543    H2*    A 210           H2*        A 210  20.102  18.226  13.504
  544   2HO*    A 210          2HO*        A 210  19.626  16.292  14.362
  545    H1*    A 210           H1*        A 210  22.485  17.674  14.909
  546    H8     A 210           H8         A 210  23.115  19.854  11.940
  547   1H6     A 210          1H6         A 210  21.809  24.715  15.630
  548   2H6     A 210          2H6         A 210  22.428  24.253  14.060
  549    H2     A 210           H2         A 210  20.775  20.990  17.820
  550   1H5*    G 211          1H5*        G 211  18.080  15.272  13.095
  551   2H5*    G 211          2H5*        G 211  16.537  15.526  12.280
  552    H4*    G 211           H4*        G 211  16.419  15.805  14.733
  553    H3*    G 211           H3*        G 211  15.679  18.086  12.922
  554    H2*    G 211           H2*        G 211  14.996  19.363  14.814
  555   2HO*    G 211          2HO*        G 211  15.298  18.077  16.928
  556    H1*    G 211           H1*        G 211  17.363  18.879  16.211
  557    H8     G 211           H8         G 211  18.389  19.238  12.699
  558    H1     G 211           H1         G 211  17.032  24.931  15.461
  559   1H2     G 211          1H2         G 211  16.078  24.613  17.262
  560   2H2     G 211          2H2         G 211  15.701  23.039  17.924
  561   1H5*    G 212          1H5*        G 212  12.735  17.350  15.732
  562   2H5*    G 212          2H5*        G 212  11.160  16.981  15.031
  563    H4*    G 212           H4*        G 212  10.668  18.454  16.757
  564    H3*    G 212           H3*        G 212  10.693  19.846  14.111
  565    H2*    G 212           H2*        G 212  10.173  21.933  15.138
  566   2HO*    G 212          2HO*        G 212  10.295  21.005  17.749
  567    H1*    G 212           H1*        G 212  12.215  21.699  17.031
  568    H8     G 212           H8         G 212  13.393  20.307  13.783
  569    H1     G 212           H1         G 212  13.803  26.758  14.106
  570   1H2     G 212          1H2         G 212  12.800  27.429  15.779
  571   2H2     G 212          2H2         G 212  11.972  26.397  16.924
  572   1H5*    G 213          1H5*        G 213   5.915  19.289  14.497
  573   2H5*    G 213          2H5*        G 213   5.536  19.286  12.775
  574    H4*    G 213           H4*        G 213   4.697  21.264  14.070
  575    H3*    G 213           H3*        G 213   6.405  21.571  11.616
  576    H2*    G 213           H2*        G 213   6.126  23.935  11.725
  577   2HO*    G 213          2HO*        G 213   4.685  23.958  14.091
  578    H1*    G 213           H1*        G 213   6.822  24.063  14.426
  579    H8     G 213           H8         G 213   8.934  21.467  12.816
  580    H1     G 213           H1         G 213  11.066  27.486  11.764
  581   1H2     G 213          1H2         G 213   9.634  28.840  12.372
  582   2H2     G 213          2H2         G 213   8.086  28.409  13.063
  583   1H5*    G 214          1H5*        G 214   4.996  24.777   9.997
  584   2H5*    G 214          2H5*        G 214   4.735  24.159   8.366
  585    H4*    G 214           H4*        G 214   6.694  25.710   8.661
  586    H3*    G 214           H3*        G 214   6.973  22.985   7.419
  587    H2*    G 214           H2*        G 214   9.252  23.461   6.917
  588   2HO*    G 214          2HO*        G 214   9.955  25.677   7.338
  589    H1*    G 214           H1*        G 214   9.812  24.348   9.510
  590    H8     G 214           H8         G 214   7.526  21.515   9.967
  591    H1     G 214           H1         G 214  13.516  19.602   8.435
  592   1H2     G 214          1H2         G 214  14.612  21.223   7.785
  593   2H2     G 214          2H2         G 214  13.999  22.858   7.671
  594   1H5*    G 215          1H5*        G 215   8.379  25.555   3.170
  595   2H5*    G 215          2H5*        G 215   6.911  24.779   2.575
  596    H4*    G 215           H4*        G 215   8.958  24.397   1.189
  597    H3*    G 215           H3*        G 215   7.341  22.110   2.279
  598    H2*    G 215           H2*        G 215   8.712  20.575   1.079
  599   2HO*    G 215          2HO*        G 215   8.919  21.980  -0.733
  600    H1*    G 215           H1*        G 215  11.089  21.698   2.012
  601    H8     G 215           H8         G 215   8.683  21.867   4.812
  602    H1     G 215           H1         G 215  11.207  15.959   4.036
  603   1H2     G 215          1H2         G 215  12.210  15.869   2.237
  604   2H2     G 215          2H2         G 215  12.348  17.197   1.106
  605   1H5*    C 216          1H5*        C 216   5.506  22.295  -1.993
  606   2H5*    C 216          2H5*        C 216   4.031  21.342  -1.835
  607    H4*    C 216           H4*        C 216   6.044  20.222  -2.916
  608    H3*    C 216           H3*        C 216   4.471  18.976  -0.668
  609    H2*    C 216           H2*        C 216   5.742  16.987  -0.922
  610   2HO*    C 216          2HO*        C 216   7.215  18.172  -3.042
  611    H1*    C 216           H1*        C 216   8.191  18.372  -1.034
  612   1H4     C 216          1H4         C 216   7.590  16.442   5.035
  613   2H4     C 216          2H4         C 216   6.698  17.907   5.382
  614    H5     C 216           H5         C 216   6.047  19.470   3.736
  615    H6     C 216           H6         C 216   6.091  20.019   1.329
  616   1H5*    U 217          1H5*        U 217   3.654  15.853  -3.955
  617   2H5*    U 217          2H5*        U 217   2.124  15.197  -3.371
  618    H4*    U 217           H4*        U 217   4.097  13.607  -3.477
  619    H3*    U 217           H3*        U 217   2.400  13.958  -1.016
  620    H2*    U 217           H2*        U 217   3.586  12.186   0.033
  621   2HO*    U 217          2HO*        U 217   4.925  10.881  -1.313
  622    H1*    U 217           H1*        U 217   6.096  13.205  -0.684
  623    H3     U 217           H3         U 217   5.438  13.630   3.870
  624    H5     U 217           H5         U 217   3.946  17.145   2.149
  625    H6     U 217           H6         U 217   4.201  16.065  -0.038
  626   1H5*    G 218          1H5*        G 218  -1.055  10.136  -1.899
  627   2H5*    G 218          2H5*        G 218  -0.570   9.619  -0.285
  628    H4*    G 218           H4*        G 218  -0.674   7.673  -1.617
  629    H3*    G 218           H3*        G 218   2.110   8.575  -0.995
  630    H2*    G 218           H2*        G 218   3.038   6.770  -2.218
  631   2HO*    G 218          2HO*        G 218   0.769   5.597  -3.142
  632    H1*    G 218           H1*        G 218   1.285   7.181  -4.413
  633    H8     G 218           H8         G 218   2.492  10.496  -3.444
  634    H1     G 218           H1         G 218   6.980   7.128  -6.670
  635   1H2     G 218          1H2         G 218   6.401   5.153  -6.795
  636   2H2     G 218          2H2         G 218   4.920   4.505  -6.126
  637   1H5*    C 219          1H5*        C 219   3.306   4.722   2.609
  638   2H5*    C 219          2H5*        C 219   1.843   4.333   3.514
  639    H4*    C 219           H4*        C 219   3.612   6.021   4.458
  640    H3*    C 219           H3*        C 219   0.736   5.821   4.844
  641    H2*    C 219           H2*        C 219   0.363   8.062   4.486
  642   2HO*    C 219          2HO*        C 219   2.113   8.047   6.776
  643    H1*    C 219           H1*        C 219   3.347   8.562   4.944
  644   1H4     C 219          1H4         C 219   1.375  14.158   2.479
  645   2H4     C 219          2H4         C 219   1.502  13.421   0.898
  646    H5     C 219           H5         C 219   1.945  11.128   0.547
  647    H6     C 219           H6         C 219   2.380   8.956   1.639
  648   1H5*    G 220          1H5*        G 220   5.278   4.224   7.134
  649   2H5*    G 220          2H5*        G 220   4.903   5.753   6.341
  650    H4*    G 220           H4*        G 220   6.423   3.392   5.314
  651    H3*    G 220           H3*        G 220   6.859   6.383   5.356
  652    H2*    G 220           H2*        G 220   8.280   6.170   3.532
  653   2HO*    G 220          2HO*        G 220   8.929   3.701   3.246
  654    H1*    G 220           H1*        G 220   6.775   3.766   2.657
  655    H8     G 220           H8         G 220   6.467   4.216   0.215
  656    H1     G 220           H1         G 220   5.965  10.609   1.084
  657   1H2     G 220          1H2         G 220   6.107  11.045   3.094
  658   2H2     G 220          2H2         G 220   6.329   9.855   4.357
  659   1H5*    G 221          1H5*        G 221  10.340   5.322   5.978
  660   2H5*    G 221          2H5*        G 221  11.502   6.453   6.672
  661    H4*    G 221           H4*        G 221  10.776   6.420   4.074
  662    H3*    G 221           H3*        G 221  11.758   8.716   5.772
  663    H2*    G 221           H2*        G 221  11.724  10.087   3.838
  664   2HO*    G 221          2HO*        G 221  10.808   8.080   2.129
  665    H1*    G 221           H1*        G 221   9.186   9.131   3.026
  666    H8     G 221           H8         G 221   9.315   9.786   6.700
  667    H1     G 221           H1         G 221   8.118  15.079   3.174
  668   1H2     G 221          1H2         G 221   8.415  14.658   1.177
  669   2H2     G 221          2H2         G 221   8.914  13.103   0.551
  670   1H5*    C 222          1H5*        C 222  15.458   7.876   3.479
  671   2H5*    C 222          2H5*        C 222  16.764   8.803   4.218
  672    H4*    C 222           H4*        C 222  15.485   9.836   2.247
  673    H3*    C 222           H3*        C 222  16.038  11.321   4.822
  674    H2*    C 222           H2*        C 222  15.233  13.278   3.793
  675   2HO*    C 222          2HO*        C 222  14.760  12.706   1.304
  676    H1*    C 222           H1*        C 222  13.152  11.802   2.430
  677   1H4     C 222          1H4         C 222  10.198  15.347   6.865
  678   2H4     C 222          2H4         C 222  10.534  14.096   8.040
  679    H5     C 222           H5         C 222  11.869  12.198   7.596
  680    H6     C 222           H6         C 222  13.222  11.023   5.897
  681   1H5*    U 223          1H5*        U 223  16.622  14.406   2.411
  682   2H5*    U 223          2H5*        U 223  18.318  14.828   2.651
  683    H4*    U 223           H4*        U 223  17.046  16.771   3.105
  684    H3*    U 223           H3*        U 223  18.128  15.450   5.579
  685    H2*    U 223           H2*        U 223  17.178  17.102   6.928
  686   2HO*    U 223          2HO*        U 223  17.530  19.037   6.012
  687    H1*    U 223           H1*        U 223  14.887  17.342   5.118
  688    H3     U 223           H3         U 223  12.982  16.980   9.245
  689    H5     U 223           H5         U 223  14.406  13.133   8.400
  690    H6     U 223           H6         U 223  15.516  14.084   6.431
  691   1H5*    U 224          1H5*        U 224  20.211  18.031   1.637
  692   2H5*    U 224          2H5*        U 224  18.707  17.695   2.493
  693    H4*    U 224           H4*        U 224  19.518  15.948   0.196
  694    H3*    U 224           H3*        U 224  18.736  18.795  -0.056
  695    H2*    U 224           H2*        U 224  17.032  18.371  -1.638
  696   2HO*    U 224          2HO*        U 224  17.076  16.374  -2.707
  697    H1*    U 224           H1*        U 224  15.817  16.341  -0.228
  698    H3     U 224           H3         U 224  12.897  19.480   1.041
  699    H5     U 224           H5         U 224  16.505  20.932   2.594
  700    H6     U 224           H6         U 224  17.618  19.026   1.524
  701   1H5*    A 225          1H5*        A 225  20.720  18.389  -4.242
  702   2H5*    A 225          2H5*        A 225  20.603  20.057  -4.804
  703    H4*    A 225           H4*        A 225  18.875  18.269  -5.590
  704    H3*    A 225           H3*        A 225  18.238  21.108  -4.786
  705    H2*    A 225           H2*        A 225  16.006  20.755  -5.497
  706   2HO*    A 225          2HO*        A 225  16.666  18.110  -6.306
  707    H1*    A 225           H1*        A 225  15.850  18.221  -4.240
  708    H8     A 225           H8         A 225  17.508  20.969  -2.250
  709   1H6     A 225          1H6         A 225  11.852  22.128   0.121
  710   2H6     A 225          2H6         A 225  13.551  22.530   0.244
  711    H2     A 225           H2         A 225  11.409  19.131  -3.129
  712   1H5*    G 226          1H5*        G 226  17.394  20.200  -8.915
  713   2H5*    G 226          2H5*        G 226  17.097  21.534 -10.031
  714    H4*    G 226           H4*        G 226  15.154  20.028  -9.724
  715    H3*    G 226           H3*        G 226  14.925  22.955  -9.086
  716    H2*    G 226           H2*        G 226  12.598  22.678  -8.656
  717   2HO*    G 226          2HO*        G 226  11.655  20.665  -9.267
  718    H1*    G 226           H1*        G 226  13.008  20.486  -6.966
  719    H8     G 226           H8         G 226  15.780  22.776  -6.230
  720    H1     G 226           H1         G 226  10.200  24.768  -3.626
  721   1H2     G 226          1H2         G 226   8.640  23.683  -4.426
  722   2H2     G 226          2H2         G 226   8.817  22.422  -5.625
  723   1H5*    G 227          1H5*        G 227  13.593  21.671 -14.046
  724   2H5*    G 227          2H5*        G 227  15.348  21.841 -14.085
  725    H4*    G 227           H4*        G 227  14.627  22.513 -16.204
  726    H3*    G 227           H3*        G 227  15.300  24.846 -14.450
  727    H2*    G 227           H2*        G 227  14.799  26.364 -16.217
  728   2HO*    G 227          2HO*        G 227  13.996  24.230 -17.896
  729    H1*    G 227           H1*        G 227  12.317  25.200 -16.743
  730    H8     G 227           H8         G 227  12.984  25.151 -13.070
  731    H1     G 227           H1         G 227  10.661  30.805 -15.196
  732   1H2     G 227          1H2         G 227  10.666  30.820 -17.258
  733   2H2     G 227          2H2         G 227  11.218  29.498 -18.261
  734   1H5*    A 228          1H5*        A 228  17.929  25.647 -18.034
  735   2H5*    A 228          2H5*        A 228  19.364  26.382 -17.319
  736    H4*    A 228           H4*        A 228  18.125  27.797 -18.983
  737    H3*    A 228           H3*        A 228  18.730  28.779 -16.203
  738    H2*    A 228           H2*        A 228  17.872  30.915 -16.788
  739   2HO*    A 228          2HO*        A 228  17.109  30.296 -19.364
  740    H1*    A 228           H1*        A 228  15.556  29.852 -17.968
  741    H8     A 228           H8         A 228  16.314  27.894 -14.913
  742   1H6     A 228          1H6         A 228  13.332  32.306 -11.659
  743   2H6     A 228          2H6         A 228  14.035  30.707 -11.565
  744    H2     A 228           H2         A 228  13.890  33.781 -15.813
  745   1H5*    G 229          1H5*        G 229  20.585  31.886 -19.159
  746   2H5*    G 229          2H5*        G 229  22.053  32.303 -18.277
  747    H4*    G 229           H4*        G 229  20.687  34.262 -18.925
  748    H3*    G 229           H3*        G 229  21.304  33.734 -16.033
  749    H2*    G 229           H2*        G 229  20.246  35.783 -15.432
  750   2HO*    G 229          2HO*        G 229  19.294  36.733 -17.693
  751    H1*    G 229           H1*        G 229  17.941  35.222 -16.902
  752    H8     G 229           H8         G 229  18.981  31.988 -15.499
  753    H1     G 229           H1         G 229  16.162  35.791 -11.086
  754   1H2     G 229          1H2         G 229  15.996  37.706 -11.833
  755   2H2     G 229          2H2         G 229  16.539  38.207 -13.418
  756   1H5*    G 230          1H5*        G 230  22.693  38.127 -16.846
  757   2H5*    G 230          2H5*        G 230  24.147  38.149 -15.849
  758    H4*    G 230           H4*        G 230  22.525  39.974 -15.360
  759    H3*    G 230           H3*        G 230  23.416  38.071 -13.214
  760    H2*    G 230           H2*        G 230  22.193  39.321 -11.596
  761   2HO*    G 230          2HO*        G 230  21.052  41.115 -13.356
  762    H1*    G 230           H1*        G 230  19.855  39.333 -13.119
  763    H8     G 230           H8         G 230  21.347  36.022 -13.691
  764    H1     G 230           H1         G 230  18.477  36.463  -7.907
  765   1H2     G 230          1H2         G 230  18.046  38.438  -7.501
  766   2H2     G 230          2H2         G 230  18.408  39.776  -8.569
  767   1H5*    G 231          1H5*        G 231  23.818  42.091 -11.720
  768   2H5*    G 231          2H5*        G 231  25.486  42.283 -11.179
  769    H4*    G 231           H4*        G 231  24.131  43.137  -9.453
  770    H3*    G 231           H3*        G 231  25.298  40.449  -8.825
  771    H2*    G 231           H2*        G 231  24.295  40.483  -6.664
  772   2HO*    G 231          2HO*        G 231  23.023  42.948  -7.224
  773    H1*    G 231           H1*        G 231  21.769  41.127  -7.658
  774    H8     G 231           H8         G 231  23.388  38.818 -10.071
  775    H1     G 231           H1         G 231  20.853  35.772  -4.955
  776   1H2     G 231          1H2         G 231  20.326  37.157  -3.520
  777   2H2     G 231          2H2         G 231  20.539  38.886  -3.680
  778   1H5*    C 232          1H5*        C 232  26.052  42.943  -5.658
  779   2H5*    C 232          2H5*        C 232  27.679  42.885  -4.979
  780    H4*    C 232           H4*        C 232  26.172  42.454  -3.206
  781    H3*    C 232           H3*        C 232  27.631  40.005  -4.157
  782    H2*    C 232           H2*        C 232  26.619  38.724  -2.433
  783   2HO*    C 232          2HO*        C 232  25.195  41.002  -1.520
  784    H1*    C 232           H1*        C 232  24.048  39.747  -2.962
  785   1H4     C 232          1H4         C 232  24.251  34.173  -6.076
  786   2H4     C 232          2H4         C 232  25.075  34.961  -7.402
  787    H5     C 232           H5         C 232  25.794  37.210  -7.355
  788    H6     C 232           H6         C 232  25.900  39.278  -6.010
  789   1H5*    A 233          1H5*        A 233  27.911  40.077   0.042
  790   2H5*    A 233          2H5*        A 233  29.612  40.034   0.504
  791    H4*    A 233           H4*        A 233  28.578  38.403   1.824
  792    H3*    A 233           H3*        A 233  30.042  37.182  -0.499
  793    H2*    A 233           H2*        A 233  29.508  35.007   0.303
  794   2HO*    A 233          2HO*        A 233  28.055  35.344   2.433
  795    H1*    A 233           H1*        A 233  26.800  35.597   0.644
  796    H8     A 233           H8         A 233  28.220  37.280  -2.396
  797   1H6     A 233          1H6         A 233  26.770  32.079  -5.525
  798   2H6     A 233          2H6         A 233  27.330  33.727  -5.697
  799    H2     A 233           H2         A 233  26.140  31.316  -1.193
  800   1H5*    G 234          1H5*        G 234  31.538  35.190   3.062
  801   2H5*    G 234          2H5*        G 234  33.300  35.213   2.994
  802    H4*    G 234           H4*        G 234  32.620  32.976   3.420
  803    H3*    G 234           H3*        G 234  33.667  33.446   0.646
  804    H2*    G 234           H2*        G 234  33.464  31.121   0.167
  805   2HO*    G 234          2HO*        G 234  32.453  29.978   2.234
  806    H1*    G 234           H1*        G 234  30.831  30.987   1.082
  807    H8     G 234           H8         G 234  31.364  34.263  -0.610
  808    H1     G 234           H1         G 234  30.205  29.408  -4.729
  809   1H2     G 234          1H2         G 234  30.286  27.612  -3.718
  810   2H2     G 234          2H2         G 234  30.619  27.447  -2.008
  811   1H    GLY  15          1H        GLY  15   1.811  -0.001   0.854
  812   1HA   GLY  15          1HA       GLY  15   2.133  -1.011  -1.618
  813   2HA   GLY  15          2HA       GLY  15   1.541   0.606  -1.968
  814    H    ARG  16           H        ARG  16   4.181  -1.271  -0.666
  815    HA   ARG  16           HA       ARG  16   5.815   0.995  -0.022
  816   1HB   ARG  16          2HB       ARG  16   6.370  -1.958  -0.255
  817   2HB   ARG  16          3HB       ARG  16   7.635  -0.790   0.106
  818   1HG   ARG  16          2HG       ARG  16   7.004  -1.561   2.195
  819   2HG   ARG  16          3HG       ARG  16   6.106  -0.050   2.037
  820   1HD   ARG  16          2HD       ARG  16   4.089  -1.117   1.788
  821   2HD   ARG  16          3HD       ARG  16   4.823  -2.577   1.126
  822    HE   ARG  16           HE       ARG  16   4.895  -3.413   3.241
  823   1HH1  ARG  16          2HH1      ARG  16   4.744   0.060   3.436
  824   2HH1  ARG  16          1HH1      ARG  16   4.640   0.089   5.165
  825   1HH2  ARG  16          2HH2      ARG  16   4.759  -3.388   5.518
  826   2HH2  ARG  16          1HH2      ARG  16   4.649  -1.873   6.349
  827    H    ALA  17           H        ALA  17   5.426   2.006  -2.188
  828    HA   ALA  17           HA       ALA  17   6.973   0.865  -4.377
  829   1HB   ALA  17          1HB       ALA  17   5.227   3.316  -4.215
  830   2HB   ALA  17          2HB       ALA  17   6.090   2.803  -5.665
  831   3HB   ALA  17          3HB       ALA  17   4.837   1.773  -4.974
  832    H    ARG  18           H        ARG  18   7.946   2.296  -1.751
  833    HA   ARG  18           HA       ARG  18   9.259   4.640  -2.293
  834   1HB   ARG  18          2HB       ARG  18   9.326   2.703  -0.263
  835   2HB   ARG  18          3HB       ARG  18  10.995   2.891  -0.785
  836   1HG   ARG  18          2HG       ARG  18   9.278   5.257  -0.121
  837   2HG   ARG  18          3HG       ARG  18  10.170   4.371   1.118
  838   1HD   ARG  18          2HD       ARG  18  12.172   5.158   0.428
  839   2HD   ARG  18          3HD       ARG  18  11.712   5.137  -1.274
  840    HE   ARG  18           HE       ARG  18  10.318   7.175   0.113
  841   1HH1  ARG  18          2HH1      ARG  18  13.450   6.375  -1.177
  842   2HH1  ARG  18          1HH1      ARG  18  13.912   8.025  -1.430
  843   1HH2  ARG  18          2HH2      ARG  18  10.914   9.352  -0.215
  844   2HH2  ARG  18          1HH2      ARG  18  12.469   9.718  -0.881
  845    H    GLY  19           H        GLY  19  10.902   5.265  -3.551
  846   1HA   GLY  19          1HA       GLY  19  13.129   4.861  -4.433
  847   2HA   GLY  19          2HA       GLY  19  12.669   3.180  -4.665
  848    H    LEU  20           H        LEU  20   9.995   4.074  -5.702
  849    HA   LEU  20           HA       LEU  20  10.910   4.832  -8.397
  850   1HB   LEU  20          2HB       LEU  20   9.247   2.697  -7.457
  851   2HB   LEU  20          3HB       LEU  20   8.321   3.736  -8.538
  852    HG   LEU  20           HG       LEU  20  10.872   3.171  -9.713
  853   1HD1  LEU  20          1HD1      LEU  20  10.891   0.835  -9.872
  854   2HD1  LEU  20          2HD1      LEU  20   9.276   0.686  -9.180
  855   3HD1  LEU  20          3HD1      LEU  20  10.632   1.165  -8.158
  856   1HD2  LEU  20          1HD2      LEU  20   7.993   2.925 -10.350
  857   2HD2  LEU  20          2HD2      LEU  20   9.109   1.934 -11.290
  858   3HD2  LEU  20          3HD2      LEU  20   9.297   3.688 -11.259
  859    H    CYS  21           H        CYS  21  10.403   6.911  -8.980
  860    HA   CYS  21           HA       CYS  21   8.539   8.389  -7.484
  861   1HB   CYS  21          2HB       CYS  21  10.511   9.361  -8.664
  862   2HB   CYS  21          3HB       CYS  21   9.728   9.045 -10.200
  863    H    TYR  22           H        TYR  22   6.492   9.112  -8.140
  864    HA   TYR  22           HA       TYR  22   5.180   7.463 -10.197
  865   1HB   TYR  22          2HB       TYR  22   4.045   6.893  -8.275
  866   2HB   TYR  22          3HB       TYR  22   4.289   8.470  -7.533
  867    HD1  TYR  22           HD1      TYR  22   2.522   6.982 -10.476
  868    HD2  TYR  22           HD2      TYR  22   2.442   9.831  -7.317
  869    HE1  TYR  22           HE1      TYR  22   0.242   7.633 -11.130
  870    HE2  TYR  22           HE2      TYR  22   0.161  10.489  -7.961
  871    HH   TYR  22           HH       TYR  22  -1.300  10.422  -9.885
  872    H    THR  23           H        THR  23   5.871  10.672  -9.134
  873    HA   THR  23           HA       THR  23   3.857  12.066 -10.541
  874    HB   THR  23           HB       THR  23   6.619  12.998  -9.731
  875    HG1  THR  23           HG1      THR  23   4.093  13.419  -8.478
  876   1HG2  THR  23          1HG2      THR  23   4.414  14.315 -11.157
  877   2HG2  THR  23          2HG2      THR  23   6.123  14.739 -11.073
  878   3HG2  THR  23          3HG2      THR  23   5.032  15.212  -9.771
  879    H    CYS  24           H        CYS  24   7.201  11.036 -11.460
  880    HA   CYS  24           HA       CYS  24   6.541  11.946 -14.166
  881   1HB   CYS  24          2HB       CYS  24   8.950  12.098 -14.582
  882   2HB   CYS  24          3HB       CYS  24   8.473  13.122 -13.242
  883    H    GLY  25           H        GLY  25   7.846   9.412 -12.094
  884   1HA   GLY  25          1HA       GLY  25   7.333   7.100 -12.469
  885   2HA   GLY  25          2HA       GLY  25   7.266   7.433 -14.193
  886    H    SER  26           H        SER  26   9.800   8.501 -11.991
  887    HA   SER  26           HA       SER  26  11.658   6.651 -13.334
  888   1HB   SER  26          2HB       SER  26  11.736   9.572 -13.141
  889   2HB   SER  26          3HB       SER  26  13.229   8.802 -12.607
  890    HG   SER  26           HG       SER  26  12.817   7.530 -14.716
  891    HA   PRO  27           HA       PRO  27  12.535   5.372  -9.184
  892   1HB   PRO  27          2HB       PRO  27  14.667   3.799  -9.773
  893   2HB   PRO  27          3HB       PRO  27  12.998   3.313 -10.092
  894   1HG   PRO  27          2HG       PRO  27  15.031   4.453 -11.971
  895   2HG   PRO  27          3HG       PRO  27  13.893   3.118 -12.230
  896   1HD   PRO  27          2HD       PRO  27  13.447   5.617 -13.173
  897   2HD   PRO  27          3HD       PRO  27  12.131   4.539 -12.665
  898    H    GLY  28           H        GLY  28  14.387   5.372  -7.669
  899   1HA   GLY  28          1HA       GLY  28  16.547   6.133  -7.021
  900   2HA   GLY  28          2HA       GLY  28  16.560   7.196  -8.420
  901    H    HIS  29           H        HIS  29  13.784   8.097  -7.808
  902    HA   HIS  29           HA       HIS  29  14.144   9.548  -5.303
  903   1HB   HIS  29          2HB       HIS  29  13.894  11.714  -6.255
  904   2HB   HIS  29          3HB       HIS  29  15.149  10.907  -7.191
  905    HD1  HIS  29           HD1      HIS  29  14.776  10.701  -9.664
  906    HD2  HIS  29           HD2      HIS  29  11.354  11.885  -7.627
  907    HE1  HIS  29           HE1      HIS  29  13.109  11.308 -11.447
  908    H    TYR  30           H        TYR  30  12.126  11.040  -4.984
  909    HA   TYR  30           HA       TYR  30   9.734   9.608  -5.935
  910   1HB   TYR  30          2HB       TYR  30  10.707   9.774  -3.265
  911   2HB   TYR  30          3HB       TYR  30   9.232  10.730  -3.358
  912    HD1  TYR  30           HD1      TYR  30  10.400   7.460  -4.762
  913    HD2  TYR  30           HD2      TYR  30   7.355   9.587  -2.687
  914    HE1  TYR  30           HE1      TYR  30   9.064   5.400  -4.622
  915    HE2  TYR  30           HE2      TYR  30   6.011   7.533  -2.541
  916    HH   TYR  30           HH       TYR  30   5.827   5.404  -3.173
  917    H    GLN  31           H        GLN  31   7.707  11.011  -5.201
  918    HA   GLN  31           HA       GLN  31   7.590  13.237  -6.804
  919   1HB   GLN  31          2HB       GLN  31   5.629  12.064  -5.833
  920   2HB   GLN  31          3HB       GLN  31   5.988  12.802  -4.278
  921   1HG   GLN  31          2HG       GLN  31   5.264  14.864  -4.927
  922   2HG   GLN  31          3HG       GLN  31   5.638  14.583  -6.626
  923   1HE2  GLN  31          1HE2      GLN  31   3.285  15.727  -6.005
  924   2HE2  GLN  31          2HE2      GLN  31   1.981  14.625  -6.269
  925    H    ALA  32           H        ALA  32   8.344  13.096  -3.347
  926    HA   ALA  32           HA       ALA  32   8.448  15.825  -2.811
  927   1HB   ALA  32          1HB       ALA  32   8.521  14.142  -1.060
  928   2HB   ALA  32          2HB       ALA  32  10.118  13.623  -1.604
  929   3HB   ALA  32          3HB       ALA  32   9.898  15.236  -0.925
  930    H    GLN  33           H        GLN  33  10.746  13.746  -4.420
  931    HA   GLN  33           HA       GLN  33  12.529  16.065  -4.774
  932   1HB   GLN  33          2HB       GLN  33  13.280  13.877  -3.465
  933   2HB   GLN  33          3HB       GLN  33  13.576  13.295  -5.098
  934   1HG   GLN  33          2HG       GLN  33  15.040  15.216  -5.507
  935   2HG   GLN  33          3HG       GLN  33  14.762  15.767  -3.856
  936   1HE2  GLN  33          1HE2      GLN  33  17.175  14.798  -5.395
  937   2HE2  GLN  33          2HE2      GLN  33  17.880  13.603  -4.365
  938    H    CYS  34           H        CYS  34  10.183  15.306  -6.461
  939    HA   CYS  34           HA       CYS  34  11.294  14.062  -8.772
  940   1HB   CYS  34          2HB       CYS  34   8.889  13.867  -8.099
  941   2HB   CYS  34          3HB       CYS  34   8.669  15.560  -8.494
  942    HA   PRO  35           HA       PRO  35  13.170  17.831 -10.247
  943   1HB   PRO  35          2HB       PRO  35  13.875  16.869 -12.686
  944   2HB   PRO  35          3HB       PRO  35  14.746  16.460 -11.203
  945   1HG   PRO  35          2HG       PRO  35  12.671  14.884 -12.677
  946   2HG   PRO  35          3HG       PRO  35  14.189  14.328 -11.947
  947   1HD   PRO  35          2HD       PRO  35  11.787  14.005 -10.739
  948   2HD   PRO  35          3HD       PRO  35  13.289  14.257  -9.826
  949    H    LYS  36           H        LYS  36  10.403  16.274 -11.522
  950    HA   LYS  36           HA       LYS  36   9.945  18.370 -13.513
  951   1HB   LYS  36          2HB       LYS  36   9.590  15.912 -14.035
  952   2HB   LYS  36          3HB       LYS  36   8.207  15.968 -12.950
  953   1HG   LYS  36          2HG       LYS  36   6.915  16.853 -14.519
  954   2HG   LYS  36          3HG       LYS  36   8.099  18.112 -14.875
  955   1HD   LYS  36          2HD       LYS  36   9.304  15.986 -16.016
  956   2HD   LYS  36          3HD       LYS  36   7.611  15.528 -16.214
  957   1HE   LYS  36          2HE       LYS  36   8.435  18.301 -16.920
  958   2HE   LYS  36          3HE       LYS  36   8.861  16.990 -18.019
  959   1HZ   LYS  36          1HZ       LYS  36   6.171  16.713 -17.248
  960   2HZ   LYS  36          2HZ       LYS  36   6.802  16.992 -18.792
  961   3HZ   LYS  36          3HZ       LYS  36   6.415  18.297 -17.788
  962    H    LYS  37           H        LYS  37   9.462  18.008 -10.314
  963    HA   LYS  37           HA       LYS  37   6.788  18.627  -9.839
  964   1HB   LYS  37          2HB       LYS  37   9.335  18.981  -8.348
  965   2HB   LYS  37          3HB       LYS  37   7.949  19.913  -7.795
  966   1HG   LYS  37          2HG       LYS  37   7.150  17.207  -8.257
  967   2HG   LYS  37          3HG       LYS  37   8.579  17.238  -7.221
  968   1HD   LYS  37          2HD       LYS  37   7.008  17.499  -5.604
  969   2HD   LYS  37          3HD       LYS  37   7.171  19.196  -6.062
  970   1HE   LYS  37          2HE       LYS  37   5.237  17.595  -7.619
  971   2HE   LYS  37          3HE       LYS  37   4.815  17.908  -5.937
  972   1HZ   LYS  37          1HZ       LYS  37   4.041  19.839  -6.693
  973   2HZ   LYS  37          2HZ       LYS  37   4.842  19.701  -8.177
  974   3HZ   LYS  37          3HZ       LYS  37   5.656  20.324  -6.831
  975    H    ARG  38           H        ARG  38   5.736  20.210 -10.868
  976    HA   ARG  38           HA       ARG  38   6.409  22.936 -10.350
  977   1HB   ARG  38          2HB       ARG  38   7.519  21.770 -12.688
  978   2HB   ARG  38          3HB       ARG  38   6.234  22.854 -13.204
  979   1HG   ARG  38          2HG       ARG  38   7.376  24.531 -11.566
  980   2HG   ARG  38          3HG       ARG  38   8.772  23.471 -11.771
  981   1HD   ARG  38          2HD       ARG  38   8.850  25.302 -13.366
  982   2HD   ARG  38          3HD       ARG  38   8.629  23.765 -14.200
  983    HE   ARG  38           HE       ARG  38   6.103  24.831 -13.761
  984   1HH1  ARG  38          2HH1      ARG  38   8.990  25.637 -15.530
  985   2HH1  ARG  38          1HH1      ARG  38   8.145  26.497 -16.774
  986   1HH2  ARG  38          2HH2      ARG  38   4.978  25.961 -15.393
  987   2HH2  ARG  38          1HH2      ARG  38   5.863  26.681 -16.694
  988    H    LYS  39           H        LYS  39   4.736  21.218 -12.992
  989    HA   LYS  39           HA       LYS  39   2.197  22.322 -12.004
  990   1HB   LYS  39          2HB       LYS  39   3.528  23.054 -14.413
  991   2HB   LYS  39          3HB       LYS  39   2.092  22.138 -14.850
  992   1HG   LYS  39          2HG       LYS  39   1.147  23.844 -12.923
  993   2HG   LYS  39          3HG       LYS  39   2.340  24.831 -13.771
  994   1HD   LYS  39          2HD       LYS  39   0.389  23.217 -15.352
  995   2HD   LYS  39          3HD       LYS  39  -0.143  24.726 -14.607
  996   1HE   LYS  39          2HE       LYS  39   1.954  25.745 -15.711
  997   2HE   LYS  39          3HE       LYS  39   1.952  24.291 -16.708
  998   1HZ   LYS  39          1HZ       LYS  39   0.273  25.063 -17.918
  999   2HZ   LYS  39          2HZ       LYS  39   0.539  26.568 -17.193
 1000   3HZ   LYS  39          3HZ       LYS  39  -0.627  25.519 -16.559
 1001    H    SER  40           H        SER  40   0.424  21.274 -13.698
 1002    HA   SER  40           HA       SER  40  -0.758  19.392 -14.183
 1003   1HB   SER  40          2HB       SER  40   1.281  19.056 -15.684
 1004   2HB   SER  40          3HB       SER  40   1.882  17.952 -14.447
 1005    HG   SER  40           HG       SER  40  -0.134  17.613 -16.287
 1006    H    GLY  41           H        GLY  41  -0.593  19.908 -11.535
 1007   1HA   GLY  41          1HA       GLY  41  -0.357  17.202 -10.378
 1008   2HA   GLY  41          2HA       GLY  41   0.235  18.616  -9.518
 1009    H    ASN  42           H        ASN  42  -1.242  20.076  -8.610
 1010    HA   ASN  42           HA       ASN  42  -4.079  19.546  -8.815
 1011   1HB   ASN  42          2HB       ASN  42  -2.486  18.916  -6.350
 1012   2HB   ASN  42          3HB       ASN  42  -4.161  19.441  -6.207
 1013   1HD2  ASN  42          1HD2      ASN  42  -2.247  16.816  -6.333
 1014   2HD2  ASN  42          2HD2      ASN  42  -3.368  15.651  -6.942
 1015    H    SER  43           H        SER  43  -1.792  21.151  -6.592
 1016    HA   SER  43           HA       SER  43  -1.649  23.295  -5.844
 1017   1HB   SER  43          2HB       SER  43  -3.100  24.067  -8.382
 1018   2HB   SER  43          3HB       SER  43  -2.008  25.067  -7.423
 1019    HG   SER  43           HG       SER  43  -1.344  23.638  -9.461
 1020    H    ARG  44           H        ARG  44  -2.945  23.281  -4.065
 1021    HA   ARG  44           HA       ARG  44  -5.813  23.468  -4.283
 1022   1HB   ARG  44          2HB       ARG  44  -3.843  23.221  -2.061
 1023   2HB   ARG  44          3HB       ARG  44  -5.428  23.883  -1.683
 1024   1HG   ARG  44          2HG       ARG  44  -6.517  21.895  -2.428
 1025   2HG   ARG  44          3HG       ARG  44  -5.007  21.250  -3.075
 1026   1HD   ARG  44          2HD       ARG  44  -4.810  21.965  -0.263
 1027   2HD   ARG  44          3HD       ARG  44  -6.058  20.758  -0.570
 1028    HE   ARG  44           HE       ARG  44  -3.243  20.363  -0.670
 1029   1HH1  ARG  44          2HH1      ARG  44  -6.247  19.369  -2.123
 1030   2HH1  ARG  44          1HH1      ARG  44  -5.651  17.814  -2.601
 1031   1HH2  ARG  44          2HH2      ARG  44  -2.448  18.318  -1.294
 1032   2HH2  ARG  44          1HH2      ARG  44  -3.490  17.217  -2.129
 1033    H    GLU  45           H        GLU  45  -3.495  25.505  -2.493
 1034    HA   GLU  45           HA       GLU  45  -4.437  27.918  -3.704
 1035   1HB   GLU  45          2HB       GLU  45  -5.322  28.909  -1.581
 1036   2HB   GLU  45          3HB       GLU  45  -6.327  27.638  -2.263
 1037   1HG   GLU  45          2HG       GLU  45  -5.829  26.151  -0.584
 1038   2HG   GLU  45          3HG       GLU  45  -4.306  26.945  -0.187
 1039    H    ARG  46           H        ARG  46  -1.937  26.511  -3.131
 1040    HA   ARG  46           HA       ARG  46  -0.620  28.362  -1.275
 1041   1HB   ARG  46          2HB       ARG  46  -0.405  25.733  -1.256
 1042   2HB   ARG  46          3HB       ARG  46   0.786  26.035  -2.515
 1043   1HG   ARG  46          2HG       ARG  46   2.250  27.050  -1.083
 1044   2HG   ARG  46          3HG       ARG  46   0.977  27.580   0.018
 1045   1HD   ARG  46          2HD       ARG  46   2.482  25.742   0.872
 1046   2HD   ARG  46          3HD       ARG  46   0.750  25.419   0.947
 1047    HE   ARG  46           HE       ARG  46   2.030  24.439  -1.439
 1048   1HH1  ARG  46          2HH1      ARG  46   1.179  23.744   1.864
 1049   2HH1  ARG  46          1HH1      ARG  46   1.225  22.025   1.651
 1050   1HH2  ARG  46          2HH2      ARG  46   2.094  22.178  -1.732
 1051   2HH2  ARG  46          1HH2      ARG  46   1.746  21.135  -0.394
 1052    H    CYS  47           H        CYS  47   1.818  28.879  -1.974
 1053    HA   CYS  47           HA       CYS  47   1.714  29.556  -4.823
 1054   1HB   CYS  47          2HB       CYS  47   1.328  31.564  -3.443
 1055   2HB   CYS  47          3HB       CYS  47   2.828  31.277  -2.583
 1056    H    GLN  48           H        GLN  48   3.281  28.506  -5.840
 1057    HA   GLN  48           HA       GLN  48   5.563  27.443  -4.358
 1058   1HB   GLN  48          2HB       GLN  48   3.960  26.393  -6.371
 1059   2HB   GLN  48          3HB       GLN  48   5.465  26.786  -7.191
 1060   1HG   GLN  48          2HG       GLN  48   6.526  25.558  -5.122
 1061   2HG   GLN  48          3HG       GLN  48   4.934  24.805  -5.044
 1062   1HE2  GLN  48          1HE2      GLN  48   7.455  25.593  -7.413
 1063   2HE2  GLN  48          2HE2      GLN  48   7.326  24.115  -8.298
 1064    H    LEU  49           H        LEU  49   5.347  30.290  -5.011
 1065    HA   LEU  49           HA       LEU  49   7.800  30.536  -6.621
 1066   1HB   LEU  49          2HB       LEU  49   5.246  31.604  -7.186
 1067   2HB   LEU  49          3HB       LEU  49   6.277  32.951  -6.708
 1068    HG   LEU  49           HG       LEU  49   7.380  31.076  -8.718
 1069   1HD1  LEU  49          1HD1      LEU  49   6.042  32.847 -10.308
 1070   2HD1  LEU  49          2HD1      LEU  49   4.842  32.479  -9.070
 1071   3HD1  LEU  49          3HD1      LEU  49   5.562  31.176 -10.014
 1072   1HD2  LEU  49          1HD2      LEU  49   7.516  33.973  -8.032
 1073   2HD2  LEU  49          2HD2      LEU  49   7.900  33.463  -9.676
 1074   3HD2  LEU  49          3HD2      LEU  49   8.818  32.817  -8.315
 1075    H    CYS  50           H        CYS  50   5.812  31.792  -3.906
 1076    HA   CYS  50           HA       CYS  50   8.279  33.008  -2.910
 1077   1HB   CYS  50          2HB       CYS  50   7.200  34.974  -2.209
 1078   2HB   CYS  50          3HB       CYS  50   6.615  34.711  -3.840
 1079    H    ASN  51           H        ASN  51   6.512  30.492  -2.632
 1080    HA   ASN  51           HA       ASN  51   5.888  29.028  -1.007
 1081   1HB   ASN  51          2HB       ASN  51   7.906  30.755   0.338
 1082   2HB   ASN  51          3HB       ASN  51   6.933  29.701   1.360
 1083   1HD2  ASN  51          1HD2      ASN  51   9.824  29.830   0.200
 1084   2HD2  ASN  51          2HD2      ASN  51  10.120  28.185  -0.239
 1085    H    GLY  52           H        GLY  52   4.410  31.645  -1.469
 1086   1HA   GLY  52          1HA       GLY  52   3.272  32.484   0.979
 1087   2HA   GLY  52          2HA       GLY  52   2.582  32.742  -0.616
 1088    H    MET  53           H        MET  53   1.095  32.170   1.732
 1089    HA   MET  53           HA       MET  53  -0.021  29.544   1.000
 1090   1HB   MET  53          2HB       MET  53   0.212  30.776   3.748
 1091   2HB   MET  53          3HB       MET  53  -0.739  29.340   3.392
 1092   1HG   MET  53          2HG       MET  53   1.454  28.379   2.457
 1093   2HG   MET  53          3HG       MET  53   2.230  29.689   3.344
 1094   1HE   MET  53          1HE       MET  53   1.220  25.708   4.502
 1095   2HE   MET  53          2HE       MET  53  -0.399  26.405   4.569
 1096   3HE   MET  53          3HE       MET  53   0.572  26.568   3.105
 1097    H    GLY  54           H        GLY  54  -1.676  30.237  -0.286
 1098   1HA   GLY  54          1HA       GLY  54  -4.140  30.756   0.492
 1099   2HA   GLY  54          2HA       GLY  54  -3.440  32.355   0.693
 1100    H    HIS  55           H        HIS  55  -1.970  32.860  -1.406
 1101    HA   HIS  55           HA       HIS  55  -3.891  32.899  -3.581
 1102   1HB   HIS  55          2HB       HIS  55  -2.307  34.473  -4.642
 1103   2HB   HIS  55          3HB       HIS  55  -2.759  34.979  -3.017
 1104    HD1  HIS  55           HD1      HIS  55  -0.913  34.420  -1.116
 1105    HD2  HIS  55           HD2      HIS  55   0.376  34.283  -5.063
 1106    HE1  HIS  55           HE1      HIS  55   1.597  34.539  -1.008
 1107    H    ASN  56           H        ASN  56  -2.462  32.948  -5.840
 1108    HA   ASN  56           HA       ASN  56  -1.140  30.315  -5.915
 1109   1HB   ASN  56          2HB       ASN  56  -3.485  30.846  -7.115
 1110   2HB   ASN  56          3HB       ASN  56  -2.392  31.384  -8.387
 1111   1HD2  ASN  56          1HD2      ASN  56  -1.660  29.911  -9.743
 1112   2HD2  ASN  56          2HD2      ASN  56  -1.699  28.201  -9.498
 1113    H    ALA  57           H        ALA  57   0.579  30.041  -7.413
 1114    HA   ALA  57           HA       ALA  57   2.425  32.120  -7.514
 1115   1HB   ALA  57          1HB       ALA  57   3.185  29.873  -7.701
 1116   2HB   ALA  57          2HB       ALA  57   2.227  29.605  -9.158
 1117   3HB   ALA  57          3HB       ALA  57   3.611  30.697  -9.202
 1118    H    LYS  58           H        LYS  58   0.079  31.044  -9.927
 1119    HA   LYS  58           HA       LYS  58   0.954  32.655 -12.055
 1120   1HB   LYS  58          2HB       LYS  58  -1.470  31.119 -11.387
 1121   2HB   LYS  58          3HB       LYS  58  -1.730  32.460 -12.494
 1122   1HG   LYS  58          2HG       LYS  58   0.485  30.521 -12.994
 1123   2HG   LYS  58          3HG       LYS  58  -1.176  30.108 -13.426
 1124   1HD   LYS  58          2HD       LYS  58  -0.668  31.127 -15.369
 1125   2HD   LYS  58          3HD       LYS  58  -0.984  32.607 -14.460
 1126   1HE   LYS  58          2HE       LYS  58   1.082  33.216 -15.063
 1127   2HE   LYS  58          3HE       LYS  58   1.633  32.071 -13.841
 1128   1HZ   LYS  58          1HZ       LYS  58   1.161  30.552 -16.072
 1129   2HZ   LYS  58          2HZ       LYS  58   2.673  31.030 -15.483
 1130   3HZ   LYS  58          3HZ       LYS  58   1.900  31.950 -16.674
 1131    H    GLN  59           H        GLN  59  -0.750  33.421  -9.169
 1132    HA   GLN  59           HA       GLN  59  -1.308  36.121 -10.209
 1133   1HB   GLN  59          2HB       GLN  59  -3.195  34.456  -9.305
 1134   2HB   GLN  59          3HB       GLN  59  -2.699  35.150  -7.767
 1135   1HG   GLN  59          2HG       GLN  59  -4.429  36.527  -8.403
 1136   2HG   GLN  59          3HG       GLN  59  -3.011  37.419  -8.953
 1137   1HE2  GLN  59          1HE2      GLN  59  -5.532  35.194 -10.011
 1138   2HE2  GLN  59          2HE2      GLN  59  -5.578  35.738 -11.650
 1139    H    CYS  60           H        CYS  60   1.166  34.822  -8.791
 1140    HA   CYS  60           HA       CYS  60   1.173  36.287  -6.315
 1141   1HB   CYS  60          2HB       CYS  60   2.218  34.074  -6.404
 1142   2HB   CYS  60          3HB       CYS  60   3.323  34.612  -7.654
 1143    H    ARG  61           H        ARG  61   1.912  38.304  -6.147
 1144    HA   ARG  61           HA       ARG  61   4.063  39.422  -7.563
 1145   1HB   ARG  61          2HB       ARG  61   2.828  41.069  -8.952
 1146   2HB   ARG  61          3HB       ARG  61   2.612  39.410  -9.493
 1147   1HG   ARG  61          2HG       ARG  61   0.461  40.113  -9.613
 1148   2HG   ARG  61          3HG       ARG  61   0.479  39.569  -7.935
 1149   1HD   ARG  61          2HD       ARG  61  -0.205  41.608  -7.366
 1150   2HD   ARG  61          3HD       ARG  61   1.393  42.191  -7.831
 1151    HE   ARG  61           HE       ARG  61   0.436  43.196  -9.640
 1152   1HH1  ARG  61          2HH1      ARG  61  -1.706  40.704  -8.491
 1153   2HH1  ARG  61          1HH1      ARG  61  -2.980  41.110  -9.593
 1154   1HH2  ARG  61          2HH2      ARG  61  -1.234  43.740 -11.095
 1155   2HH2  ARG  61          1HH2      ARG  61  -2.710  42.837 -11.074
 1156    H    LYS  62           H        LYS  62   4.198  41.836  -7.216
 1157    HA   LYS  62           HA       LYS  62   2.852  42.555  -4.693
 1158   1HB   LYS  62          2HB       LYS  62   5.511  42.157  -4.963
 1159   2HB   LYS  62          3HB       LYS  62   5.421  43.866  -5.364
 1160   1HG   LYS  62          2HG       LYS  62   3.948  43.043  -2.952
 1161   2HG   LYS  62          3HG       LYS  62   5.707  42.921  -2.865
 1162   1HD   LYS  62          2HD       LYS  62   5.960  45.239  -3.410
 1163   2HD   LYS  62          3HD       LYS  62   4.237  45.397  -3.761
 1164   1HE   LYS  62          2HE       LYS  62   5.158  44.512  -1.055
 1165   2HE   LYS  62          3HE       LYS  62   5.161  46.223  -1.479
 1166   1HZ   LYS  62          1HZ       LYS  62   3.094  45.903  -0.525
 1167   2HZ   LYS  62          2HZ       LYS  62   2.867  44.386  -1.237
 1168   3HZ   LYS  62          3HZ       LYS  62   2.748  45.787  -2.177
 1169    H    ARG  63           H        ARG  63   2.260  44.734  -4.387
 1170    HA   ARG  63           HA       ARG  63   2.079  46.285  -6.887
 1171   1HB   ARG  63          2HB       ARG  63   0.129  45.772  -4.699
 1172   2HB   ARG  63          3HB       ARG  63   0.105  47.363  -5.448
 1173   1HG   ARG  63          2HG       ARG  63   0.169  45.713  -7.622
 1174   2HG   ARG  63          3HG       ARG  63  -0.804  44.789  -6.475
 1175   1HD   ARG  63          2HD       ARG  63  -1.756  47.383  -6.246
 1176   2HD   ARG  63          3HD       ARG  63  -1.469  47.180  -7.974
 1177    HE   ARG  63           HE       ARG  63  -2.859  44.951  -6.897
 1178   1HH1  ARG  63          2HH1      ARG  63  -3.281  48.258  -7.899
 1179   2HH1  ARG  63          1HH1      ARG  63  -4.959  48.064  -8.284
 1180   1HH2  ARG  63          2HH2      ARG  63  -5.068  44.683  -7.400
 1181   2HH2  ARG  63          1HH2      ARG  63  -5.975  46.031  -7.999
 1182    H    ASP  64           H        ASP  64   1.560  47.092  -3.463
 1183    HA   ASP  64           HA       ASP  64   3.402  49.362  -3.816
 1184   1HB   ASP  64          2HB       ASP  64   0.992  49.852  -3.249
 1185   2HB   ASP  64          3HB       ASP  64   1.269  49.067  -1.696
  Start of MODEL    2
    1   1H5*    C 160          1H5*        C 160  20.605  27.584 -21.676
    2   2H5*    C 160          2H5*        C 160  19.924  26.806 -20.247
    3    H4*    C 160           H4*        C 160  22.328  26.582 -20.255
    4    H3*    C 160           H3*        C 160  21.161  28.334 -18.105
    5    H2*    C 160           H2*        C 160  23.317  28.554 -17.133
    6   2HO*    C 160          2HO*        C 160  24.747  26.941 -17.573
    7    H1*    C 160           H1*        C 160  24.548  29.122 -19.598
    8   1H4     C 160          1H4         C 160  23.372  34.776 -16.821
    9   2H4     C 160          2H4         C 160  21.845  34.824 -17.675
   10    H5     C 160           H5         C 160  20.998  33.031 -18.958
   11    H6     C 160           H6         C 160  21.412  30.727 -19.746
   12   1H5*    U 161          1H5*        U 161  23.176  25.014 -15.676
   13   2H5*    U 161          2H5*        U 161  22.150  24.916 -14.245
   14    H4*    U 161           H4*        U 161  24.538  25.442 -13.777
   15    H3*    U 161           H3*        U 161  22.349  27.296 -12.867
   16    H2*    U 161           H2*        U 161  23.957  28.602 -11.706
   17   2HO*    U 161          2HO*        U 161  25.550  27.340 -10.951
   18    H1*    U 161           H1*        U 161  25.723  28.668 -13.894
   19    H3     U 161           H3         U 161  24.013  32.888 -13.215
   20    H5     U 161           H5         U 161  21.262  30.938 -15.698
   21    H6     U 161           H6         U 161  22.501  28.864 -15.276
   22   1H5*    G 162          1H5*        G 162  24.600  26.229  -9.332
   23   2H5*    G 162          2H5*        G 162  23.464  25.665  -8.108
   24    H4*    G 162           H4*        G 162  24.846  27.262  -7.058
   25    H3*    G 162           H3*        G 162  22.091  28.285  -7.662
   26    H2*    G 162           H2*        G 162  22.607  30.354  -6.598
   27   2HO*    G 162          2HO*        G 162  25.093  30.216  -5.871
   28    H1*    G 162           H1*        G 162  24.982  30.693  -8.022
   29    H8     G 162           H8         G 162  22.537  29.151 -10.336
   30    H1     G 162           H1         G 162  21.631  35.516  -9.594
   31   1H2     G 162          1H2         G 162  22.772  36.195  -8.016
   32   2H2     G 162          2H2         G 162  23.818  35.189  -7.038
   33   1H5*    C 163          1H5*        C 163  22.833  28.926  -3.527
   34   2H5*    C 163          2H5*        C 163  21.431  28.588  -2.513
   35    H4*    C 163           H4*        C 163  22.197  30.834  -2.117
   36    H3*    C 163           H3*        C 163  19.535  30.558  -3.481
   37    H2*    C 163           H2*        C 163  19.248  32.913  -3.433
   38   2HO*    C 163          2HO*        C 163  20.348  33.984  -1.861
   39    H1*    C 163           H1*        C 163  21.865  33.401  -4.380
   40   1H4     C 163          1H4         C 163  18.141  33.868  -9.549
   41   2H4     C 163          2H4         C 163  18.168  32.125  -9.707
   42    H5     C 163           H5         C 163  19.170  30.677  -8.133
   43    H6     C 163           H6         C 163  20.404  30.542  -5.999
   44   1H5*    C 164          1H5*        C 164  18.159  32.882   0.501
   45   2H5*    C 164          2H5*        C 164  16.700  31.912   0.703
   46    H4*    C 164           H4*        C 164  16.260  34.338   0.645
   47    H3*    C 164           H3*        C 164  15.015  32.560  -1.439
   48    H2*    C 164           H2*        C 164  13.776  34.414  -2.260
   49   2HO*    C 164          2HO*        C 164  14.079  36.444  -0.943
   50    H1*    C 164           H1*        C 164  16.016  36.100  -2.328
   51   1H4     C 164          1H4         C 164  15.434  33.668  -8.226
   52   2H4     C 164          2H4         C 164  16.523  32.382  -7.753
   53    H5     C 164           H5         C 164  17.309  32.066  -5.549
   54    H6     C 164           H6         C 164  17.242  32.915  -3.231
   55   1H5*    C 165          1H5*        C 165  12.204  34.809   0.375
   56   2H5*    C 165          2H5*        C 165  10.756  34.006   0.982
   57    H4*    C 165           H4*        C 165   9.956  35.778  -0.310
   58    H3*    C 165           H3*        C 165   9.793  33.171  -1.782
   59    H2*    C 165           H2*        C 165   8.801  34.248  -3.651
   60   2HO*    C 165          2HO*        C 165   8.976  36.761  -2.348
   61    H1*    C 165           H1*        C 165  10.713  36.316  -3.671
   62   1H4     C 165          1H4         C 165  12.817  32.160  -8.037
   63   2H4     C 165          2H4         C 165  13.497  31.177  -6.760
   64    H5     C 165           H5         C 165  13.204  31.623  -4.459
   65    H6     C 165           H6         C 165  12.174  33.135  -2.800
   66   1H5*    U 166          1H5*        U 166   5.798  34.890  -1.636
   67   2H5*    U 166          2H5*        U 166   4.522  33.701  -1.903
   68    H4*    U 166           H4*        U 166   4.761  35.460  -3.678
   69    H3*    U 166           H3*        U 166   4.836  32.524  -4.331
   70    H2*    U 166           H2*        U 166   4.895  33.054  -6.648
   71   2HO*    U 166          2HO*        U 166   3.549  34.804  -6.740
   72    H1*    U 166           H1*        U 166   6.941  34.943  -6.343
   73    H3     U 166           H3         U 166   8.476  31.155  -8.523
   74    H5     U 166           H5         U 166   9.173  30.533  -4.440
   75    H6     U 166           H6         U 166   7.807  32.522  -4.005
   76   1H5*    C 167          1H5*        C 167   0.398  33.278  -5.412
   77   2H5*    C 167          2H5*        C 167  -0.398  31.792  -4.897
   78    H4*    C 167           H4*        C 167  -0.392  32.144  -7.353
   79    H3*    C 167           H3*        C 167   0.846  29.676  -6.165
   80    H2*    C 167           H2*        C 167   1.229  28.820  -8.346
   81   2HO*    C 167          2HO*        C 167  -0.201  29.510  -9.838
   82    H1*    C 167           H1*        C 167   2.308  31.244  -9.287
   83   1H4     C 167          1H4         C 167   7.307  27.587  -7.659
   84   2H4     C 167          2H4         C 167   7.238  28.280  -6.054
   85    H5     C 167           H5         C 167   5.527  29.731  -5.319
   86    H6     C 167           H6         C 167   3.438  30.888  -5.951
   87   1H5*    A 168          1H5*        A 168  -4.334  27.599  -7.057
   88   2H5*    A 168          2H5*        A 168  -4.044  29.339  -7.060
   89    H4*    A 168           H4*        A 168  -4.419  28.571  -4.356
   90    H3*    A 168           H3*        A 168  -6.369  27.220  -6.220
   91    H2*    A 168           H2*        A 168  -8.081  27.574  -4.612
   92   2HO*    A 168          2HO*        A 168  -6.821  27.127  -2.792
   93    H1*    A 168           H1*        A 168  -7.266  30.265  -4.184
   94    H8     A 168           H8         A 168  -7.943  28.242  -7.384
   95   1H6     A 168          1H6         A 168 -12.813  32.070  -8.150
   96   2H6     A 168          2H6         A 168 -11.956  30.710  -8.841
   97    H2     A 168           H2         A 168 -10.701  33.235  -4.418
   98   1H5*    U 169          1H5*        U 169  -8.883  23.682  -5.247
   99   2H5*    U 169          2H5*        U 169  -7.642  23.271  -6.431
  100    H4*    U 169           H4*        U 169  -9.561  25.532  -6.936
  101    H3*    U 169           H3*        U 169 -10.169  22.603  -7.126
  102    H2*    U 169           H2*        U 169 -11.349  22.945  -9.163
  103   2HO*    U 169          2HO*        U 169 -12.121  24.976  -9.501
  104    H1*    U 169           H1*        U 169  -9.308  24.401 -10.348
  105    H3     U 169           H3         U 169  -9.368  20.209 -12.227
  106    H5     U 169           H5         U 169  -6.922  19.881  -8.844
  107    H6     U 169           H6         U 169  -7.657  22.134  -8.216
  108   1H5*    C 170          1H5*        C 170 -13.257  23.090  -2.933
  109   2H5*    C 170          2H5*        C 170 -13.208  24.435  -4.073
  110    H4*    C 170           H4*        C 170 -10.555  23.421  -3.791
  111    H3*    C 170           H3*        C 170 -12.017  23.723  -1.169
  112    H2*    C 170           H2*        C 170 -10.030  24.586  -0.208
  113   2HO*    C 170          2HO*        C 170  -8.763  23.016  -1.393
  114    H1*    C 170           H1*        C 170  -9.521  26.257  -2.452
  115   1H4     C 170          1H4         C 170 -12.465  30.587   1.158
  116   2H4     C 170          2H4         C 170 -13.343  29.331   2.000
  117    H5     C 170           H5         C 170 -13.188  27.034   1.470
  118    H6     C 170           H6         C 170 -12.140  25.363  -0.014
  119   1H5*    C 171          1H5*        C 171  -9.730  19.690  -1.989
  120   2H5*    C 171          2H5*        C 171 -10.156  18.282  -1.017
  121    H4*    C 171           H4*        C 171  -7.884  18.777  -0.571
  122    H3*    C 171           H3*        C 171  -9.714  19.600   1.679
  123    H2*    C 171           H2*        C 171  -7.800  20.101   2.996
  124   2HO*    C 171          2HO*        C 171  -5.880  19.526   1.121
  125    H1*    C 171           H1*        C 171  -6.558  21.495   0.861
  126   1H4     C 171          1H4         C 171  -9.062  26.049   4.578
  127   2H4     C 171          2H4         C 171 -10.613  25.800   3.808
  128    H5     C 171           H5         C 171 -11.043  24.089   2.237
  129    H6     C 171           H6         C 171 -10.080  22.178   1.005
  130   1H5*    G 172          1H5*        G 172  -7.060  16.342   3.810
  131   2H5*    G 172          2H5*        G 172  -8.391  15.473   4.574
  132    H4*    G 172           H4*        G 172  -6.812  15.984   6.268
  133    H3*    G 172           H3*        G 172  -9.302  17.662   6.384
  134    H2*    G 172           H2*        G 172  -8.529  18.665   8.403
  135   2HO*    G 172          2HO*        G 172  -6.181  17.675   8.875
  136    H1*    G 172           H1*        G 172  -6.016  19.259   7.346
  137    H8     G 172           H8         G 172  -8.800  19.625   4.834
  138    H1     G 172           H1         G 172  -7.764  24.905   8.429
  139   1H2     G 172          1H2         G 172  -6.431  24.461   9.939
  140   2H2     G 172          2H2         G 172  -5.703  22.890  10.192
  141   1H5*    U 173          1H5*        U 173  -8.463  16.137  10.023
  142   2H5*    U 173          2H5*        U 173  -9.770  15.299  10.858
  143    H4*    U 173           H4*        U 173  -8.901  16.832  12.411
  144    H3*    U 173           H3*        U 173 -11.490  17.779  11.215
  145    H2*    U 173           H2*        U 173 -11.462  19.673  12.647
  146   2HO*    U 173          2HO*        U 173 -10.123  19.582  14.453
  147    H1*    U 173           H1*        U 173  -8.776  20.274  12.075
  148    H3     U 173           H3         U 173 -11.218  23.625  10.171
  149    H5     U 173           H5         U 173 -11.488  20.445   7.459
  150    H6     U 173           H6         U 173 -10.394  19.042   9.146
  151   1H5*    C 174          1H5*        C 174 -11.985  18.082  15.227
  152   2H5*    C 174          2H5*        C 174 -13.385  17.211  15.853
  153    H4*    C 174           H4*        C 174 -13.610  19.363  16.715
  154    H3*    C 174           H3*        C 174 -15.384  18.952  14.333
  155    H2*    C 174           H2*        C 174 -16.245  21.155  14.549
  156   2HO*    C 174          2HO*        C 174 -16.328  21.678  16.654
  157    H1*    C 174           H1*        C 174 -13.643  22.255  14.883
  158   1H4     C 174          1H4         C 174 -15.065  23.489   8.790
  159   2H4     C 174          2H4         C 174 -14.776  21.812   8.382
  160    H5     C 174           H5         C 174 -14.282  20.137   9.971
  161    H6     C 174           H6         C 174 -13.940  19.652  12.368
  162   1H5*    U 175          1H5*        U 175 -17.824  15.876  18.299
  163   2H5*    U 175          2H5*        U 175 -18.019  15.161  16.698
  164    H4*    U 175           H4*        U 175 -20.180  16.566  16.554
  165    H3*    U 175           H3*        U 175 -19.481  16.973  19.431
  166    H2*    U 175           H2*        U 175 -21.738  16.645  20.100
  167   2HO*    U 175          2HO*        U 175 -22.914  17.547  18.485
  168    H1*    U 175           H1*        U 175 -22.022  14.296  18.591
  169    H3     U 175           H3         U 175 -22.039  12.818  22.884
  170    H5     U 175           H5         U 175 -18.009  13.651  22.109
  171    H6     U 175           H6         U 175 -18.724  14.628  19.977
  172   1H5*    C 176          1H5*        C 176 -18.464  21.336  17.154
  173   2H5*    C 176          2H5*        C 176 -18.364  21.639  18.888
  174    H4*    C 176           H4*        C 176 -19.683  23.542  18.774
  175    H3*    C 176           H3*        C 176 -20.910  22.345  16.324
  176    H2*    C 176           H2*        C 176 -21.380  24.500  15.434
  177   2HO*    C 176          2HO*        C 176 -21.609  26.066  16.934
  178    H1*    C 176           H1*        C 176 -18.787  25.443  15.850
  179   1H4     C 176          1H4         C 176 -18.735  23.209   9.865
  180   2H4     C 176          2H4         C 176 -18.422  21.604  10.484
  181    H5     C 176           H5         C 176 -18.396  21.061  12.782
  182    H6     C 176           H6         C 176 -18.667  21.935  15.076
  183   1H5*    G 177          1H5*        G 177 -24.033  25.293  17.804
  184   2H5*    G 177          2H5*        G 177 -25.522  24.357  17.686
  185    H4*    G 177           H4*        G 177 -25.728  26.492  16.542
  186    H3*    G 177           H3*        G 177 -25.878  23.993  14.886
  187    H2*    G 177           H2*        G 177 -26.363  25.294  12.951
  188   2HO*    G 177          2HO*        G 177 -26.484  27.707  13.455
  189    H1*    G 177           H1*        G 177 -24.219  27.032  13.370
  190    H8     G 177           H8         G 177 -23.034  23.693  14.395
  191    H1     G 177           H1         G 177 -23.130  24.434   7.967
  192   1H2     G 177          1H2         G 177 -24.172  26.147   7.486
  193   2H2     G 177          2H2         G 177 -24.910  27.222   8.652
  194   1H5*    C 178          1H5*        C 178 -29.422  26.170  13.950
  195   2H5*    C 178          2H5*        C 178 -30.809  25.084  13.863
  196    H4*    C 178           H4*        C 178 -30.574  26.310  11.796
  197    H3*    C 178           H3*        C 178 -30.073  23.349  11.668
  198    H2*    C 178           H2*        C 178 -29.825  23.490   9.311
  199   2HO*    C 178          2HO*        C 178 -30.116  26.138   8.901
  200    H1*    C 178           H1*        C 178 -28.117  25.729   9.469
  201   1H4     C 178          1H4         C 178 -24.182  20.736   8.859
  202   2H4     C 178          2H4         C 178 -24.334  20.423  10.574
  203    H5     C 178           H5         C 178 -25.797  21.605  12.003
  204    H6     C 178           H6         C 178 -27.491  23.395  12.140
  205   1H5*    U 179          1H5*        U 179 -33.312  24.096   8.835
  206   2H5*    U 179          2H5*        U 179 -34.504  22.805   8.987
  207    H4*    U 179           H4*        U 179 -33.763  22.978   6.700
  208    H3*    U 179           H3*        U 179 -32.949  20.488   8.176
  209    H2*    U 179           H2*        U 179 -32.011  19.613   6.178
  210   2HO*    U 179          2HO*        U 179 -32.508  21.785   4.560
  211    H1*    U 179           H1*        U 179 -30.642  21.989   5.575
  212    H3     U 179           H3         U 179 -27.522  18.820   6.707
  213    H5     U 179           H5         U 179 -28.807  20.453  10.343
  214    H6     U 179           H6         U 179 -30.562  21.617   9.087
  215   1H5*    U 180          1H5*        U 180 -34.738  19.350   4.820
  216   2H5*    U 180          2H5*        U 180 -35.908  18.031   4.863
  217    H4*    U 180           H4*        U 180 -34.193  17.419   3.340
  218    H3*    U 180           H3*        U 180 -34.154  15.917   5.934
  219    H2*    U 180           H2*        U 180 -32.301  14.626   5.211
  220   2HO*    U 180          2HO*        U 180 -31.645  15.159   2.881
  221    H1*    U 180           H1*        U 180 -30.919  16.909   4.248
  222    H3     U 180           H3         U 180 -28.243  15.627   7.655
  223    H5     U 180           H5         U 180 -31.662  17.082   9.587
  224    H6     U 180           H6         U 180 -32.700  17.296   7.376
  225   1H5*    A 181          1H5*        A 181 -36.736  12.636   3.447
  226   2H5*    A 181          2H5*        A 181 -37.435  11.838   4.857
  227    H4*    A 181           H4*        A 181 -35.752  10.507   3.525
  228    H3*    A 181           H3*        A 181 -35.518  10.903   6.499
  229    H2*    A 181           H2*        A 181 -33.664   9.420   6.537
  230   2HO*    A 181          2HO*        A 181 -33.692   7.913   4.965
  231    H1*    A 181           H1*        A 181 -32.401  10.661   4.362
  232    H8     A 181           H8         A 181 -34.055  13.145   6.634
  233   1H6     A 181          1H6         A 181 -28.723  13.211   9.878
  234   2H6     A 181          2H6         A 181 -30.281  13.986   9.695
  235    H2     A 181           H2         A 181 -28.483   9.943   6.876
  236   1H5*    U 182          1H5*        U 182 -35.520   5.816   7.986
  237   2H5*    U 182          2H5*        U 182 -36.969   6.046   7.006
  238    H4*    U 182           H4*        U 182 -37.684   7.388   9.254
  239    H3*    U 182           H3*        U 182 -35.717   5.278  10.138
  240    H2*    U 182           H2*        U 182 -37.071   4.802  11.981
  241   2HO*    U 182          2HO*        U 182 -37.469   6.840  12.730
  242    H1*    U 182           H1*        U 182 -39.475   5.391  10.399
  243    H3     U 182           H3         U 182 -40.645   1.427  12.245
  244    H5     U 182           H5         U 182 -37.468   0.440   9.701
  245    H6     U 182           H6         U 182 -37.154   2.843   9.325
  246   1H5*    U 183          1H5*        U 183 -35.912   8.422  13.354
  247   2H5*    U 183          2H5*        U 183 -35.835   9.679  12.120
  248    H4*    U 183           H4*        U 183 -33.934  10.704  13.444
  249    H3*    U 183           H3*        U 183 -34.769   8.600  15.447
  250    H2*    U 183           H2*        U 183 -34.271  10.096  17.168
  251   2HO*    U 183          2HO*        U 183 -33.068  12.124  15.882
  252    H1*    U 183           H1*        U 183 -35.082  12.356  15.474
  253    H3     U 183           H3         U 183 -37.387  13.412  19.207
  254    H5     U 183           H5         U 183 -39.056   9.752  18.038
  255    H6     U 183           H6         U 183 -37.326   9.629  16.305
  256   1H5*    C 184          1H5*        C 184 -31.716   6.107  17.820
  257   2H5*    C 184          2H5*        C 184 -33.224   6.882  18.304
  258    H4*    C 184           H4*        C 184 -31.859   8.580  19.556
  259    H3*    C 184           H3*        C 184 -29.613   7.136  18.378
  260    H2*    C 184           H2*        C 184 -29.195   5.949  20.305
  261   2HO*    C 184          2HO*        C 184 -27.809   7.290  21.436
  262    H1*    C 184           H1*        C 184 -30.891   8.039  21.778
  263   1H4     C 184          1H4         C 184 -29.947   3.704  26.425
  264   2H4     C 184          2H4         C 184 -31.232   2.761  25.704
  265    H5     C 184           H5         C 184 -32.254   3.290  23.642
  266    H6     C 184           H6         C 184 -32.294   4.869  21.743
  267   1H5*    G 185          1H5*        G 185 -28.279  12.785  18.932
  268   2H5*    G 185          2H5*        G 185 -29.821  12.269  18.247
  269    H4*    G 185           H4*        G 185 -28.116  12.097  16.086
  270    H3*    G 185           H3*        G 185 -27.125  14.290  17.877
  271    H2*    G 185           H2*        G 185 -26.789  15.703  15.987
  272   2HO*    G 185          2HO*        G 185 -27.003  14.715  13.897
  273    H1*    G 185           H1*        G 185 -29.351  15.250  14.978
  274    H8     G 185           H8         G 185 -29.338  17.829  15.368
  275    H1     G 185           H1         G 185 -29.747  16.928  21.763
  276   1H2     G 185          1H2         G 185 -29.426  14.938  22.200
  277   2H2     G 185          2H2         G 185 -29.095  13.698  21.011
  278   1H5*    G 186          1H5*        G 186 -22.522  11.610  15.290
  279   2H5*    G 186          2H5*        G 186 -23.561  11.199  16.654
  280    H4*    G 186           H4*        G 186 -21.256  13.064  17.086
  281    H3*    G 186           H3*        G 186 -21.003  10.124  16.543
  282    H2*    G 186           H2*        G 186 -19.341   9.941  18.242
  283   2HO*    G 186          2HO*        G 186 -18.267  11.790  18.709
  284    H1*    G 186           H1*        G 186 -20.888  11.270  20.143
  285    H8     G 186           H8         G 186 -19.734   8.360  19.576
  286    H1     G 186           H1         G 186 -26.100   7.266  19.967
  287   1H2     G 186          1H2         G 186 -27.122   9.036  19.690
  288   2H2     G 186          2H2         G 186 -26.365  10.586  19.396
  289   1H5*    G 187          1H5*        G 187 -18.730  12.660  12.493
  290   2H5*    G 187          2H5*        G 187 -19.964  12.295  13.699
  291    H4*    G 187           H4*        G 187 -18.898   9.967  12.214
  292    H3*    G 187           H3*        G 187 -20.282  12.216  10.791
  293    H2*    G 187           H2*        G 187 -21.539  10.652   9.506
  294   2HO*    G 187          2HO*        G 187 -20.753   8.323  10.608
  295    H1*    G 187           H1*        G 187 -22.350   9.202  11.746
  296    H8     G 187           H8         G 187 -22.342  12.711  12.840
  297    H1     G 187           H1         G 187 -27.458  11.299   9.138
  298   1H2     G 187          1H2         G 187 -27.172   9.466   8.237
  299   2H2     G 187          2H2         G 187 -25.756   8.461   8.454
  300   1H5*    G 188          1H5*        G 188 -19.828   9.373   7.805
  301   2H5*    G 188          2H5*        G 188 -18.625  10.060   6.714
  302    H4*    G 188           H4*        G 188 -20.274   9.316   5.274
  303    H3*    G 188           H3*        G 188 -20.650  12.253   5.793
  304    H2*    G 188           H2*        G 188 -22.453  12.288   4.236
  305   2HO*    G 188          2HO*        G 188 -22.499  10.657   2.752
  306    H1*    G 188           H1*        G 188 -23.710  10.076   5.392
  307    H8     G 188           H8         G 188 -22.334  11.976   8.219
  308    H1     G 188           H1         G 188 -27.677  14.705   5.792
  309   1H2     G 188          1H2         G 188 -28.135  13.832   3.980
  310   2H2     G 188          2H2         G 188 -27.208  12.550   3.231
  311   1H5*    A 189          1H5*        A 189 -20.488  12.490   1.216
  312   2H5*    A 189          2H5*        A 189 -19.474  13.929   1.105
  313    H4*    A 189           H4*        A 189 -21.697  14.130  -0.004
  314    H3*    A 189           H3*        A 189 -20.872  16.062   2.152
  315    H2*    A 189           H2*        A 189 -22.835  17.338   1.732
  316   2HO*    A 189          2HO*        A 189 -23.207  17.226  -0.412
  317    H1*    A 189           H1*        A 189 -24.505  15.083   1.775
  318    H8     A 189           H8         A 189 -21.818  14.876   4.379
  319   1H6     A 189          1H6         A 189 -25.699  17.984   8.151
  320   2H6     A 189          2H6         A 189 -24.184  17.110   8.083
  321    H2     A 189           H2         A 189 -27.439  17.982   4.062
  322   1H5*    G 190          1H5*        G 190 -21.927  18.495  -1.540
  323   2H5*    G 190          2H5*        G 190 -20.690  19.751  -1.565
  324    H4*    G 190           H4*        G 190 -22.914  20.712  -1.723
  325    H3*    G 190           H3*        G 190 -21.304  21.335   0.735
  326    H2*    G 190           H2*        G 190 -23.005  22.833   1.466
  327   2HO*    G 190          2HO*        G 190 -24.805  23.141  -0.090
  328    H1*    G 190           H1*        G 190 -25.048  20.970   1.087
  329    H8     G 190           H8         G 190 -22.098  19.109   2.325
  330    H1     G 190           H1         G 190 -25.276  22.209   7.035
  331   1H2     G 190          1H2         G 190 -26.643  23.510   6.202
  332   2H2     G 190          2H2         G 190 -26.892  23.727   4.484
  333   1H5*    C 191          1H5*        C 191 -22.750  24.750  -0.800
  334   2H5*    C 191          2H5*        C 191 -21.597  26.056  -1.076
  335    H4*    C 191           H4*        C 191 -23.321  27.035   0.156
  336    H3*    C 191           H3*        C 191 -20.976  26.378   1.922
  337    H2*    C 191           H2*        C 191 -22.075  27.422   3.753
  338   2HO*    C 191          2HO*        C 191 -24.385  28.013   2.286
  339    H1*    C 191           H1*        C 191 -24.489  26.079   3.299
  340   1H4     C 191          1H4         C 191 -21.488  22.474   7.629
  341   2H4     C 191          2H4         C 191 -20.541  21.743   6.352
  342    H5     C 191           H5         C 191 -20.627  22.427   4.093
  343    H6     C 191           H6         C 191 -21.651  23.999   2.488
  344   1H5*    G 192          1H5*        G 192 -22.113  30.256   2.732
  345   2H5*    G 192          2H5*        G 192 -20.784  31.383   2.463
  346    H4*    G 192           H4*        G 192 -21.620  31.989   4.545
  347    H3*    G 192           H3*        G 192 -19.183  30.261   4.856
  348    H2*    G 192           H2*        G 192 -19.289  30.533   7.220
  349   2HO*    G 192          2HO*        G 192 -21.629  31.975   7.316
  350    H1*    G 192           H1*        G 192 -21.992  29.851   7.350
  351    H8     G 192           H8         G 192 -20.365  27.761   4.737
  352    H1     G 192           H1         G 192 -19.412  25.544  10.742
  353   1H2     G 192          1H2         G 192 -20.035  26.960  12.106
  354   2H2     G 192          2H2         G 192 -20.714  28.516  11.685
  355   1H5*    G 193          1H5*        G 193 -18.949  33.560   7.514
  356   2H5*    G 193          2H5*        G 193 -17.310  34.210   7.536
  357    H4*    G 193           H4*        G 193 -18.057  33.663   9.778
  358    H3*    G 193           H3*        G 193 -15.772  32.069   8.653
  359    H2*    G 193           H2*        G 193 -15.516  30.962  10.748
  360   2HO*    G 193          2HO*        G 193 -17.712  32.181  11.947
  361    H1*    G 193           H1*        G 193 -18.226  30.321  10.934
  362    H8     G 193           H8         G 193 -17.367  29.995   7.366
  363    H1     G 193           H1         G 193 -15.295  24.974  10.884
  364   1H2     G 193          1H2         G 193 -15.451  25.428  12.890
  365   2H2     G 193          2H2         G 193 -16.054  26.943  13.524
  366   1H5*    A 194          1H5*        A 194 -14.172  33.502  12.603
  367   2H5*    A 194          2H5*        A 194 -12.735  34.368  12.063
  368    H4*    A 194           H4*        A 194 -12.059  32.953  13.830
  369    H3*    A 194           H3*        A 194 -11.204  31.967  11.124
  370    H2*    A 194           H2*        A 194 -10.026  30.173  12.141
  371   2HO*    A 194          2HO*        A 194  -9.418  30.465  14.241
  372    H1*    A 194           H1*        A 194 -12.155  29.428  13.777
  373    H8     A 194           H8         A 194 -13.549  30.544  10.519
  374   1H6     A 194          1H6         A 194 -12.461  24.780   8.390
  375   2H6     A 194          2H6         A 194 -13.245  26.302   8.027
  376    H2     A 194           H2         A 194 -10.491  25.194  12.351
  377   1H5*    C 195          1H5*        C 195  -7.959  31.929  13.565
  378   2H5*    C 195          2H5*        C 195  -6.605  32.907  13.000
  379    H4*    C 195           H4*        C 195  -5.638  30.874  13.587
  380    H3*    C 195           H3*        C 195  -6.066  31.010  10.612
  381    H2*    C 195           H2*        C 195  -4.969  28.917  10.367
  382   2HO*    C 195          2HO*        C 195  -3.370  29.247  11.913
  383    H1*    C 195           H1*        C 195  -6.435  27.698  12.416
  384   1H4     C 195          1H4         C 195  -9.602  26.276   7.048
  385   2H4     C 195          2H4         C 195 -10.468  27.790   7.185
  386    H5     C 195           H5         C 195  -9.996  29.432   8.816
  387    H6     C 195           H6         C 195  -8.563  30.033  10.734
  388   1H5*    G 196          1H5*        G 196  -1.016  30.890  10.296
  389   2H5*    G 196          2H5*        G 196  -1.243  32.190   9.125
  390    H4*    G 196           H4*        G 196   0.046  30.239   8.273
  391    H3*    G 196           H3*        G 196  -2.456  31.168   6.895
  392    H2*    G 196           H2*        G 196  -2.102  29.565   5.167
  393   2HO*    G 196          2HO*        G 196   0.176  28.515   6.453
  394    H1*    G 196           H1*        G 196  -1.720  27.462   6.963
  395    H8     G 196           H8         G 196  -4.324  30.001   8.005
  396    H1     G 196           H1         G 196  -6.609  25.142   4.392
  397   1H2     G 196          1H2         G 196  -5.038  24.005   3.693
  398   2H2     G 196          2H2         G 196  -3.351  24.321   4.035
  399   1H5*    A 197          1H5*        A 197   0.650  35.496   4.257
  400   2H5*    A 197          2H5*        A 197  -0.666  34.577   3.527
  401    H4*    A 197           H4*        A 197   2.201  33.636   3.453
  402    H3*    A 197           H3*        A 197   0.842  35.614   1.647
  403    H2*    A 197           H2*        A 197   1.637  34.555  -0.233
  404   2HO*    A 197          2HO*        A 197   3.788  34.268  -0.102
  405    H1*    A 197           H1*        A 197   1.988  32.036   1.348
  406    H8     A 197           H8         A 197  -1.198  33.529  -0.130
  407   1H6     A 197          1H6         A 197  -0.827  28.951  -4.357
  408   2H6     A 197          2H6         A 197  -1.812  30.282  -3.791
  409    H2     A 197           H2         A 197   2.797  28.772  -1.793
  410   1H5*    U 198          1H5*        U 198   5.128  37.170   3.321
  411   2H5*    U 198          2H5*        U 198   6.564  37.225   2.298
  412    H4*    U 198           H4*        U 198   5.173  34.643   2.218
  413    H3*    U 198           H3*        U 198   6.173  35.691   4.872
  414    H2*    U 198           H2*        U 198   6.923  33.548   5.394
  415   2HO*    U 198          2HO*        U 198   5.838  32.041   3.446
  416    H1*    U 198           H1*        U 198   7.411  33.016   2.530
  417    H3     U 198           H3         U 198  11.758  32.160   3.091
  418    H5     U 198           H5         U 198  10.921  34.665   6.342
  419    H6     U 198           H6         U 198   8.636  34.863   5.473
  420   1H5*    G 199          1H5*        G 199   0.413  35.833   6.212
  421   2H5*    G 199          2H5*        G 199   1.658  36.912   6.841
  422    H4*    G 199           H4*        G 199   0.530  35.917   8.690
  423    H3*    G 199           H3*        G 199   3.323  34.892   8.244
  424    H2*    G 199           H2*        G 199   3.163  33.626  10.255
  425   2HO*    G 199          2HO*        G 199   0.556  34.219  10.875
  426    H1*    G 199           H1*        G 199   0.676  32.538   9.559
  427    H8     G 199           H8         G 199   2.895  32.816   6.562
  428    H1     G 199           H1         G 199   3.956  27.494  10.089
  429   1H2     G 199          1H2         G 199   2.923  27.630  11.868
  430   2H2     G 199          2H2         G 199   1.920  28.985  12.336
  431   1H5*    A 200          1H5*        A 200   6.112  38.410   9.841
  432   2H5*    A 200          2H5*        A 200   6.644  37.947   8.225
  433    H4*    A 200           H4*        A 200   8.000  37.446  10.534
  434    H3*    A 200           H3*        A 200   8.124  36.188   7.811
  435    H2*    A 200           H2*        A 200   9.712  34.608   8.588
  436   2HO*    A 200          2HO*        A 200   9.655  35.663  11.204
  437    H1*    A 200           H1*        A 200   8.271  33.903  10.846
  438    H8     A 200           H8         A 200   5.717  34.599   8.280
  439   1H6     A 200          1H6         A 200   6.712  28.857   6.048
  440   2H6     A 200          2H6         A 200   5.654  30.248   5.962
  441    H2     A 200           H2         A 200   9.918  29.781   8.982
  442   1H5*    C 201          1H5*        C 201  12.630  37.946   7.214
  443   2H5*    C 201          2H5*        C 201  12.902  36.354   6.505
  444    H4*    C 201           H4*        C 201  11.686  36.985   9.198
  445    H3*    C 201           H3*        C 201  14.301  35.740   8.341
  446    H2*    C 201           H2*        C 201  14.344  34.556  10.390
  447   2HO*    C 201          2HO*        C 201  13.278  35.490  12.073
  448    H1*    C 201           H1*        C 201  11.543  33.953  10.182
  449   1H4     C 201          1H4         C 201  14.352  28.413   8.766
  450   2H4     C 201          2H4         C 201  14.937  29.081   7.258
  451    H5     C 201           H5         C 201  14.640  31.334   6.615
  452    H6     C 201           H6         C 201  13.699  33.521   7.266
  453   1H5*    C 202          1H5*        C 202  15.169  37.927  12.110
  454   2H5*    C 202          2H5*        C 202  16.909  37.993  12.395
  455    H4*    C 202           H4*        C 202  15.541  36.519  13.940
  456    H3*    C 202           H3*        C 202  17.969  35.475  12.475
  457    H2*    C 202           H2*        C 202  17.825  33.503  13.769
  458   2HO*    C 202          2HO*        C 202  15.668  34.175  15.322
  459    H1*    C 202           H1*        C 202  14.966  33.434  13.524
  460   1H4     C 202          1H4         C 202  17.227  28.835   9.683
  461   2H4     C 202          2H4         C 202  17.362  30.024   8.408
  462    H5     C 202           H5         C 202  16.980  32.334   8.717
  463    H6     C 202           H6         C 202  16.372  34.089  10.343
  464   1H5*    C 203          1H5*        C 203  18.765  35.558  16.732
  465   2H5*    C 203          2H5*        C 203  20.462  35.381  17.174
  466    H4*    C 203           H4*        C 203  19.002  33.481  17.857
  467    H3*    C 203           H3*        C 203  21.373  32.979  16.055
  468    H2*    C 203           H2*        C 203  21.021  30.654  16.329
  469   2HO*    C 203          2HO*        C 203  18.950  30.469  17.951
  470    H1*    C 203           H1*        C 203  18.190  30.954  16.028
  471   1H4     C 203          1H4         C 203  20.370  28.486  10.531
  472   2H4     C 203          2H4         C 203  20.611  30.118   9.947
  473    H5     C 203           H5         C 203  20.336  32.046  11.282
  474    H6     C 203           H6         C 203  19.756  32.893  13.528
  475   1H5*    U 204          1H5*        U 204  21.372  31.113  19.663
  476   2H5*    U 204          2H5*        U 204  22.823  30.785  20.611
  477    H4*    U 204           H4*        U 204  21.599  28.745  20.302
  478    H3*    U 204           H3*        U 204  24.213  28.929  18.827
  479    H2*    U 204           H2*        U 204  23.964  26.672  18.113
  480   2HO*    U 204          2HO*        U 204  21.449  26.509  19.418
  481    H1*    U 204           H1*        U 204  21.347  27.059  17.217
  482    H3     U 204           H3         U 204  24.163  26.579  13.597
  483    H5     U 204           H5         U 204  24.134  30.671  14.489
  484    H6     U 204           H6         U 204  22.932  30.112  16.552
  485   1H5*    A 205          1H5*        A 205  25.876  26.744  22.749
  486   2H5*    A 205          2H5*        A 205  27.601  27.030  22.520
  487    H4*    A 205           H4*        A 205  26.703  24.674  22.092
  488    H3*    A 205           H3*        A 205  28.519  26.162  20.210
  489    H2*    A 205           H2*        A 205  28.647  24.236  18.827
  490   2HO*    A 205          2HO*        A 205  28.712  22.638  20.365
  491    H1*    A 205           H1*        A 205  25.882  23.819  18.824
  492    H8     A 205           H8         A 205  26.366  27.471  18.688
  493   1H6     A 205          1H6         A 205  27.286  26.898  12.542
  494   2H6     A 205          2H6         A 205  27.019  28.046  13.835
  495    H2     A 205           H2         A 205  27.316  22.833  14.337
  496   1H5*    G 206          1H5*        G 206  30.489  24.266  18.049
  497   2H5*    G 206          2H5*        G 206  32.052  24.112  18.851
  498    H4*    G 206           H4*        G 206  31.019  26.516  17.333
  499    H3*    G 206           H3*        G 206  32.896  24.312  16.623
  500    H2*    G 206           H2*        G 206  34.387  25.812  15.526
  501   2HO*    G 206          2HO*        G 206  33.375  28.200  15.947
  502    H1*    G 206           H1*        G 206  34.506  27.557  17.698
  503    H8     G 206           H8         G 206  34.294  24.049  18.946
  504    H1     G 206           H1         G 206  40.282  25.813  17.239
  505   1H2     G 206          1H2         G 206  40.211  27.620  16.247
  506   2H2     G 206          2H2         G 206  38.747  28.523  15.926
  507   1H5*    U 207          1H5*        U 207  30.010  25.081  12.264
  508   2H5*    U 207          2H5*        U 207  31.276  24.851  11.057
  509    H4*    U 207           H4*        U 207  29.708  26.840  10.769
  510    H3*    U 207           H3*        U 207  32.707  27.030  10.619
  511    H2*    U 207           H2*        U 207  32.521  29.318  10.009
  512   2HO*    U 207          2HO*        U 207  30.159  30.029   9.773
  513    H1*    U 207           H1*        U 207  30.706  29.915  12.051
  514    H3     U 207           H3         U 207  34.319  31.951  13.778
  515    H5     U 207           H5         U 207  35.392  27.903  13.874
  516    H6     U 207           H6         U 207  33.296  27.422  12.695
  517   1H5*    A 208          1H5*        A 208  33.037  27.654   5.300
  518   2H5*    A 208          2H5*        A 208  31.418  27.491   4.622
  519    H4*    A 208           H4*        A 208  32.837  25.928   3.524
  520    H3*    A 208           H3*        A 208  30.809  24.764   5.377
  521    H2*    A 208           H2*        A 208  31.565  22.549   4.944
  522   2HO*    A 208          2HO*        A 208  33.572  22.695   3.348
  523    H1*    A 208           H1*        A 208  34.246  23.187   5.414
  524    H8     A 208           H8         A 208  31.344  24.624   7.466
  525   1H6     A 208          1H6         A 208  32.966  20.416  11.780
  526   2H6     A 208          2H6         A 208  31.877  21.741  11.430
  527    H2     A 208           H2         A 208  35.568  19.835   8.225
  528   1H5*    G 209          1H5*        G 209  29.322  23.089   2.387
  529   2H5*    G 209          2H5*        G 209  27.571  22.888   2.378
  530    H4*    G 209           H4*        G 209  28.813  21.134   3.638
  531    H3*    G 209           H3*        G 209  26.677  22.781   4.962
  532    H2*    G 209           H2*        G 209  26.893  21.468   6.940
  533   2HO*    G 209          2HO*        G 209  28.962  19.869   6.239
  534    H1*    G 209           H1*        G 209  29.673  21.737   7.014
  535    H8     G 209           H8         G 209  28.270  24.956   5.827
  536    H1     G 209           H1         G 209  27.860  24.236  12.245
  537   1H2     G 209          1H2         G 209  28.304  22.287  12.750
  538   2H2     G 209          2H2         G 209  28.726  21.033  11.604
  539   1H5*    A 210          1H5*        A 210  25.611  18.422   6.388
  540   2H5*    A 210          2H5*        A 210  23.879  18.621   6.124
  541    H4*    A 210           H4*        A 210  24.549  18.001   8.457
  542    H3*    A 210           H3*        A 210  22.900  20.464   7.912
  543    H2*    A 210           H2*        A 210  22.619  20.754  10.251
  544   2HO*    A 210          2HO*        A 210  24.169  18.531  10.938
  545    H1*    A 210           H1*        A 210  25.353  20.321  10.791
  546    H8     A 210           H8         A 210  24.927  22.416   7.738
  547   1H6     A 210          1H6         A 210  24.631  27.360  11.537
  548   2H6     A 210          2H6         A 210  24.752  26.863   9.864
  549    H2     A 210           H2         A 210  24.473  23.682  14.025
  550   1H5*    G 211          1H5*        G 211  21.184  17.873  10.552
  551   2H5*    G 211          2H5*        G 211  19.477  17.467  10.379
  552    H4*    G 211           H4*        G 211  19.849  18.054  12.649
  553    H3*    G 211           H3*        G 211  18.338  20.116  11.073
  554    H2*    G 211           H2*        G 211  18.051  21.424  13.045
  555   2HO*    G 211          2HO*        G 211  19.369  20.132  14.914
  556    H1*    G 211           H1*        G 211  20.748  21.340  13.719
  557    H8     G 211           H8         G 211  20.576  21.488  10.022
  558    H1     G 211           H1         G 211  19.651  27.250  12.820
  559   1H2     G 211          1H2         G 211  19.381  26.995  14.849
  560   2H2     G 211          2H2         G 211  19.402  25.450  15.669
  561   1H5*    G 212          1H5*        G 212  16.134  19.395  14.534
  562   2H5*    G 212          2H5*        G 212  14.519  18.804  14.146
  563    H4*    G 212           H4*        G 212  14.129  20.459  15.723
  564    H3*    G 212           H3*        G 212  13.659  21.491  12.954
  565    H2*    G 212           H2*        G 212  13.071  23.638  13.800
  566   2HO*    G 212          2HO*        G 212  12.512  23.759  15.951
  567    H1*    G 212           H1*        G 212  15.356  23.766  15.440
  568    H8     G 212           H8         G 212  16.034  22.276  12.058
  569    H1     G 212           H1         G 212  16.338  28.740  12.194
  570   1H2     G 212          1H2         G 212  15.646  29.424  14.012
  571   2H2     G 212          2H2         G 212  15.068  28.398  15.306
  572   1H5*    G 213          1H5*        G 213   9.028  20.353  14.043
  573   2H5*    G 213          2H5*        G 213   8.415  20.367  12.389
  574    H4*    G 213           H4*        G 213   7.635  22.227  13.930
  575    H3*    G 213           H3*        G 213   8.780  22.712  11.193
  576    H2*    G 213           H2*        G 213   8.303  25.035  11.414
  577   2HO*    G 213          2HO*        G 213   7.344  25.225  13.887
  578    H1*    G 213           H1*        G 213   9.505  25.221  13.925
  579    H8     G 213           H8         G 213  11.438  22.842  11.802
  580    H1     G 213           H1         G 213  12.891  29.049  10.688
  581   1H2     G 213          1H2         G 213  11.526  30.259  11.648
  582   2H2     G 213          2H2         G 213  10.186  29.678  12.612
  583   1H5*    G 214          1H5*        G 214   7.066  25.813   9.675
  584   2H5*    G 214          2H5*        G 214   5.903  24.957   8.663
  585    H4*    G 214           H4*        G 214   7.381  26.270   7.285
  586    H3*    G 214           H3*        G 214   7.586  23.292   7.057
  587    H2*    G 214           H2*        G 214   9.262  23.484   5.384
  588   2HO*    G 214          2HO*        G 214   9.589  25.566   4.463
  589    H1*    G 214           H1*        G 214  10.770  25.329   6.865
  590    H8     G 214           H8         G 214   9.495  22.851   9.275
  591    H1     G 214           H1         G 214  14.523  20.630   5.860
  592   1H2     G 214          1H2         G 214  14.900  21.904   4.282
  593   2H2     G 214          2H2         G 214  13.990  23.356   3.936
  594   1H5*    G 215          1H5*        G 215   7.600  24.556   3.371
  595   2H5*    G 215          2H5*        G 215   6.098  24.295   2.486
  596    H4*    G 215           H4*        G 215   7.742  23.747   0.945
  597    H3*    G 215           H3*        G 215   6.608  21.283   2.215
  598    H2*    G 215           H2*        G 215   8.034  19.900   0.899
  599   2HO*    G 215          2HO*        G 215   9.499  21.829  -0.346
  600    H1*    G 215           H1*        G 215  10.334  21.317   1.573
  601    H8     G 215           H8         G 215   8.045  21.222   4.518
  602    H1     G 215           H1         G 215  11.591  15.851   3.839
  603   1H2     G 215          1H2         G 215  12.539  15.878   2.007
  604   2H2     G 215          2H2         G 215  12.393  17.164   0.831
  605   1H5*    C 216          1H5*        C 216   4.269  21.117  -1.838
  606   2H5*    C 216          2H5*        C 216   2.932  20.035  -1.449
  607    H4*    C 216           H4*        C 216   4.840  19.073  -2.819
  608    H3*    C 216           H3*        C 216   3.777  17.755  -0.328
  609    H2*    C 216           H2*        C 216   5.190  15.891  -0.741
  610   2HO*    C 216          2HO*        C 216   6.057  17.234  -3.117
  611    H1*    C 216           H1*        C 216   7.443  17.492  -1.246
  612   1H4     C 216          1H4         C 216   7.913  15.790   4.901
  613   2H4     C 216          2H4         C 216   6.935  17.176   5.331
  614    H5     C 216           H5         C 216   5.901  18.596   3.751
  615    H6     C 216           H6         C 216   5.546  19.039   1.348
  616   1H5*    U 217          1H5*        U 217   3.772  15.176  -3.230
  617   2H5*    U 217          2H5*        U 217   2.303  14.323  -3.707
  618    H4*    U 217           H4*        U 217   3.706  12.554  -3.428
  619    H3*    U 217           H3*        U 217   2.384  13.021  -0.773
  620    H2*    U 217           H2*        U 217   3.564  11.158   0.144
  621   2HO*    U 217          2HO*        U 217   4.985  10.024  -1.474
  622    H1*    U 217           H1*        U 217   6.037  12.077  -0.731
  623    H3     U 217           H3         U 217   6.518  13.228   3.575
  624    H5     U 217           H5         U 217   3.343  15.657   2.323
  625    H6     U 217           H6         U 217   3.441  14.502   0.163
  626   1H5*    G 218          1H5*        G 218  -1.393   9.437  -1.506
  627   2H5*    G 218          2H5*        G 218   0.095  10.082  -0.813
  628    H4*    G 218           H4*        G 218  -0.174   7.694  -2.152
  629    H3*    G 218           H3*        G 218   2.247   9.372  -1.494
  630    H2*    G 218           H2*        G 218   3.605   7.770  -2.567
  631   2HO*    G 218          2HO*        G 218   1.918   5.868  -3.316
  632    H1*    G 218           H1*        G 218   1.684   7.446  -4.692
  633    H8     G 218           H8         G 218   2.412  11.019  -4.240
  634    H1     G 218           H1         G 218   7.064   7.960  -7.539
  635   1H2     G 218          1H2         G 218   6.792   5.922  -7.383
  636   2H2     G 218          2H2         G 218   5.496   5.156  -6.492
  637   1H5*    C 219          1H5*        C 219   4.251   6.025   2.305
  638   2H5*    C 219          2H5*        C 219   2.885   5.381   3.217
  639    H4*    C 219           H4*        C 219   4.297   7.085   4.409
  640    H3*    C 219           H3*        C 219   1.320   7.358   4.134
  641    H2*    C 219           H2*        C 219   1.333   9.395   5.251
  642   2HO*    C 219          2HO*        C 219   2.531   8.609   7.002
  643    H1*    C 219           H1*        C 219   4.001  10.059   4.244
  644   1H4     C 219          1H4         C 219  -0.225  14.403   2.046
  645   2H4     C 219          2H4         C 219  -0.183  13.517   0.538
  646    H5     C 219           H5         C 219   0.910  11.442   0.260
  647    H6     C 219           H6         C 219   2.244   9.688   1.373
  648   1H5*    G 220          1H5*        G 220   4.495   4.363   6.863
  649   2H5*    G 220          2H5*        G 220   4.487   5.865   5.940
  650    H4*    G 220           H4*        G 220   5.932   3.335   5.453
  651    H3*    G 220           H3*        G 220   6.468   6.269   4.942
  652    H2*    G 220           H2*        G 220   8.224   5.629   3.519
  653   2HO*    G 220          2HO*        G 220   8.415   3.015   3.755
  654    H1*    G 220           H1*        G 220   6.683   3.344   2.578
  655    H8     G 220           H8         G 220   6.270   3.781   0.126
  656    H1     G 220           H1         G 220   6.840  10.184   0.868
  657   1H2     G 220          1H2         G 220   7.039  10.631   2.870
  658   2H2     G 220          2H2         G 220   7.050   9.447   4.158
  659   1H5*    G 221          1H5*        G 221   9.717   5.098   5.655
  660   2H5*    G 221          2H5*        G 221  10.891   5.822   6.754
  661    H4*    G 221           H4*        G 221  11.371   5.809   4.216
  662    H3*    G 221           H3*        G 221  11.812   8.104   6.095
  663    H2*    G 221           H2*        G 221  12.694   9.420   4.320
  664   2HO*    G 221          2HO*        G 221  12.257   7.574   2.307
  665    H1*    G 221           H1*        G 221  10.567   8.942   2.616
  666    H8     G 221           H8         G 221  10.125   9.240   6.414
  667    H1     G 221           H1         G 221   8.581  14.520   3.005
  668   1H2     G 221          1H2         G 221   8.995  14.198   1.012
  669   2H2     G 221          2H2         G 221   9.661  12.717   0.359
  670   1H5*    C 222          1H5*        C 222  16.328   8.089   4.241
  671   2H5*    C 222          2H5*        C 222  16.766   9.361   5.382
  672    H4*    C 222           H4*        C 222  16.398   9.709   2.707
  673    H3*    C 222           H3*        C 222  16.285  11.648   5.005
  674    H2*    C 222           H2*        C 222  15.755  13.395   3.495
  675   2HO*    C 222          2HO*        C 222  15.810  12.668   1.140
  676    H1*    C 222           H1*        C 222  13.790  11.947   2.152
  677   1H4     C 222          1H4         C 222  10.726  15.185   6.751
  678   2H4     C 222          2H4         C 222  10.922  13.799   7.800
  679    H5     C 222           H5         C 222  12.191  11.889   7.234
  680    H6     C 222           H6         C 222  13.600  10.830   5.506
  681   1H5*    U 223          1H5*        U 223  18.253  13.501   2.081
  682   2H5*    U 223          2H5*        U 223  19.565  14.562   2.594
  683    H4*    U 223           H4*        U 223  17.510  15.584   1.421
  684    H3*    U 223           H3*        U 223  18.812  16.686   3.902
  685    H2*    U 223           H2*        U 223  17.347  18.543   3.832
  686   2HO*    U 223          2HO*        U 223  15.876  17.936   1.637
  687    H1*    U 223           H1*        U 223  15.058  17.004   3.382
  688    H3     U 223           H3         U 223  15.122  18.796   7.664
  689    H5     U 223           H5         U 223  16.820  14.978   7.937
  690    H6     U 223           H6         U 223  16.861  14.929   5.486
  691   1H5*    U 224          1H5*        U 224  20.408  19.345  -0.342
  692   2H5*    U 224          2H5*        U 224  19.559  20.886  -0.452
  693    H4*    U 224           H4*        U 224  19.037  18.658  -1.957
  694    H3*    U 224           H3*        U 224  17.435  21.127  -1.357
  695    H2*    U 224           H2*        U 224  15.590  20.249  -2.548
  696   2HO*    U 224          2HO*        U 224  16.819  17.847  -3.233
  697    H1*    U 224           H1*        U 224  15.657  17.756  -1.351
  698    H3     U 224           H3         U 224  12.260  19.296   1.117
  699    H5     U 224           H5         U 224  15.362  21.927   2.114
  700    H6     U 224           H6         U 224  16.751  20.756   0.467
  701   1H5*    A 225          1H5*        A 225  18.554  20.352  -5.380
  702   2H5*    A 225          2H5*        A 225  18.608  21.489  -6.728
  703    H4*    A 225           H4*        A 225  16.988  19.789  -7.203
  704    H3*    A 225           H3*        A 225  15.887  22.526  -6.660
  705    H2*    A 225           H2*        A 225  13.685  21.760  -7.089
  706   2HO*    A 225          2HO*        A 225  13.574  19.465  -7.875
  707    H1*    A 225           H1*        A 225  14.043  19.437  -5.500
  708    H8     A 225           H8         A 225  15.454  22.374  -3.739
  709   1H6     A 225          1H6         A 225   9.698  23.563  -1.642
  710   2H6     A 225          2H6         A 225  11.385  23.993  -1.473
  711    H2     A 225           H2         A 225   9.416  20.414  -4.765
  712   1H5*    G 226          1H5*        G 226  14.736  20.740 -10.114
  713   2H5*    G 226          2H5*        G 226  14.564  21.583 -11.654
  714    H4*    G 226           H4*        G 226  12.547  20.399 -11.269
  715    H3*    G 226           H3*        G 226  12.348  23.364 -10.956
  716    H2*    G 226           H2*        G 226  10.032  23.219 -10.412
  717   2HO*    G 226          2HO*        G 226   9.338  20.776 -10.367
  718    H1*    G 226           H1*        G 226  10.459  21.249  -8.464
  719    H8     G 226           H8         G 226  13.290  23.550  -8.106
  720    H1     G 226           H1         G 226   7.827  25.997  -5.643
  721   1H2     G 226          1H2         G 226   6.224  24.857  -6.257
  722   2H2     G 226          2H2         G 226   6.341  23.446  -7.286
  723   1H5*    G 227          1H5*        G 227  11.138  21.946 -15.533
  724   2H5*    G 227          2H5*        G 227  12.096  22.967 -16.604
  725    H4*    G 227           H4*        G 227   9.915  23.514 -17.156
  726    H3*    G 227           H3*        G 227  11.036  25.540 -15.249
  727    H2*    G 227           H2*        G 227   9.011  26.791 -15.358
  728   2HO*    G 227          2HO*        G 227   7.368  25.813 -16.890
  729    H1*    G 227           H1*        G 227   7.400  24.587 -14.832
  730    H8     G 227           H8         G 227  10.667  24.414 -12.976
  731    H1     G 227           H1         G 227   6.077  27.810  -9.930
  732   1H2     G 227          1H2         G 227   4.464  28.075 -11.189
  733   2H2     G 227          2H2         G 227   4.371  27.467 -12.827
  734   1H5*    A 228          1H5*        A 228   9.661  27.884 -18.587
  735   2H5*    A 228          2H5*        A 228  10.864  29.106 -18.993
  736    H4*    A 228           H4*        A 228   8.794  30.209 -18.572
  737    H3*    A 228           H3*        A 228  10.924  30.617 -16.512
  738    H2*    A 228           H2*        A 228   9.502  32.018 -15.226
  739   2HO*    A 228          2HO*        A 228   7.224  32.135 -16.426
  740    H1*    A 228           H1*        A 228   7.347  30.215 -15.340
  741    H8     A 228           H8         A 228  10.488  28.295 -14.878
  742   1H6     A 228          1H6         A 228   9.944  29.391  -8.758
  743   2H6     A 228          2H6         A 228  10.820  28.471  -9.962
  744    H2     A 228           H2         A 228   6.968  31.907 -10.891
  745   1H5*    G 229          1H5*        G 229   9.059  34.076 -17.725
  746   2H5*    G 229          2H5*        G 229  10.076  35.405 -18.282
  747    H4*    G 229           H4*        G 229   8.509  36.393 -16.854
  748    H3*    G 229           H3*        G 229  11.186  36.060 -15.559
  749    H2*    G 229           H2*        G 229  10.393  37.065 -13.548
  750   2HO*    G 229          2HO*        G 229   7.758  37.295 -14.450
  751    H1*    G 229           H1*        G 229   8.151  35.410 -13.404
  752    H8     G 229           H8         G 229  10.922  33.341 -14.717
  753    H1     G 229           H1         G 229  11.238  34.189  -8.308
  754   1H2     G 229          1H2         G 229   9.903  35.655  -7.741
  755   2H2     G 229          2H2         G 229   8.853  36.524  -8.837
  756   1H5*    G 230          1H5*        G 230   9.879  40.048 -14.599
  757   2H5*    G 230          2H5*        G 230  11.100  41.137 -15.256
  758    H4*    G 230           H4*        G 230  10.753  41.910 -13.090
  759    H3*    G 230           H3*        G 230  13.230  40.226 -13.245
  760    H2*    G 230           H2*        G 230  13.673  40.630 -10.939
  761   2HO*    G 230          2HO*        G 230  11.342  42.060 -10.457
  762    H1*    G 230           H1*        G 230  11.094  39.925 -10.142
  763    H8     G 230           H8         G 230  12.225  37.761 -12.977
  764    H1     G 230           H1         G 230  14.311  35.757  -7.188
  765   1H2     G 230          1H2         G 230  13.911  37.202  -5.773
  766   2H2     G 230          2H2         G 230  13.126  38.730  -6.105
  767   1H5*    G 231          1H5*        G 231  14.141  43.568 -10.961
  768   2H5*    G 231          2H5*        G 231  15.441  44.479 -11.728
  769    H4*    G 231           H4*        G 231  16.051  44.330  -9.476
  770    H3*    G 231           H3*        G 231  17.559  42.365 -11.169
  771    H2*    G 231           H2*        G 231  18.802  41.655  -9.264
  772   2HO*    G 231          2HO*        G 231  18.389  42.890  -7.267
  773    H1*    G 231           H1*        G 231  16.521  41.274  -7.703
  774    H8     G 231           H8         G 231  15.783  40.288 -11.222
  775    H1     G 231           H1         G 231  18.834  35.684  -7.850
  776   1H2     G 231          1H2         G 231  19.496  36.465  -6.060
  777   2H2     G 231          2H2         G 231  19.259  38.122  -5.549
  778   1H5*    C 232          1H5*        C 232  20.512  44.579  -9.070
  779   2H5*    C 232          2H5*        C 232  22.017  44.734  -9.977
  780    H4*    C 232           H4*        C 232  22.289  43.487  -7.876
  781    H3*    C 232           H3*        C 232  22.864  42.072 -10.475
  782    H2*    C 232           H2*        C 232  23.711  40.226  -9.242
  783   2HO*    C 232          2HO*        C 232  23.402  40.896  -6.717
  784    H1*    C 232           H1*        C 232  21.504  40.231  -7.471
  785   1H4     C 232          1H4         C 232  20.249  35.655 -11.758
  786   2H4     C 232          2H4         C 232  19.556  36.869 -12.811
  787    H5     C 232           H5         C 232  19.618  39.187 -12.365
  788    H6     C 232           H6         C 232  20.365  40.929 -10.782
  789   1H5*    A 233          1H5*        A 233  27.064  42.045  -8.343
  790   2H5*    A 233          2H5*        A 233  28.052  42.394  -9.761
  791    H4*    A 233           H4*        A 233  28.819  40.396  -8.587
  792    H3*    A 233           H3*        A 233  27.794  40.093 -11.395
  793    H2*    A 233           H2*        A 233  28.406  37.794 -11.371
  794   2HO*    A 233          2HO*        A 233  30.325  38.176 -10.166
  795    H1*    A 233           H1*        A 233  27.165  37.300  -8.919
  796    H8     A 233           H8         A 233  25.016  39.703 -10.728
  797   1H6     A 233          1H6         A 233  22.562  34.845 -13.781
  798   2H6     A 233          2H6         A 233  22.383  36.555 -13.462
  799    H2     A 233           H2         A 233  26.140  33.427 -11.561
  800   1H5*    G 234          1H5*        G 234  32.059  38.504 -11.555
  801   2H5*    G 234          2H5*        G 234  32.694  39.266 -13.013
  802    H4*    G 234           H4*        G 234  33.104  36.907 -13.117
  803    H3*    G 234           H3*        G 234  31.052  37.952 -15.047
  804    H2*    G 234           H2*        G 234  30.883  35.790 -16.035
  805   2HO*    G 234          2HO*        G 234  32.414  34.167 -14.922
  806    H1*    G 234           H1*        G 234  30.544  34.507 -13.580
  807    H8     G 234           H8         G 234  28.775  37.766 -13.420
  808    H1     G 234           H1         G 234  25.404  33.199 -16.528
  809   1H2     G 234          1H2         G 234  26.618  31.570 -16.884
  810   2H2     G 234          2H2         G 234  28.298  31.458 -16.412
  811   1H    GLY  15          1H        GLY  15   3.892  -1.957  -1.596
  812   1HA   GLY  15          1HA       GLY  15   6.423  -2.513  -0.535
  813   2HA   GLY  15          2HA       GLY  15   6.631  -2.127  -2.237
  814    H    ARG  16           H        ARG  16   7.817  -0.257  -1.715
  815    HA   ARG  16           HA       ARG  16   6.200   1.928  -0.575
  816   1HB   ARG  16          2HB       ARG  16   9.212   1.656  -0.586
  817   2HB   ARG  16          3HB       ARG  16   8.296   2.982   0.120
  818   1HG   ARG  16          2HG       ARG  16   8.101   1.877   2.025
  819   2HG   ARG  16          3HG       ARG  16   7.346   0.514   1.194
  820   1HD   ARG  16          2HD       ARG  16   9.928   0.138   0.506
  821   2HD   ARG  16          3HD       ARG  16  10.129   0.893   2.087
  822    HE   ARG  16           HE       ARG  16   8.296  -1.012   2.581
  823   1HH1  ARG  16          2HH1      ARG  16  11.383  -1.080   0.974
  824   2HH1  ARG  16          1HH1      ARG  16  11.725  -2.719   1.415
  825   1HH2  ARG  16          2HH2      ARG  16   8.734  -3.172   3.169
  826   2HH2  ARG  16          1HH2      ARG  16  10.215  -3.909   2.664
  827    H    ALA  17           H        ALA  17   8.332   0.918  -3.157
  828    HA   ALA  17           HA       ALA  17   8.677   1.747  -5.251
  829   1HB   ALA  17          1HB       ALA  17   6.088   2.294  -4.803
  830   2HB   ALA  17          2HB       ALA  17   6.709   3.932  -5.012
  831   3HB   ALA  17          3HB       ALA  17   6.931   2.737  -6.288
  832    H    ARG  18           H        ARG  18   9.573   3.137  -2.567
  833    HA   ARG  18           HA       ARG  18  10.072   5.823  -3.026
  834   1HB   ARG  18          2HB       ARG  18  10.735   3.989  -1.067
  835   2HB   ARG  18          3HB       ARG  18  12.300   4.456  -1.718
  836   1HG   ARG  18          2HG       ARG  18  10.242   6.460  -0.838
  837   2HG   ARG  18          3HG       ARG  18  11.462   5.791   0.248
  838   1HD   ARG  18          2HD       ARG  18  12.122   7.156  -2.354
  839   2HD   ARG  18          3HD       ARG  18  12.040   8.002  -0.809
  840    HE   ARG  18           HE       ARG  18  13.750   5.884  -0.409
  841   1HH1  ARG  18          2HH1      ARG  18  13.609   8.653  -2.515
  842   2HH1  ARG  18          1HH1      ARG  18  15.329   8.804  -2.645
  843   1HH2  ARG  18          2HH2      ARG  18  16.017   6.073  -0.574
  844   2HH2  ARG  18          1HH2      ARG  18  16.698   7.335  -1.541
  845    H    GLY  19           H        GLY  19  11.360   6.925  -4.362
  846   1HA   GLY  19          1HA       GLY  19  13.509   7.242  -5.419
  847   2HA   GLY  19          2HA       GLY  19  13.607   5.500  -5.633
  848    H    LEU  20           H        LEU  20  10.770   5.387  -6.515
  849    HA   LEU  20           HA       LEU  20  11.255   6.227  -9.282
  850   1HB   LEU  20          2HB       LEU  20   9.794   4.020  -7.992
  851   2HB   LEU  20          3HB       LEU  20   9.015   4.717  -9.411
  852    HG   LEU  20           HG       LEU  20  11.843   4.098  -9.817
  853   1HD1  LEU  20          1HD1      LEU  20  11.127   1.600 -10.103
  854   2HD1  LEU  20          2HD1      LEU  20   9.952   2.006  -8.854
  855   3HD1  LEU  20          3HD1      LEU  20  11.675   2.200  -8.538
  856   1HD2  LEU  20          1HD2      LEU  20  10.977   3.147 -11.876
  857   2HD2  LEU  20          2HD2      LEU  20  10.277   4.742 -11.596
  858   3HD2  LEU  20          3HD2      LEU  20   9.327   3.291 -11.271
  859    H    CYS  21           H        CYS  21  10.186   7.969 -10.154
  860    HA   CYS  21           HA       CYS  21   8.263   9.292  -8.539
  861   1HB   CYS  21          2HB       CYS  21   9.907  10.475  -9.999
  862   2HB   CYS  21          3HB       CYS  21   9.068   9.865 -11.411
  863    H    TYR  22           H        TYR  22   6.072   9.641  -9.137
  864    HA   TYR  22           HA       TYR  22   4.929   7.550 -10.871
  865   1HB   TYR  22          2HB       TYR  22   4.061   6.970  -8.824
  866   2HB   TYR  22          3HB       TYR  22   4.102   8.621  -8.216
  867    HD1  TYR  22           HD1      TYR  22   2.347   6.617 -10.843
  868    HD2  TYR  22           HD2      TYR  22   2.085   9.697  -7.920
  869    HE1  TYR  22           HE1      TYR  22  -0.059   6.838 -11.300
  870    HE2  TYR  22           HE2      TYR  22  -0.323   9.926  -8.368
  871    HH   TYR  22           HH       TYR  22  -2.149   8.694  -9.294
  872    H    THR  23           H        THR  23   5.074  10.922 -10.133
  873    HA   THR  23           HA       THR  23   2.732  11.792 -11.440
  874    HB   THR  23           HB       THR  23   5.338  13.264 -11.009
  875    HG1  THR  23           HG1      THR  23   2.892  13.358  -9.545
  876   1HG2  THR  23          1HG2      THR  23   2.674  14.125 -12.066
  877   2HG2  THR  23          2HG2      THR  23   4.292  14.550 -12.626
  878   3HG2  THR  23          3HG2      THR  23   3.659  15.257 -11.141
  879    H    CYS  24           H        CYS  24   6.126  11.334 -12.623
  880    HA   CYS  24           HA       CYS  24   5.049  11.781 -15.311
  881   1HB   CYS  24          2HB       CYS  24   7.289  12.412 -16.012
  882   2HB   CYS  24          3HB       CYS  24   6.779  13.411 -14.665
  883    H    GLY  25           H        GLY  25   7.007   9.801 -13.159
  884   1HA   GLY  25          1HA       GLY  25   6.969   7.408 -13.270
  885   2HA   GLY  25          2HA       GLY  25   6.697   7.530 -15.002
  886    H    SER  26           H        SER  26   9.116   9.333 -13.189
  887    HA   SER  26           HA       SER  26  11.184   8.064 -14.835
  888   1HB   SER  26          2HB       SER  26  10.862  10.620 -14.690
  889   2HB   SER  26          3HB       SER  26  11.592  10.485 -13.090
  890    HG   SER  26           HG       SER  26  13.473  10.202 -13.986
  891    HA   PRO  27           HA       PRO  27  12.327   5.733 -11.206
  892   1HB   PRO  27          2HB       PRO  27  14.377   4.401 -12.386
  893   2HB   PRO  27          3HB       PRO  27  12.682   3.970 -12.636
  894   1HG   PRO  27          2HG       PRO  27  14.505   5.581 -14.380
  895   2HG   PRO  27          3HG       PRO  27  13.340   4.325 -14.838
  896   1HD   PRO  27          2HD       PRO  27  12.804   6.968 -15.084
  897   2HD   PRO  27          3HD       PRO  27  11.547   5.769 -14.722
  898    H    GLY  28           H        GLY  28  13.093   7.536  -9.993
  899   1HA   GLY  28          1HA       GLY  28  15.743   7.503  -9.254
  900   2HA   GLY  28          2HA       GLY  28  15.639   8.727 -10.509
  901    H    HIS  29           H        HIS  29  13.603  10.219 -10.134
  902    HA   HIS  29           HA       HIS  29  13.905  11.250  -7.410
  903   1HB   HIS  29          2HB       HIS  29  13.102  13.356  -8.262
  904   2HB   HIS  29          3HB       HIS  29  14.349  12.758  -9.352
  905    HD1  HIS  29           HD1      HIS  29  13.745  12.732 -11.756
  906    HD2  HIS  29           HD2      HIS  29  10.387  12.800  -9.311
  907    HE1  HIS  29           HE1      HIS  29  11.785  12.954 -13.314
  908    H    TYR  30           H        TYR  30  11.671  12.694  -7.020
  909    HA   TYR  30           HA       TYR  30   9.422  10.826  -7.302
  910   1HB   TYR  30          2HB       TYR  30  10.812  11.323  -4.898
  911   2HB   TYR  30          3HB       TYR  30   9.279  12.178  -4.766
  912    HD1  TYR  30           HD1      TYR  30  10.607   8.841  -5.806
  913    HD2  TYR  30           HD2      TYR  30   7.451  11.019  -3.962
  914    HE1  TYR  30           HE1      TYR  30   9.485   6.726  -5.243
  915    HE2  TYR  30           HE2      TYR  30   6.320   8.909  -3.393
  916    HH   TYR  30           HH       TYR  30   7.664   5.778  -4.387
  917    H    GLN  31           H        GLN  31   7.365  12.016  -6.336
  918    HA   GLN  31           HA       GLN  31   6.680  14.054  -8.059
  919   1HB   GLN  31          2HB       GLN  31   5.002  12.792  -6.854
  920   2HB   GLN  31          3HB       GLN  31   5.564  13.441  -5.319
  921   1HG   GLN  31          2HG       GLN  31   4.380  15.314  -5.542
  922   2HG   GLN  31          3HG       GLN  31   4.814  15.499  -7.241
  923   1HE2  GLN  31          1HE2      GLN  31   2.754  16.056  -7.876
  924   2HE2  GLN  31          2HE2      GLN  31   1.448  14.925  -7.910
  925    H    ALA  32           H        ALA  32   7.949  14.303  -4.764
  926    HA   ALA  32           HA       ALA  32   7.711  17.062  -4.428
  927   1HB   ALA  32          1HB       ALA  32   9.288  16.860  -2.655
  928   2HB   ALA  32          2HB       ALA  32   8.317  15.388  -2.665
  929   3HB   ALA  32          3HB       ALA  32   9.950  15.371  -3.332
  930    H    GLN  33           H        GLN  33   9.936  15.205  -6.326
  931    HA   GLN  33           HA       GLN  33  11.361  17.687  -7.028
  932   1HB   GLN  33          2HB       GLN  33  12.416  14.905  -6.611
  933   2HB   GLN  33          3HB       GLN  33  13.272  16.049  -7.638
  934   1HG   GLN  33          2HG       GLN  33  13.963  17.312  -5.900
  935   2HG   GLN  33          3HG       GLN  33  12.504  17.011  -4.958
  936   1HE2  GLN  33          1HE2      GLN  33  15.360  15.315  -6.197
  937   2HE2  GLN  33          2HE2      GLN  33  15.603  14.339  -4.792
  938    H    CYS  34           H        CYS  34   8.904  16.422  -8.266
  939    HA   CYS  34           HA       CYS  34   9.913  15.331 -10.722
  940   1HB   CYS  34          2HB       CYS  34   7.802  14.525  -9.629
  941   2HB   CYS  34          3HB       CYS  34   7.061  16.070  -9.997
  942    HA   PRO  35           HA       PRO  35  10.395  19.403 -12.484
  943   1HB   PRO  35          2HB       PRO  35  10.958  18.559 -15.002
  944   2HB   PRO  35          3HB       PRO  35  12.128  18.485 -13.680
  945   1HG   PRO  35          2HG       PRO  35  10.386  16.319 -14.792
  946   2HG   PRO  35          3HG       PRO  35  12.093  16.249 -14.318
  947   1HD   PRO  35          2HD       PRO  35  10.101  15.323 -12.734
  948   2HD   PRO  35          3HD       PRO  35  11.592  16.030 -12.078
  949    H    LYS  36           H        LYS  36   8.015  17.081 -13.268
  950    HA   LYS  36           HA       LYS  36   6.677  18.863 -15.168
  951   1HB   LYS  36          2HB       LYS  36   6.923  16.080 -15.016
  952   2HB   LYS  36          3HB       LYS  36   5.254  16.410 -14.573
  953   1HG   LYS  36          2HG       LYS  36   4.788  17.422 -16.632
  954   2HG   LYS  36          3HG       LYS  36   6.500  17.600 -17.027
  955   1HD   LYS  36          2HD       LYS  36   6.460  14.967 -16.828
  956   2HD   LYS  36          3HD       LYS  36   4.747  15.198 -17.184
  957   1HE   LYS  36          2HE       LYS  36   5.807  14.869 -19.268
  958   2HE   LYS  36          3HE       LYS  36   5.480  16.598 -19.158
  959   1HZ   LYS  36          1HZ       LYS  36   8.093  15.372 -18.469
  960   2HZ   LYS  36          2HZ       LYS  36   7.743  17.020 -18.619
  961   3HZ   LYS  36          3HZ       LYS  36   7.734  16.027 -19.988
  962    H    LYS  37           H        LYS  37   6.822  18.527 -11.932
  963    HA   LYS  37           HA       LYS  37   4.243  18.349 -10.968
  964   1HB   LYS  37          2HB       LYS  37   6.756  19.590 -10.039
  965   2HB   LYS  37          3HB       LYS  37   5.290  20.228  -9.307
  966   1HG   LYS  37          2HG       LYS  37   4.997  17.453  -9.247
  967   2HG   LYS  37          3HG       LYS  37   6.674  17.763  -8.790
  968   1HD   LYS  37          2HD       LYS  37   5.573  17.877  -6.754
  969   2HD   LYS  37          3HD       LYS  37   5.647  19.572  -7.237
  970   1HE   LYS  37          2HE       LYS  37   3.297  18.527  -8.371
  971   2HE   LYS  37          3HE       LYS  37   3.354  17.925  -6.715
  972   1HZ   LYS  37          1HZ       LYS  37   4.055  20.533  -6.463
  973   2HZ   LYS  37          2HZ       LYS  37   2.515  19.900  -6.171
  974   3HZ   LYS  37          3HZ       LYS  37   2.876  20.586  -7.674
  975    H    ARG  38           H        ARG  38   5.925  21.463 -11.416
  976    HA   ARG  38           HA       ARG  38   3.315  22.726 -11.856
  977   1HB   ARG  38          2HB       ARG  38   5.411  23.475 -10.254
  978   2HB   ARG  38          3HB       ARG  38   5.676  24.464 -11.685
  979   1HG   ARG  38          2HG       ARG  38   4.359  25.807 -10.335
  980   2HG   ARG  38          3HG       ARG  38   3.194  25.093 -11.452
  981   1HD   ARG  38          2HD       ARG  38   3.172  23.252  -9.477
  982   2HD   ARG  38          3HD       ARG  38   3.528  24.708  -8.548
  983    HE   ARG  38           HE       ARG  38   1.359  25.135 -10.330
  984   1HH1  ARG  38          2HH1      ARG  38   2.201  23.634  -7.304
  985   2HH1  ARG  38          1HH1      ARG  38   0.601  23.757  -6.650
  986   1HH2  ARG  38          2HH2      ARG  38  -0.750  25.302  -9.479
  987   2HH2  ARG  38          1HH2      ARG  38  -1.076  24.705  -7.887
  988    H    LYS  39           H        LYS  39   3.879  24.923 -13.269
  989    HA   LYS  39           HA       LYS  39   5.288  24.098 -15.697
  990   1HB   LYS  39          2HB       LYS  39   2.392  24.457 -15.413
  991   2HB   LYS  39          3HB       LYS  39   3.091  25.386 -16.733
  992   1HG   LYS  39          2HG       LYS  39   3.903  23.445 -17.800
  993   2HG   LYS  39          3HG       LYS  39   3.599  22.447 -16.377
  994   1HD   LYS  39          2HD       LYS  39   1.257  23.855 -17.488
  995   2HD   LYS  39          3HD       LYS  39   1.940  22.581 -18.501
  996   1HE   LYS  39          2HE       LYS  39   1.661  21.859 -15.676
  997   2HE   LYS  39          3HE       LYS  39   0.134  22.200 -16.486
  998   1HZ   LYS  39          1HZ       LYS  39   2.161  20.347 -17.600
  999   2HZ   LYS  39          2HZ       LYS  39   0.549  20.530 -18.077
 1000   3HZ   LYS  39          3HZ       LYS  39   0.913  19.833 -16.579
 1001    H    SER  40           H        SER  40   3.098  26.791 -14.927
 1002    HA   SER  40           HA       SER  40   5.324  28.652 -14.819
 1003   1HB   SER  40          2HB       SER  40   3.804  30.059 -16.556
 1004   2HB   SER  40          3HB       SER  40   5.150  29.035 -17.057
 1005    HG   SER  40           HG       SER  40   2.625  28.813 -17.755
 1006    H    GLY  41           H        GLY  41   4.548  30.902 -14.336
 1007   1HA   GLY  41          1HA       GLY  41   2.119  31.808 -13.657
 1008   2HA   GLY  41          2HA       GLY  41   2.472  30.732 -12.313
 1009    H    ASN  42           H        ASN  42   2.065  33.581 -12.206
 1010    HA   ASN  42           HA       ASN  42   4.428  34.272 -10.704
 1011   1HB   ASN  42          2HB       ASN  42   5.281  35.071 -12.750
 1012   2HB   ASN  42          3HB       ASN  42   3.715  35.695 -13.260
 1013   1HD2  ASN  42          1HD2      ASN  42   3.450  37.794 -13.098
 1014   2HD2  ASN  42          2HD2      ASN  42   4.322  38.854 -12.049
 1015    H    SER  43           H        SER  43   1.930  36.268 -12.261
 1016    HA   SER  43           HA       SER  43   0.287  37.594 -11.414
 1017   1HB   SER  43          2HB       SER  43   0.344  36.052  -8.836
 1018   2HB   SER  43          3HB       SER  43  -1.034  36.762  -9.675
 1019    HG   SER  43           HG       SER  43  -0.586  35.146 -11.354
 1020    H    ARG  44           H        ARG  44   1.113  39.573 -11.106
 1021    HA   ARG  44           HA       ARG  44   2.600  40.081  -8.615
 1022   1HB   ARG  44          2HB       ARG  44   3.481  40.541 -11.136
 1023   2HB   ARG  44          3HB       ARG  44   2.720  42.086 -10.782
 1024   1HG   ARG  44          2HG       ARG  44   4.298  42.675  -9.293
 1025   2HG   ARG  44          3HG       ARG  44   4.478  41.032  -8.673
 1026   1HD   ARG  44          2HD       ARG  44   5.587  40.554 -10.965
 1027   2HD   ARG  44          3HD       ARG  44   5.758  42.306 -11.062
 1028    HE   ARG  44           HE       ARG  44   7.255  40.512  -9.398
 1029   1HH1  ARG  44          2HH1      ARG  44   6.101  43.778  -9.751
 1030   2HH1  ARG  44          1HH1      ARG  44   7.350  44.464  -8.766
 1031   1HH2  ARG  44          2HH2      ARG  44   8.904  41.403  -8.099
 1032   2HH2  ARG  44          1HH2      ARG  44   8.945  43.113  -7.827
 1033    H    GLU  45           H        GLU  45   1.077  40.728  -7.189
 1034    HA   GLU  45           HA       GLU  45   0.020  43.312  -7.314
 1035   1HB   GLU  45          2HB       GLU  45  -1.471  41.581  -8.882
 1036   2HB   GLU  45          3HB       GLU  45  -2.369  41.640  -7.372
 1037   1HG   GLU  45          2HG       GLU  45  -1.900  44.260  -7.732
 1038   2HG   GLU  45          3HG       GLU  45  -1.944  43.721  -9.410
 1039    H    ARG  46           H        ARG  46  -2.176  43.206  -5.723
 1040    HA   ARG  46           HA       ARG  46  -1.050  42.137  -3.251
 1041   1HB   ARG  46          2HB       ARG  46  -1.944  44.545  -3.580
 1042   2HB   ARG  46          3HB       ARG  46  -3.537  43.813  -3.439
 1043   1HG   ARG  46          2HG       ARG  46  -3.134  43.120  -1.223
 1044   2HG   ARG  46          3HG       ARG  46  -1.404  43.440  -1.360
 1045   1HD   ARG  46          2HD       ARG  46  -3.516  45.577  -1.573
 1046   2HD   ARG  46          3HD       ARG  46  -2.717  45.145  -0.060
 1047    HE   ARG  46           HE       ARG  46  -0.770  45.702  -2.010
 1048   1HH1  ARG  46          2HH1      ARG  46  -3.187  47.308  -0.087
 1049   2HH1  ARG  46          1HH1      ARG  46  -2.344  48.822  -0.056
 1050   1HH2  ARG  46          2HH2      ARG  46   0.349  47.690  -1.977
 1051   2HH2  ARG  46          1HH2      ARG  46  -0.334  49.038  -1.132
 1052    H    CYS  47           H        CYS  47  -2.702  41.222  -1.569
 1053    HA   CYS  47           HA       CYS  47  -4.568  39.517  -3.053
 1054   1HB   CYS  47          2HB       CYS  47  -2.663  38.220  -2.197
 1055   2HB   CYS  47          3HB       CYS  47  -2.964  38.808  -0.574
 1056    H    GLN  48           H        GLN  48  -6.589  40.032  -2.558
 1057    HA   GLN  48           HA       GLN  48  -7.185  41.546  -0.133
 1058   1HB   GLN  48          2HB       GLN  48  -8.100  41.724  -2.754
 1059   2HB   GLN  48          3HB       GLN  48  -9.447  41.007  -1.880
 1060   1HG   GLN  48          2HG       GLN  48  -9.998  43.121  -1.431
 1061   2HG   GLN  48          3HG       GLN  48  -8.745  43.011  -0.197
 1062   1HE2  GLN  48          1HE2      GLN  48  -7.145  44.427  -0.270
 1063   2HE2  GLN  48          2HE2      GLN  48  -6.763  45.449  -1.609
 1064    H    LEU  49           H        LEU  49  -6.561  38.707   0.007
 1065    HA   LEU  49           HA       LEU  49  -9.095  37.769   1.174
 1066   1HB   LEU  49          2HB       LEU  49  -7.715  36.630  -0.992
 1067   2HB   LEU  49          3HB       LEU  49  -7.415  35.577   0.389
 1068    HG   LEU  49           HG       LEU  49 -10.213  36.402  -0.261
 1069   1HD1  LEU  49          1HD1      LEU  49  -9.009  33.952  -1.481
 1070   2HD1  LEU  49          2HD1      LEU  49  -8.934  35.501  -2.319
 1071   3HD1  LEU  49          3HD1      LEU  49 -10.498  34.799  -1.904
 1072   1HD2  LEU  49          1HD2      LEU  49 -10.475  35.126   1.554
 1073   2HD2  LEU  49          2HD2      LEU  49  -8.843  34.467   1.437
 1074   3HD2  LEU  49          3HD2      LEU  49 -10.149  33.762   0.484
 1075    H    CYS  50           H        CYS  50  -5.507  37.781   1.293
 1076    HA   CYS  50           HA       CYS  50  -5.785  37.024   4.104
 1077   1HB   CYS  50          2HB       CYS  50  -3.976  35.522   4.038
 1078   2HB   CYS  50          3HB       CYS  50  -4.945  35.108   2.639
 1079    H    ASN  51           H        ASN  51  -5.405  39.462   2.259
 1080    HA   ASN  51           HA       ASN  51  -4.334  41.469   2.302
 1081   1HB   ASN  51          2HB       ASN  51  -4.486  40.608   4.959
 1082   2HB   ASN  51          3HB       ASN  51  -2.824  41.152   4.756
 1083   1HD2  ASN  51          1HD2      ASN  51  -6.163  42.071   4.769
 1084   2HD2  ASN  51          2HD2      ASN  51  -5.907  43.779   4.787
 1085    H    GLY  52           H        GLY  52  -2.951  38.895   1.414
 1086   1HA   GLY  52          1HA       GLY  52  -0.191  39.099   1.924
 1087   2HA   GLY  52          2HA       GLY  52  -0.916  38.293   0.541
 1088    H    MET  53           H        MET  53   1.500  39.663   0.368
 1089    HA   MET  53           HA       MET  53   0.733  41.886  -1.399
 1090   1HB   MET  53          2HB       MET  53   1.709  42.721   0.739
 1091   2HB   MET  53          3HB       MET  53   3.184  41.840   0.367
 1092   1HG   MET  53          2HG       MET  53   3.128  43.208  -1.841
 1093   2HG   MET  53          3HG       MET  53   2.052  44.271  -0.936
 1094   1HE   MET  53          1HE       MET  53   5.098  43.778  -2.246
 1095   2HE   MET  53          2HE       MET  53   6.222  44.809  -1.362
 1096   3HE   MET  53          3HE       MET  53   6.104  43.093  -0.968
 1097    H    GLY  54           H        GLY  54   0.910  40.626  -3.248
 1098   1HA   GLY  54          1HA       GLY  54   3.089  40.587  -4.772
 1099   2HA   GLY  54          2HA       GLY  54   3.398  39.192  -3.748
 1100    H    HIS  55           H        HIS  55   1.121  37.881  -3.532
 1101    HA   HIS  55           HA       HIS  55   0.631  36.982  -6.252
 1102   1HB   HIS  55          2HB       HIS  55  -0.542  35.092  -5.164
 1103   2HB   HIS  55          3HB       HIS  55   1.107  35.287  -4.575
 1104    HD1  HIS  55           HD1      HIS  55   1.306  36.514  -2.176
 1105    HD2  HIS  55           HD2      HIS  55  -2.452  35.086  -3.222
 1106    HE1  HIS  55           HE1      HIS  55   0.002  36.419  -0.028
 1107    H    ASN  56           H        ASN  56  -1.852  36.006  -6.278
 1108    HA   ASN  56           HA       ASN  56  -3.560  38.364  -5.824
 1109   1HB   ASN  56          2HB       ASN  56  -2.962  37.063  -8.241
 1110   2HB   ASN  56          3HB       ASN  56  -4.606  36.578  -7.839
 1111   1HD2  ASN  56          1HD2      ASN  56  -3.185  38.543  -9.770
 1112   2HD2  ASN  56          2HD2      ASN  56  -4.167  39.961  -9.658
 1113    H    ALA  57           H        ALA  57  -5.745  37.998  -5.243
 1114    HA   ALA  57           HA       ALA  57  -6.181  36.062  -3.304
 1115   1HB   ALA  57          1HB       ALA  57  -7.577  38.238  -4.299
 1116   2HB   ALA  57          2HB       ALA  57  -8.651  36.867  -4.584
 1117   3HB   ALA  57          3HB       ALA  57  -8.061  37.201  -2.956
 1118    H    LYS  58           H        LYS  58  -7.081  36.046  -6.731
 1119    HA   LYS  58           HA       LYS  58  -8.564  33.673  -6.734
 1120   1HB   LYS  58          2HB       LYS  58  -8.088  35.507  -8.596
 1121   2HB   LYS  58          3HB       LYS  58  -6.867  34.342  -9.093
 1122   1HG   LYS  58          2HG       LYS  58  -8.921  32.676  -8.887
 1123   2HG   LYS  58          3HG       LYS  58  -9.821  34.162  -9.197
 1124   1HD   LYS  58          2HD       LYS  58  -9.469  33.553 -11.353
 1125   2HD   LYS  58          3HD       LYS  58  -7.941  34.395 -11.088
 1126   1HE   LYS  58          2HE       LYS  58  -6.730  32.467 -11.040
 1127   2HE   LYS  58          3HE       LYS  58  -8.057  31.523 -10.364
 1128   1HZ   LYS  58          1HZ       LYS  58  -7.571  30.874 -12.640
 1129   2HZ   LYS  58          2HZ       LYS  58  -7.859  32.451 -13.178
 1130   3HZ   LYS  58          3HZ       LYS  58  -9.125  31.535 -12.528
 1131    H    GLN  59           H        GLN  59  -5.166  34.217  -6.523
 1132    HA   GLN  59           HA       GLN  59  -4.673  31.335  -6.885
 1133   1HB   GLN  59          2HB       GLN  59  -3.378  33.575  -8.034
 1134   2HB   GLN  59          3HB       GLN  59  -2.245  32.859  -6.896
 1135   1HG   GLN  59          2HG       GLN  59  -1.754  31.736  -8.839
 1136   2HG   GLN  59          3HG       GLN  59  -2.876  30.630  -8.049
 1137   1HE2  GLN  59          1HE2      GLN  59  -4.312  29.794  -9.364
 1138   2HE2  GLN  59          2HE2      GLN  59  -4.987  30.553 -10.762
 1139    H    CYS  60           H        CYS  60  -5.506  33.063  -4.403
 1140    HA   CYS  60           HA       CYS  60  -3.171  32.757  -2.752
 1141   1HB   CYS  60          2HB       CYS  60  -4.615  34.712  -2.445
 1142   2HB   CYS  60          3HB       CYS  60  -5.985  33.681  -2.083
 1143    H    ARG  61           H        ARG  61  -2.940  31.190  -1.201
 1144    HA   ARG  61           HA       ARG  61  -3.973  28.655  -1.588
 1145   1HB   ARG  61          2HB       ARG  61  -2.334  29.986   0.414
 1146   2HB   ARG  61          3HB       ARG  61  -3.337  28.725   1.118
 1147   1HG   ARG  61          2HG       ARG  61  -2.453  27.185  -0.672
 1148   2HG   ARG  61          3HG       ARG  61  -1.288  28.452  -1.060
 1149   1HD   ARG  61          2HD       ARG  61  -0.010  27.938   0.695
 1150   2HD   ARG  61          3HD       ARG  61  -1.396  27.909   1.785
 1151    HE   ARG  61           HE       ARG  61  -0.089  25.663   0.627
 1152   1HH1  ARG  61          2HH1      ARG  61  -3.195  26.849   1.659
 1153   2HH1  ARG  61          1HH1      ARG  61  -3.839  25.271   1.973
 1154   1HH2  ARG  61          2HH2      ARG  61  -0.926  23.581   1.036
 1155   2HH2  ARG  61          1HH2      ARG  61  -2.547  23.413   1.618
 1156    H    LYS  62           H        LYS  62  -4.686  30.548   1.343
 1157    HA   LYS  62           HA       LYS  62  -7.477  30.476   1.121
 1158   1HB   LYS  62          2HB       LYS  62  -7.367  28.096   1.346
 1159   2HB   LYS  62          3HB       LYS  62  -6.252  28.215   2.700
 1160   1HG   LYS  62          2HG       LYS  62  -8.441  27.633   3.504
 1161   2HG   LYS  62          3HG       LYS  62  -8.036  29.264   4.039
 1162   1HD   LYS  62          2HD       LYS  62  -9.301  30.047   1.943
 1163   2HD   LYS  62          3HD       LYS  62  -9.955  28.409   1.897
 1164   1HE   LYS  62          2HE       LYS  62 -11.408  28.874   3.517
 1165   2HE   LYS  62          3HE       LYS  62 -10.129  29.502   4.556
 1166   1HZ   LYS  62          1HZ       LYS  62 -10.911  31.528   4.210
 1167   2HZ   LYS  62          2HZ       LYS  62 -12.112  30.928   3.180
 1168   3HZ   LYS  62          3HZ       LYS  62 -10.609  31.385   2.552
 1169    H    ARG  63           H        ARG  63  -8.444  31.667   2.721
 1170    HA   ARG  63           HA       ARG  63  -7.457  32.071   5.309
 1171   1HB   ARG  63          2HB       ARG  63  -5.888  33.398   3.455
 1172   2HB   ARG  63          3HB       ARG  63  -6.996  34.646   4.011
 1173   1HG   ARG  63          2HG       ARG  63  -5.771  32.997   6.119
 1174   2HG   ARG  63          3HG       ARG  63  -4.673  34.046   5.222
 1175   1HD   ARG  63          2HD       ARG  63  -5.822  35.983   5.860
 1176   2HD   ARG  63          3HD       ARG  63  -7.256  35.079   6.344
 1177    HE   ARG  63           HE       ARG  63  -6.289  34.692   8.392
 1178   1HH1  ARG  63          2HH1      ARG  63  -3.901  35.942   6.190
 1179   2HH1  ARG  63          1HH1      ARG  63  -2.703  36.180   7.418
 1180   1HH2  ARG  63          2HH2      ARG  63  -4.721  35.002  10.019
 1181   2HH2  ARG  63          1HH2      ARG  63  -3.170  35.644   9.596
 1182    H    ASP  64           H        ASP  64  -8.652  33.700   6.491
 1183    HA   ASP  64           HA       ASP  64 -11.331  33.994   5.457
 1184   1HB   ASP  64          2HB       ASP  64 -11.971  34.551   7.637
 1185   2HB   ASP  64          3HB       ASP  64 -10.639  33.426   7.883
  Start of MODEL    3
    1   1H5*    C 160          1H5*        C 160  25.966  16.792 -14.063
    2   2H5*    C 160          2H5*        C 160  24.614  17.505 -13.183
    3    H4*    C 160           H4*        C 160  25.730  16.174 -11.616
    4    H3*    C 160           H3*        C 160  26.384  19.083 -11.274
    5    H2*    C 160           H2*        C 160  27.714  18.577  -9.369
    6   2HO*    C 160          2HO*        C 160  27.665  16.006  -9.072
    7    H1*    C 160           H1*        C 160  29.117  16.535 -10.655
    8   1H4     C 160          1H4         C 160  32.580  21.881 -11.401
    9   2H4     C 160          2H4         C 160  31.833  22.078 -12.971
   10    H5     C 160           H5         C 160  30.070  20.724 -13.768
   11    H6     C 160           H6         C 160  28.575  18.829 -13.250
   12   1H5*    U 161          1H5*        U 161  25.010  18.030  -7.288
   13   2H5*    U 161          2H5*        U 161  24.045  19.389  -6.712
   14    H4*    U 161           H4*        U 161  25.959  18.917  -5.256
   15    H3*    U 161           H3*        U 161  25.845  21.584  -6.648
   16    H2*    U 161           H2*        U 161  27.748  22.287  -5.407
   17   2HO*    U 161          2HO*        U 161  27.274  21.327  -3.449
   18    H1*    U 161           H1*        U 161  29.170  19.923  -5.959
   19    H3     U 161           H3         U 161  31.114  23.513  -8.125
   20    H5     U 161           H5         U 161  28.253  21.973 -10.765
   21    H6     U 161           H6         U 161  27.443  20.578  -8.919
   22   1H5*    G 162          1H5*        G 162  25.773  22.549  -2.105
   23   2H5*    G 162          2H5*        G 162  24.709  23.955  -2.059
   24    H4*    G 162           H4*        G 162  26.869  24.359  -0.960
   25    H3*    G 162           H3*        G 162  26.094  26.020  -3.338
   26    H2*    G 162           H2*        G 162  28.054  27.347  -3.055
   27   2HO*    G 162          2HO*        G 162  28.816  25.695  -0.864
   28    H1*    G 162           H1*        G 162  29.740  25.128  -2.897
   29    H8     G 162           H8         G 162  27.170  24.257  -5.393
   30    H1     G 162           H1         G 162  31.660  28.276  -7.753
   31   1H2     G 162          1H2         G 162  32.801  29.020  -6.205
   32   2H2     G 162          2H2         G 162  32.574  28.616  -4.518
   33   1H5*    C 163          1H5*        C 163  27.256  28.525  -0.448
   34   2H5*    C 163          2H5*        C 163  26.088  29.751   0.045
   35    H4*    C 163           H4*        C 163  28.026  30.968  -0.329
   36    H3*    C 163           H3*        C 163  26.210  31.138  -2.710
   37    H2*    C 163           H2*        C 163  27.746  32.568  -3.818
   38   2HO*    C 163          2HO*        C 163  29.161  33.676  -2.536
   39    H1*    C 163           H1*        C 163  29.953  30.919  -3.234
   40   1H4     C 163          1H4         C 163  28.255  29.206  -9.142
   41   2H4     C 163          2H4         C 163  26.950  28.246  -8.484
   42    H5     C 163           H5         C 163  26.383  28.189  -6.191
   43    H6     C 163           H6         C 163  26.937  29.048  -3.944
   44   1H5*    C 164          1H5*        C 164  27.386  35.069  -1.658
   45   2H5*    C 164          2H5*        C 164  26.029  36.196  -1.666
   46    H4*    C 164           H4*        C 164  27.736  37.114  -3.038
   47    H3*    C 164           H3*        C 164  25.361  36.064  -4.537
   48    H2*    C 164           H2*        C 164  26.304  36.786  -6.597
   49   2HO*    C 164          2HO*        C 164  28.667  37.771  -5.876
   50    H1*    C 164           H1*        C 164  28.820  35.650  -5.996
   51   1H4     C 164          1H4         C 164  25.953  31.346  -9.742
   52   2H4     C 164          2H4         C 164  25.072  30.744  -8.356
   53    H5     C 164           H5         C 164  25.154  31.735  -6.213
   54    H6     C 164           H6         C 164  26.112  33.567  -4.861
   55   1H5*    C 165          1H5*        C 165  26.022  40.143  -5.694
   56   2H5*    C 165          2H5*        C 165  24.524  41.033  -5.964
   57    H4*    C 165           H4*        C 165  25.921  41.123  -7.934
   58    H3*    C 165           H3*        C 165  23.350  39.584  -8.173
   59    H2*    C 165           H2*        C 165  23.761  39.255 -10.490
   60   2HO*    C 165          2HO*        C 165  26.231  40.606 -10.377
   61    H1*    C 165           H1*        C 165  26.428  38.454 -10.056
   62   1H4     C 165          1H4         C 165  23.121  33.009 -10.574
   63   2H4     C 165          2H4         C 165  22.708  33.123  -8.878
   64    H5     C 165           H5         C 165  23.249  34.972  -7.512
   65    H6     C 165           H6         C 165  24.330  37.191  -7.438
   66   1H5*    U 166          1H5*        U 166  23.194  42.527 -11.276
   67   2H5*    U 166          2H5*        U 166  21.604  43.287 -11.317
   68    H4*    U 166           H4*        U 166  22.102  42.424 -13.491
   69    H3*    U 166           H3*        U 166  19.956  40.942 -11.994
   70    H2*    U 166           H2*        U 166  19.557  39.594 -13.912
   71   2HO*    U 166          2HO*        U 166  21.588  40.766 -15.431
   72    H1*    U 166           H1*        U 166  22.296  39.072 -14.300
   73    H3     U 166           H3         U 166  20.218  35.173 -13.019
   74    H5     U 166           H5         U 166  21.195  37.149  -9.458
   75    H6     U 166           H6         U 166  21.789  39.100 -10.819
   76   1H5*    C 167          1H5*        C 167  17.935  42.214 -15.701
   77   2H5*    C 167          2H5*        C 167  16.410  42.935 -15.186
   78    H4*    C 167           H4*        C 167  15.939  41.276 -16.834
   79    H3*    C 167           H3*        C 167  15.137  40.506 -14.037
   80    H2*    C 167           H2*        C 167  14.110  38.541 -14.892
   81   2HO*    C 167          2HO*        C 167  14.481  38.536 -17.452
   82    H1*    C 167           H1*        C 167  16.342  37.887 -16.481
   83   1H4     C 167          1H4         C 167  16.961  34.432 -11.132
   84   2H4     C 167          2H4         C 167  17.805  35.776 -10.398
   85    H5     C 167           H5         C 167  18.048  37.893 -11.420
   86    H6     C 167           H6         C 167  17.537  39.252 -13.417
   87   1H5*    A 168          1H5*        A 168  13.312  44.210 -13.841
   88   2H5*    A 168          2H5*        A 168  11.817  43.821 -12.990
   89    H4*    A 168           H4*        A 168  11.028  44.931 -15.456
   90    H3*    A 168           H3*        A 168  13.399  46.398 -14.296
   91    H2*    A 168           H2*        A 168  12.361  48.413 -14.734
   92   2HO*    A 168          2HO*        A 168  10.911  48.458 -16.579
   93    H1*    A 168           H1*        A 168   9.708  47.051 -14.634
   94    H8     A 168           H8         A 168  10.850  50.050 -14.175
   95   1H6     A 168          1H6         A 168   9.056  50.560  -8.219
   96   2H6     A 168          2H6         A 168   9.552  51.464  -9.632
   97    H2     A 168           H2         A 168   9.091  46.250  -9.295
   98   1H5*    U 169          1H5*        U 169  16.055  47.402 -16.995
   99   2H5*    U 169          2H5*        U 169  16.288  47.121 -18.720
  100    H4*    U 169           H4*        U 169  17.306  45.054 -16.824
  101    H3*    U 169           H3*        U 169  18.520  47.805 -17.101
  102    H2*    U 169           H2*        U 169  20.648  46.855 -16.993
  103   2HO*    U 169          2HO*        U 169  20.829  45.202 -15.573
  104    H1*    U 169           H1*        U 169  19.641  44.422 -18.318
  105    H3     U 169           H3         U 169  23.373  45.038 -20.775
  106    H5     U 169           H5         U 169  21.127  48.486 -21.548
  107    H6     U 169           H6         U 169  19.534  47.709 -19.853
  108   1H5*    C 170          1H5*        C 170  16.319  48.447 -15.188
  109   2H5*    C 170          2H5*        C 170  16.451  49.990 -14.344
  110    H4*    C 170           H4*        C 170  14.325  48.981 -13.850
  111    H3*    C 170           H3*        C 170  16.273  49.080 -11.555
  112    H2*    C 170           H2*        C 170  14.573  48.274 -10.107
  113   2HO*    C 170          2HO*        C 170  12.664  48.061 -12.147
  114    H1*    C 170           H1*        C 170  13.798  46.241 -11.902
  115   1H4     C 170          1H4         C 170  17.690  43.365  -7.729
  116   2H4     C 170          2H4         C 170  19.065  43.919  -8.658
  117    H5     C 170           H5         C 170  18.901  45.372 -10.512
  118    H6     C 170           H6         C 170  17.361  46.665 -11.946
  119   1H5*    C 171          1H5*        C 171  13.288  52.193 -11.843
  120   2H5*    C 171          2H5*        C 171  13.446  53.913 -11.489
  121    H4*    C 171           H4*        C 171  12.080  53.128  -9.787
  122    H3*    C 171           H3*        C 171  14.924  53.254  -8.786
  123    H2*    C 171           H2*        C 171  14.144  52.694  -6.621
  124   2HO*    C 171          2HO*        C 171  12.286  53.875  -6.487
  125    H1*    C 171           H1*        C 171  12.396  50.685  -7.648
  126   1H4     C 171          1H4         C 171  17.447  47.607  -5.191
  127   2H4     C 171          2H4         C 171  18.235  47.747  -6.746
  128    H5     C 171           H5         C 171  17.360  48.983  -8.558
  129    H6     C 171           H6         C 171  15.494  50.403  -9.332
  130   1H5*    G 172          1H5*        G 172  12.519  55.882  -6.074
  131   2H5*    G 172          2H5*        G 172  13.415  57.400  -6.067
  132    H4*    G 172           H4*        G 172  12.995  56.936  -3.815
  133    H3*    G 172           H3*        G 172  15.809  56.259  -4.594
  134    H2*    G 172           H2*        G 172  16.302  55.609  -2.354
  135   2HO*    G 172          2HO*        G 172  14.678  56.079  -0.755
  136    H1*    G 172           H1*        G 172  14.067  53.949  -2.163
  137    H8     G 172           H8         G 172  15.550  53.829  -5.604
  138    H1     G 172           H1         G 172  18.426  49.856  -1.382
  139   1H2     G 172          1H2         G 172  17.739  50.259   0.521
  140   2H2     G 172          2H2         G 172  16.559  51.489   0.914
  141   1H5*    U 173          1H5*        U 173  15.987  58.333  -1.183
  142   2H5*    U 173          2H5*        U 173  16.977  59.793  -1.190
  143    H4*    U 173           H4*        U 173  17.735  58.637   0.670
  144    H3*    U 173           H3*        U 173  19.564  58.112  -1.659
  145    H2*    U 173           H2*        U 173  20.991  56.845  -0.244
  146   2HO*    U 173          2HO*        U 173  19.198  57.416   1.911
  147    H1*    U 173           H1*        U 173  18.861  55.378   0.858
  148    H3     U 173           H3         U 173  21.065  52.296  -1.636
  149    H5     U 173           H5         U 173  19.015  54.609  -4.463
  150    H6     U 173           H6         U 173  18.392  56.116  -2.631
  151   1H5*    C 174          1H5*        C 174  21.877  59.377   1.513
  152   2H5*    C 174          2H5*        C 174  23.067  60.617   1.119
  153    H4*    C 174           H4*        C 174  24.246  58.872   2.177
  154    H3*    C 174           H3*        C 174  24.674  58.961  -0.791
  155    H2*    C 174           H2*        C 174  26.191  57.144  -0.660
  156   2HO*    C 174          2HO*        C 174  27.267  57.053   1.225
  157    H1*    C 174           H1*        C 174  24.469  55.663   1.043
  158   1H4     C 174          1H4         C 174  23.564  53.108  -4.735
  159   2H4     C 174          2H4         C 174  22.545  54.463  -5.168
  160    H5     C 174           H5         C 174  22.201  56.346  -3.784
  161    H6     C 174           H6         C 174  22.755  57.404  -1.622
  162   1H5*    U 175          1H5*        U 175  28.108  61.782   2.295
  163   2H5*    U 175          2H5*        U 175  26.783  62.498   1.376
  164    H4*    U 175           H4*        U 175  28.228  63.902   0.159
  165    H3*    U 175           H3*        U 175  30.496  62.135   1.095
  166    H2*    U 175           H2*        U 175  31.954  63.947   0.834
  167   2HO*    U 175          2HO*        U 175  31.512  65.184  -0.905
  168    H1*    U 175           H1*        U 175  29.854  65.810   1.662
  169    H3     U 175           H3         U 175  33.067  67.163   4.509
  170    H5     U 175           H5         U 175  32.464  63.162   5.591
  171    H6     U 175           H6         U 175  30.943  62.977   3.676
  172   1H5*    C 176          1H5*        C 176  29.614  59.487  -1.096
  173   2H5*    C 176          2H5*        C 176  29.715  59.486   0.664
  174    H4*    C 176           H4*        C 176  31.681  57.978   0.518
  175    H3*    C 176           H3*        C 176  31.260  58.292  -2.425
  176    H2*    C 176           H2*        C 176  31.759  56.002  -2.811
  177   2HO*    C 176          2HO*        C 176  32.834  54.895  -1.182
  178    H1*    C 176           H1*        C 176  30.036  55.101  -0.791
  179   1H4     C 176          1H4         C 176  26.722  54.868  -6.277
  180   2H4     C 176          2H4         C 176  26.071  56.443  -5.885
  181    H5     C 176           H5         C 176  26.793  57.747  -4.053
  182    H6     C 176           H6         C 176  28.334  57.862  -2.127
  183   1H5*    G 177          1H5*        G 177  35.086  56.238  -2.210
  184   2H5*    G 177          2H5*        G 177  36.237  57.371  -2.919
  185    H4*    G 177           H4*        G 177  36.696  55.325  -3.949
  186    H3*    G 177           H3*        G 177  35.126  57.160  -5.715
  187    H2*    G 177           H2*        G 177  35.107  55.544  -7.466
  188   2HO*    G 177          2HO*        G 177  36.278  53.426  -6.552
  189    H1*    G 177           H1*        G 177  34.195  53.498  -5.803
  190    H8     G 177           H8         G 177  32.511  56.601  -4.699
  191    H1     G 177           H1         G 177  29.846  54.053 -10.019
  192   1H2     G 177          1H2         G 177  31.078  52.578 -10.767
  193   2H2     G 177          2H2         G 177  32.604  52.103 -10.060
  194   1H5*    C 178          1H5*        C 178  38.352  55.850  -8.118
  195   2H5*    C 178          2H5*        C 178  39.073  57.187  -9.014
  196    H4*    C 178           H4*        C 178  38.374  55.466 -10.544
  197    H3*    C 178           H3*        C 178  36.828  58.040 -10.655
  198    H2*    C 178           H2*        C 178  35.589  57.226 -12.508
  199   2HO*    C 178          2HO*        C 178  36.577  54.750 -12.806
  200    H1*    C 178           H1*        C 178  35.132  54.719 -11.266
  201   1H4     C 178          1H4         C 178  29.734  57.994 -10.318
  202   2H4     C 178          2H4         C 178  30.493  58.843  -8.991
  203    H5     C 178           H5         C 178  32.770  58.605  -8.408
  204    H6     C 178           H6         C 178  34.899  57.482  -8.960
  205   1H5*    U 179          1H5*        U 179  38.651  57.671 -14.797
  206   2H5*    U 179          2H5*        U 179  38.901  59.332 -15.335
  207    H4*    U 179           H4*        U 179  37.430  57.988 -16.817
  208    H3*    U 179           H3*        U 179  36.425  60.534 -15.571
  209    H2*    U 179           H2*        U 179  34.412  60.344 -16.816
  210   2HO*    U 179          2HO*        U 179  34.616  58.146 -18.201
  211    H1*    U 179           H1*        U 179  34.067  57.630 -16.157
  212    H3     U 179           H3         U 179  30.787  60.121 -14.092
  213    H5     U 179           H5         U 179  34.055  60.152 -11.473
  214    H6     U 179           H6         U 179  35.378  59.131 -13.269
  215   1H5*    U 180          1H5*        U 180  35.805  60.791 -19.457
  216   2H5*    U 180          2H5*        U 180  36.206  62.276 -20.318
  217    H4*    U 180           H4*        U 180  33.903  61.841 -20.682
  218    H3*    U 180           H3*        U 180  34.453  64.127 -18.823
  219    H2*    U 180           H2*        U 180  32.133  64.553 -18.592
  220   2HO*    U 180          2HO*        U 180  31.096  64.103 -20.443
  221    H1*    U 180           H1*        U 180  31.533  61.801 -18.219
  222    H3     U 180           H3         U 180  30.412  63.533 -14.196
  223    H5     U 180           H5         U 180  34.594  63.761 -14.236
  224    H6     U 180           H6         U 180  34.512  63.027 -16.575
  225   1H5*    A 181          1H5*        A 181  34.025  66.816 -22.854
  226   2H5*    A 181          2H5*        A 181  34.905  68.213 -22.235
  227    H4*    A 181           H4*        A 181  32.427  68.517 -22.615
  228    H3*    A 181           H3*        A 181  33.756  69.171 -19.994
  229    H2*    A 181           H2*        A 181  31.705  70.061 -19.193
  230   2HO*    A 181          2HO*        A 181  30.200  70.664 -20.718
  231    H1*    A 181           H1*        A 181  30.204  67.854 -20.054
  232    H8     A 181           H8         A 181  33.550  66.849 -18.685
  233   1H6     A 181          1H6         A 181  30.804  66.616 -13.086
  234   2H6     A 181          2H6         A 181  32.273  66.245 -13.960
  235    H2     A 181           H2         A 181  27.936  68.412 -15.966
  236   1H5*    U 182          1H5*        U 182  33.872  73.728 -18.935
  237   2H5*    U 182          2H5*        U 182  32.214  73.541 -18.366
  238    H4*    U 182           H4*        U 182  33.317  75.292 -20.502
  239    H3*    U 182           H3*        U 182  31.321  75.568 -18.266
  240    H2*    U 182           H2*        U 182  30.261  77.329 -19.405
  241   2HO*    U 182          2HO*        U 182  31.715  77.783 -21.544
  242    H1*    U 182           H1*        U 182  30.646  75.993 -21.955
  243    H3     U 182           H3         U 182  26.174  76.669 -22.005
  244    H5     U 182           H5         U 182  26.717  73.878 -18.931
  245    H6     U 182           H6         U 182  29.134  74.181 -19.218
  246   1H5*    U 183          1H5*        U 183  33.546  75.371 -15.883
  247   2H5*    U 183          2H5*        U 183  34.311  76.303 -14.597
  248    H4*    U 183           H4*        U 183  35.551  74.870 -16.912
  249    H3*    U 183           H3*        U 183  35.991  74.958 -13.935
  250    H2*    U 183           H2*        U 183  38.242  74.474 -14.221
  251   2HO*    U 183          2HO*        U 183  38.634  72.946 -15.734
  252    H1*    U 183           H1*        U 183  38.195  75.812 -16.866
  253    H3     U 183           H3         U 183  42.172  77.053 -14.928
  254    H5     U 183           H5         U 183  39.236  79.349 -13.018
  255    H6     U 183           H6         U 183  37.558  77.963 -14.150
  256   1H5*    C 184          1H5*        C 184  34.995  69.745 -13.039
  257   2H5*    C 184          2H5*        C 184  33.277  69.811 -13.431
  258    H4*    C 184           H4*        C 184  34.729  71.030 -11.093
  259    H3*    C 184           H3*        C 184  32.524  69.010 -11.418
  260    H2*    C 184           H2*        C 184  31.467  69.774  -9.514
  261   2HO*    C 184          2HO*        C 184  33.329  69.446  -8.252
  262    H1*    C 184           H1*        C 184  32.769  72.436  -9.878
  263   1H4     C 184          1H4         C 184  26.128  72.599 -10.696
  264   2H4     C 184          2H4         C 184  26.536  73.978  -9.700
  265    H5     C 184           H5         C 184  28.734  74.492  -9.002
  266    H6     C 184           H6         C 184  31.103  73.801  -9.088
  267   1H5*    G 185          1H5*        G 185  32.917  66.052  -9.544
  268   2H5*    G 185          2H5*        G 185  33.825  67.150  -8.506
  269    H4*    G 185           H4*        G 185  33.939  64.159  -8.673
  270    H3*    G 185           H3*        G 185  33.432  66.181  -6.520
  271    H2*    G 185           H2*        G 185  34.342  64.710  -4.881
  272   2HO*    G 185          2HO*        G 185  33.797  62.698  -5.534
  273    H1*    G 185           H1*        G 185  36.666  64.233  -6.349
  274    H8     G 185           H8         G 185  34.772  67.557  -5.962
  275    H1     G 185           H1         G 185  40.400  67.146  -2.793
  276   1H2     G 185          1H2         G 185  41.230  65.284  -3.103
  277   2H2     G 185          2H2         G 185  40.508  64.022  -4.076
  278   1H5*    G 186          1H5*        G 186  28.355  65.584  -5.943
  279   2H5*    G 186          2H5*        G 186  29.125  67.169  -6.026
  280    H4*    G 186           H4*        G 186  28.386  65.524  -3.650
  281    H3*    G 186           H3*        G 186  28.001  68.351  -4.545
  282    H2*    G 186           H2*        G 186  27.960  69.118  -2.289
  283   2HO*    G 186          2HO*        G 186  27.804  67.526  -0.649
  284    H1*    G 186           H1*        G 186  30.322  67.792  -1.617
  285    H8     G 186           H8         G 186  28.883  70.129  -4.232
  286    H1     G 186           H1         G 186  34.808  71.712  -2.167
  287   1H2     G 186          1H2         G 186  35.534  70.217  -0.947
  288   2H2     G 186          2H2         G 186  34.667  68.752  -0.544
  289   1H5*    G 187          1H5*        G 187  23.665  65.660  -5.328
  290   2H5*    G 187          2H5*        G 187  25.264  66.343  -5.620
  291    H4*    G 187           H4*        G 187  22.707  67.815  -6.271
  292    H3*    G 187           H3*        G 187  24.100  65.710  -7.861
  293    H2*    G 187           H2*        G 187  23.887  66.970  -9.872
  294   2HO*    G 187          2HO*        G 187  22.740  69.138  -9.472
  295    H1*    G 187           H1*        G 187  24.956  69.284  -8.740
  296    H8     G 187           H8         G 187  26.863  66.524  -7.237
  297    H1     G 187           H1         G 187  28.692  67.752 -13.321
  298   1H2     G 187          1H2         G 187  27.316  69.001 -14.215
  299   2H2     G 187          2H2         G 187  25.881  69.624 -13.432
  300   1H5*    G 188          1H5*        G 188  21.238  67.069 -10.547
  301   2H5*    G 188          2H5*        G 188  20.072  65.751 -10.653
  302    H4*    G 188           H4*        G 188  20.433  66.310 -12.868
  303    H3*    G 188           H3*        G 188  22.161  63.962 -12.134
  304    H2*    G 188           H2*        G 188  22.910  63.821 -14.392
  305   2HO*    G 188          2HO*        G 188  21.584  66.056 -15.322
  306    H1*    G 188           H1*        G 188  23.527  66.544 -14.531
  307    H8     G 188           H8         G 188  24.477  65.526 -11.132
  308    H1     G 188           H1         G 188  28.745  63.540 -15.573
  309   1H2     G 188          1H2         G 188  27.939  63.775 -17.457
  310   2H2     G 188          2H2         G 188  26.344  64.415 -17.785
  311   1H5*    A 189          1H5*        A 189  20.188  62.213 -15.987
  312   2H5*    A 189          2H5*        A 189  19.931  60.606 -15.306
  313    H4*    A 189           H4*        A 189  21.331  60.700 -17.389
  314    H3*    A 189           H3*        A 189  22.321  59.383 -14.870
  315    H2*    A 189           H2*        A 189  24.244  58.628 -16.041
  316   2HO*    A 189          2HO*        A 189  23.815  59.714 -18.480
  317    H1*    A 189           H1*        A 189  24.731  61.143 -17.201
  318    H8     A 189           H8         A 189  23.608  61.430 -13.637
  319   1H6     A 189          1H6         A 189  29.618  60.869 -12.051
  320   2H6     A 189          2H6         A 189  28.019  61.229 -11.441
  321    H2     A 189           H2         A 189  29.245  60.040 -16.401
  322   1H5*    G 190          1H5*        G 190  22.451  56.308 -18.200
  323   2H5*    G 190          2H5*        G 190  21.930  54.809 -17.430
  324    H4*    G 190           H4*        G 190  24.027  54.497 -18.612
  325    H3*    G 190           H3*        G 190  24.066  54.221 -15.621
  326    H2*    G 190           H2*        G 190  26.351  53.550 -15.713
  327   2HO*    G 190          2HO*        G 190  27.080  52.782 -17.655
  328    H1*    G 190           H1*        G 190  27.098  55.705 -17.321
  329    H8     G 190           H8         G 190  24.537  56.965 -14.967
  330    H1     G 190           H1         G 190  30.386  56.410 -12.253
  331   1H2     G 190          1H2         G 190  31.630  55.347 -13.508
  332   2H2     G 190          2H2         G 190  31.158  54.701 -15.064
  333   1H5*    C 191          1H5*        C 191  25.455  50.272 -17.053
  334   2H5*    C 191          2H5*        C 191  24.951  49.071 -15.863
  335    H4*    C 191           H4*        C 191  27.404  49.213 -16.160
  336    H3*    C 191           H3*        C 191  26.188  49.732 -13.457
  337    H2*    C 191           H2*        C 191  28.365  49.872 -12.518
  338   2HO*    C 191          2HO*        C 191  29.589  49.460 -15.028
  339    H1*    C 191           H1*        C 191  29.296  51.586 -14.550
  340   1H4     C 191          1H4         C 191  27.664  55.396  -9.673
  341   2H4     C 191          2H4         C 191  26.040  55.467 -10.318
  342    H5     C 191           H5         C 191  25.296  54.184 -12.156
  343    H6     C 191           H6         C 191  25.935  52.500 -13.846
  344   1H5*    G 192          1H5*        G 192  29.364  46.708 -12.726
  345   2H5*    G 192          2H5*        G 192  28.466  45.425 -11.916
  346    H4*    G 192           H4*        G 192  30.410  45.865 -10.626
  347    H3*    G 192           H3*        G 192  27.864  46.873  -9.388
  348    H2*    G 192           H2*        G 192  29.073  47.528  -7.443
  349   2HO*    G 192          2HO*        G 192  31.589  46.991  -8.029
  350    H1*    G 192           H1*        G 192  31.019  48.896  -8.902
  351    H8     G 192           H8         G 192  27.744  49.388 -10.586
  352    H1     G 192           H1         G 192  28.589  53.276  -5.481
  353   1H2     G 192          1H2         G 192  30.248  52.666  -4.419
  354   2H2     G 192          2H2         G 192  31.259  51.304  -4.847
  355   1H5*    G 193          1H5*        G 193  29.976  44.487  -6.443
  356   2H5*    G 193          2H5*        G 193  28.813  43.481  -5.581
  357    H4*    G 193           H4*        G 193  30.187  44.785  -4.047
  358    H3*    G 193           H3*        G 193  27.234  45.328  -4.118
  359    H2*    G 193           H2*        G 193  27.467  46.856  -2.306
  360   2HO*    G 193          2HO*        G 193  29.951  46.996  -1.693
  361    H1*    G 193           H1*        G 193  29.567  48.238  -3.516
  362    H8     G 193           H8         G 193  27.237  47.281  -6.222
  363    H1     G 193           H1         G 193  25.186  52.410  -2.850
  364   1H2     G 193          1H2         G 193  26.329  52.616  -1.145
  365   2H2     G 193          2H2         G 193  27.647  51.557  -0.697
  366   1H5*    A 194          1H5*        A 194  27.962  44.487   0.128
  367   2H5*    A 194          2H5*        A 194  26.898  43.128   0.482
  368    H4*    A 194           H4*        A 194  26.524  44.722   2.176
  369    H3*    A 194           H3*        A 194  24.317  44.642   0.139
  370    H2*    A 194           H2*        A 194  23.085  46.239   1.401
  371   2HO*    A 194          2HO*        A 194  25.121  46.509   3.323
  372    H1*    A 194           H1*        A 194  25.247  47.981   1.664
  373    H8     A 194           H8         A 194  25.231  46.282  -1.685
  374   1H6     A 194          1H6         A 194  21.609  50.968  -3.653
  375   2H6     A 194          2H6         A 194  22.520  49.567  -4.169
  376    H2     A 194           H2         A 194  22.055  51.312   0.756
  377   1H5*    C 195          1H5*        C 195  22.793  44.325   3.933
  378   2H5*    C 195          2H5*        C 195  21.565  43.090   4.206
  379    H4*    C 195           H4*        C 195  20.663  45.118   5.001
  380    H3*    C 195           H3*        C 195  19.495  44.236   2.386
  381    H2*    C 195           H2*        C 195  18.041  46.110   2.352
  382   2HO*    C 195          2HO*        C 195  17.846  47.321   4.307
  383    H1*    C 195           H1*        C 195  20.118  47.908   3.038
  384   1H4     C 195          1H4         C 195  19.542  48.502  -3.291
  385   2H4     C 195          2H4         C 195  20.440  47.017  -3.506
  386    H5     C 195           H5         C 195  21.138  45.631  -1.726
  387    H6     C 195           H6         C 195  21.146  45.325   0.725
  388   1H5*    G 196          1H5*        G 196  15.317  44.201   4.940
  389   2H5*    G 196          2H5*        G 196  14.962  42.590   4.317
  390    H4*    G 196           H4*        G 196  13.121  44.129   3.907
  391    H3*    G 196           H3*        G 196  14.569  43.006   1.526
  392    H2*    G 196           H2*        G 196  12.994  44.056   0.079
  393   2HO*    G 196          2HO*        G 196  11.103  44.925   1.047
  394    H1*    G 196           H1*        G 196  13.248  46.540   1.327
  395    H8     G 196           H8         G 196  16.478  44.598   1.113
  396    H1     G 196           H1         G 196  15.226  48.267  -4.070
  397   1H2     G 196          1H2         G 196  13.317  49.033  -3.927
  398   2H2     G 196          2H2         G 196  12.218  48.726  -2.600
  399   1H5*    A 197          1H5*        A 197  12.544  37.984   1.490
  400   2H5*    A 197          2H5*        A 197  12.712  39.260   0.284
  401    H4*    A 197           H4*        A 197  10.302  37.820   1.220
  402    H3*    A 197           H3*        A 197  11.320  38.922  -1.388
  403    H2*    A 197           H2*        A 197   9.167  39.207  -2.167
  404   2HO*    A 197          2HO*        A 197   8.531  37.090  -1.900
  405    H1*    A 197           H1*        A 197   8.185  39.364   0.651
  406    H8     A 197           H8         A 197   9.423  41.333  -2.376
  407   1H6     A 197          1H6         A 197   5.103  45.555  -0.807
  408   2H6     A 197          2H6         A 197   6.305  45.135  -2.007
  409    H2     A 197           H2         A 197   5.156  42.394   2.315
  410   1H5*    U 198          1H5*        U 198  11.258  34.175   0.467
  411   2H5*    U 198          2H5*        U 198  12.563  35.317   0.787
  412    H4*    U 198           H4*        U 198  13.836  33.287  -0.597
  413    H3*    U 198           H3*        U 198  11.472  32.101   0.639
  414    H2*    U 198           H2*        U 198  12.608  31.485   2.542
  415   2HO*    U 198          2HO*        U 198  14.030  30.040   0.494
  416    H1*    U 198           H1*        U 198  15.195  31.913   0.950
  417    H3     U 198           H3         U 198  18.181  31.913   4.278
  418    H5     U 198           H5         U 198  14.546  32.231   6.335
  419    H6     U 198           H6         U 198  13.432  32.323   4.152
  420   1H5*    G 199          1H5*        G 199  10.473  32.131  -2.963
  421   2H5*    G 199          2H5*        G 199  10.758  33.173  -1.569
  422    H4*    G 199           H4*        G 199   8.682  33.852  -2.366
  423    H3*    G 199           H3*        G 199   8.353  31.988  -0.031
  424    H2*    G 199           H2*        G 199   5.994  32.310  -0.110
  425   2HO*    G 199          2HO*        G 199   5.217  34.025  -1.407
  426    H1*    G 199           H1*        G 199   5.843  31.805  -2.852
  427    H8     G 199           H8         G 199   8.349  29.752  -0.869
  428    H1     G 199           H1         G 199   2.481  27.079  -1.413
  429   1H2     G 199          1H2         G 199   1.193  28.420  -2.307
  430   2H2     G 199          2H2         G 199   1.638  30.029  -2.831
  431   1H5*    A 200          1H5*        A 200   7.867  36.165   3.329
  432   2H5*    A 200          2H5*        A 200   9.593  36.518   3.242
  433    H4*    A 200           H4*        A 200   8.712  35.732   5.475
  434    H3*    A 200           H3*        A 200  11.061  34.437   4.110
  435    H2*    A 200           H2*        A 200  11.402  33.069   6.020
  436   2HO*    A 200          2HO*        A 200   9.390  33.798   7.625
  437    H1*    A 200           H1*        A 200   8.700  32.348   6.209
  438    H8     A 200           H8         A 200   9.623  32.467   2.619
  439   1H6     A 200          1H6         A 200  11.807  26.656   3.259
  440   2H6     A 200          2H6         A 200  11.411  27.901   2.096
  441    H2     A 200           H2         A 200  10.912  28.258   7.305
  442   1H5*    C 201          1H5*        C 201  14.153  36.361   8.747
  443   2H5*    C 201          2H5*        C 201  14.323  35.029   7.602
  444    H4*    C 201           H4*        C 201  11.619  35.679   8.726
  445    H3*    C 201           H3*        C 201  13.838  34.270  10.216
  446    H2*    C 201           H2*        C 201  12.207  32.905  11.243
  447   2HO*    C 201          2HO*        C 201  10.169  33.757  11.431
  448    H1*    C 201           H1*        C 201  10.749  32.644   8.778
  449   1H4     C 201          1H4         C 201  13.579  26.985   9.668
  450   2H4     C 201          2H4         C 201  15.066  27.650   9.033
  451    H5     C 201           H5         C 201  15.357  29.927   8.474
  452    H6     C 201           H6         C 201  14.279  32.147   8.386
  453   1H5*    C 202          1H5*        C 202  11.052  35.793  13.347
  454   2H5*    C 202          2H5*        C 202  12.035  36.246  14.740
  455    H4*    C 202           H4*        C 202  10.342  34.656  15.397
  456    H3*    C 202           H3*        C 202  13.187  33.677  15.492
  457    H2*    C 202           H2*        C 202  12.442  31.661  16.498
  458   2HO*    C 202          2HO*        C 202  10.095  31.637  17.065
  459    H1*    C 202           H1*        C 202  10.310  31.385  14.642
  460   1H4     C 202          1H4         C 202  14.899  27.417  12.613
  461   2H4     C 202          2H4         C 202  15.628  28.751  11.747
  462    H5     C 202           H5         C 202  14.880  30.985  11.901
  463    H6     C 202           H6         C 202  13.231  32.506  12.933
  464   1H5*    C 203          1H5*        C 203  11.962  33.613  19.924
  465   2H5*    C 203          2H5*        C 203  13.495  33.822  20.770
  466    H4*    C 203           H4*        C 203  12.316  31.710  21.315
  467    H3*    C 203           H3*        C 203  15.092  31.630  20.152
  468    H2*    C 203           H2*        C 203  15.144  29.276  20.498
  469   2HO*    C 203          2HO*        C 203  13.671  28.425  21.949
  470    H1*    C 203           H1*        C 203  12.613  28.899  19.334
  471   1H4     C 203          1H4         C 203  16.811  27.736  14.652
  472   2H4     C 203          2H4         C 203  16.840  29.447  14.288
  473    H5     C 203           H5         C 203  15.735  31.087  15.580
  474    H6     C 203           H6         C 203  14.318  31.492  17.561
  475   1H5*    U 204          1H5*        U 204  14.640  29.715  23.665
  476   2H5*    U 204          2H5*        U 204  15.882  29.651  24.915
  477    H4*    U 204           H4*        U 204  15.213  27.418  24.284
  478    H3*    U 204           H3*        U 204  18.014  28.236  23.570
  479    H2*    U 204           H2*        U 204  18.458  26.028  22.797
  480   2HO*    U 204          2HO*        U 204  17.315  24.589  23.948
  481    H1*    U 204           H1*        U 204  16.153  25.923  21.228
  482    H3     U 204           H3         U 204  19.914  26.302  18.565
  483    H5     U 204           H5         U 204  18.630  30.213  19.336
  484    H6     U 204           H6         U 204  17.083  29.273  20.990
  485   1H5*    A 205          1H5*        A 205  19.021  26.217  27.805
  486   2H5*    A 205          2H5*        A 205  20.687  26.769  27.983
  487    H4*    A 205           H4*        A 205  20.233  24.325  27.284
  488    H3*    A 205           H3*        A 205  22.277  26.146  26.034
  489    H2*    A 205           H2*        A 205  23.035  24.348  24.682
  490   2HO*    A 205          2HO*        A 205  21.381  22.362  25.390
  491    H1*    A 205           H1*        A 205  20.459  23.596  23.895
  492    H8     A 205           H8         A 205  20.410  27.271  23.993
  493   1H6     A 205          1H6         A 205  23.133  27.257  18.377
  494   2H6     A 205          2H6         A 205  22.331  28.265  19.561
  495    H2     A 205           H2         A 205  23.283  23.125  20.005
  496   1H5*    G 206          1H5*        G 206  26.116  26.594  26.760
  497   2H5*    G 206          2H5*        G 206  25.474  27.079  25.191
  498    H4*    G 206           H4*        G 206  27.754  26.012  25.174
  499    H3*    G 206           H3*        G 206  25.492  25.024  23.461
  500    H2*    G 206           H2*        G 206  26.960  23.456  22.430
  501   2HO*    G 206          2HO*        G 206  28.901  24.451  22.327
  502    H1*    G 206           H1*        G 206  27.917  22.482  24.859
  503    H8     G 206           H8         G 206  24.680  23.246  23.045
  504    H1     G 206           H1         G 206  24.696  17.640  26.280
  505   1H2     G 206          1H2         G 206  26.418  17.500  27.406
  506   2H2     G 206          2H2         G 206  27.670  18.721  27.466
  507   1H5*    U 207          1H5*        U 207  26.097  25.871  18.963
  508   2H5*    U 207          2H5*        U 207  27.800  25.998  18.520
  509    H4*    U 207           H4*        U 207  26.054  27.647  17.515
  510    H3*    U 207           H3*        U 207  28.817  28.333  18.487
  511    H2*    U 207           H2*        U 207  28.504  30.577  17.783
  512   2HO*    U 207          2HO*        U 207  26.552  30.991  16.505
  513    H1*    U 207           H1*        U 207  25.997  30.826  18.976
  514    H3     U 207           H3         U 207  28.349  33.276  21.915
  515    H5     U 207           H5         U 207  29.877  29.417  22.481
  516    H6     U 207           H6         U 207  28.477  28.694  20.603
  517   1H5*    A 208          1H5*        A 208  30.964  29.252  13.676
  518   2H5*    A 208          2H5*        A 208  29.708  28.952  12.475
  519    H4*    A 208           H4*        A 208  31.623  27.702  11.839
  520    H3*    A 208           H3*        A 208  29.327  26.094  12.865
  521    H2*    A 208           H2*        A 208  30.531  24.057  12.595
  522   2HO*    A 208          2HO*        A 208  32.888  24.630  11.760
  523    H1*    A 208           H1*        A 208  32.783  25.017  13.955
  524    H8     A 208           H8         A 208  29.202  25.836  15.041
  525   1H6     A 208          1H6         A 208  30.019  21.400  19.354
  526   2H6     A 208          2H6         A 208  28.908  22.615  18.763
  527    H2     A 208           H2         A 208  33.647  21.534  16.794
  528   1H5*    G 209          1H5*        G 209  29.133  24.500   9.521
  529   2H5*    G 209          2H5*        G 209  27.521  24.050   8.964
  530    H4*    G 209           H4*        G 209  28.617  22.416  10.510
  531    H3*    G 209           H3*        G 209  25.906  23.574  11.092
  532    H2*    G 209           H2*        G 209  25.710  22.154  12.995
  533   2HO*    G 209          2HO*        G 209  28.026  20.894  13.110
  534    H1*    G 209           H1*        G 209  28.213  22.867  14.000
  535    H8     G 209           H8         G 209  26.801  25.935  12.513
  536    H1     G 209           H1         G 209  24.240  24.562  18.296
  537   1H2     G 209          1H2         G 209  24.780  22.652  18.853
  538   2H2     G 209          2H2         G 209  25.779  21.581  17.895
  539   1H5*    A 210          1H5*        A 210  25.604  19.530  12.328
  540   2H5*    A 210          2H5*        A 210  24.233  18.906  11.410
  541    H4*    A 210           H4*        A 210  23.896  18.451  13.740
  542    H3*    A 210           H3*        A 210  22.071  20.556  12.587
  543    H2*    A 210           H2*        A 210  20.861  20.576  14.628
  544   2HO*    A 210          2HO*        A 210  21.036  18.777  15.926
  545    H1*    A 210           H1*        A 210  23.208  20.670  16.194
  546    H8     A 210           H8         A 210  23.463  22.899  13.208
  547   1H6     A 210          1H6         A 210  20.712  27.312  16.660
  548   2H6     A 210          2H6         A 210  21.535  27.003  15.148
  549    H2     A 210           H2         A 210  20.509  23.474  18.890
  550   1H5*    G 211          1H5*        G 211  20.101  17.377  14.434
  551   2H5*    G 211          2H5*        G 211  18.590  16.831  13.706
  552    H4*    G 211           H4*        G 211  18.260  17.291  16.050
  553    H3*    G 211           H3*        G 211  16.879  19.139  14.121
  554    H2*    G 211           H2*        G 211  15.786  20.211  15.947
  555   2HO*    G 211          2HO*        G 211  16.829  18.996  18.072
  556    H1*    G 211           H1*        G 211  18.160  20.544  17.385
  557    H8     G 211           H8         G 211  19.086  21.114  13.877
  558    H1     G 211           H1         G 211  15.922  26.149  16.429
  559   1H2     G 211          1H2         G 211  15.081  25.594  18.228
  560   2H2     G 211          2H2         G 211  15.213  24.002  18.940
  561   1H5*    G 212          1H5*        G 212  13.179  17.277  16.420
  562   2H5*    G 212          2H5*        G 212  12.150  17.063  15.005
  563    H4*    G 212           H4*        G 212  11.049  18.336  16.790
  564    H3*    G 212           H3*        G 212  11.512  19.654  14.130
  565    H2*    G 212           H2*        G 212  10.297  21.566  14.867
  566   2HO*    G 212          2HO*        G 212   9.539  21.215  17.259
  567    H1*    G 212           H1*        G 212  11.740  21.777  17.247
  568    H8     G 212           H8         G 212  14.122  20.691  14.630
  569    H1     G 212           H1         G 212  12.834  27.029  14.382
  570   1H2     G 212          1H2         G 212  11.228  27.453  15.604
  571   2H2     G 212          2H2         G 212  10.359  26.269  16.554
  572   1H5*    G 213          1H5*        G 213   7.193  19.927  14.956
  573   2H5*    G 213          2H5*        G 213   6.336  19.625  13.444
  574    H4*    G 213           H4*        G 213   5.643  21.728  14.454
  575    H3*    G 213           H3*        G 213   7.034  21.826  11.797
  576    H2*    G 213           H2*        G 213   6.691  24.181  11.693
  577   2HO*    G 213          2HO*        G 213   4.619  24.061  12.683
  578    H1*    G 213           H1*        G 213   7.704  24.611  14.260
  579    H8     G 213           H8         G 213   9.803  21.948  12.844
  580    H1     G 213           H1         G 213  11.281  27.776  10.450
  581   1H2     G 213          1H2         G 213   9.808  29.125  10.963
  582   2H2     G 213          2H2         G 213   8.385  28.736  11.902
  583   1H5*    G 214          1H5*        G 214   5.251  24.813  10.143
  584   2H5*    G 214          2H5*        G 214   4.734  24.059   8.635
  585    H4*    G 214           H4*        G 214   6.608  25.726   8.450
  586    H3*    G 214           H3*        G 214   6.815  22.936   7.355
  587    H2*    G 214           H2*        G 214   8.941  23.463   6.418
  588   2HO*    G 214          2HO*        G 214   8.686  25.560   5.793
  589    H1*    G 214           H1*        G 214   9.924  24.535   8.796
  590    H8     G 214           H8         G 214   7.839  21.702   9.850
  591    H1     G 214           H1         G 214  13.523  19.795   7.415
  592   1H2     G 214          1H2         G 214  14.438  21.384   6.473
  593   2H2     G 214          2H2         G 214  13.764  22.995   6.360
  594   1H5*    G 215          1H5*        G 215   7.596  25.478   2.872
  595   2H5*    G 215          2H5*        G 215   6.254  24.438   2.400
  596    H4*    G 215           H4*        G 215   8.308  24.301   0.960
  597    H3*    G 215           H3*        G 215   7.058  21.869   2.211
  598    H2*    G 215           H2*        G 215   8.606  20.482   1.046
  599   2HO*    G 215          2HO*        G 215   9.841  21.462  -0.618
  600    H1*    G 215           H1*        G 215  10.820  21.979   1.854
  601    H8     G 215           H8         G 215   8.284  21.819   4.599
  602    H1     G 215           H1         G 215  12.150  16.636   4.333
  603   1H2     G 215          1H2         G 215  13.258  16.691   2.595
  604   2H2     G 215          2H2         G 215  13.153  17.953   1.388
  605   1H5*    C 216          1H5*        C 216   5.362  21.420  -1.981
  606   2H5*    C 216          2H5*        C 216   3.909  20.437  -1.802
  607    H4*    C 216           H4*        C 216   5.929  19.261  -2.730
  608    H3*    C 216           H3*        C 216   4.494  18.210  -0.292
  609    H2*    C 216           H2*        C 216   5.829  16.255  -0.413
  610   2HO*    C 216          2HO*        C 216   5.797  16.002  -2.641
  611    H1*    C 216           H1*        C 216   8.194  17.765  -0.902
  612   1H4     C 216          1H4         C 216   8.359  16.014   5.262
  613   2H4     C 216          2H4         C 216   7.547  17.512   5.657
  614    H5     C 216           H5         C 216   6.705  19.017   4.044
  615    H6     C 216           H6         C 216   6.431  19.461   1.630
  616   1H5*    U 217          1H5*        U 217   3.693  15.132  -3.453
  617   2H5*    U 217          2H5*        U 217   2.300  14.180  -2.939
  618    H4*    U 217           H4*        U 217   4.469  12.931  -3.093
  619    H3*    U 217           H3*        U 217   2.840  12.961  -0.562
  620    H2*    U 217           H2*        U 217   4.331  11.366   0.388
  621   2HO*    U 217          2HO*        U 217   5.847  10.370  -1.043
  622    H1*    U 217           H1*        U 217   6.608  12.827  -0.355
  623    H3     U 217           H3         U 217   6.198  13.059   4.212
  624    H5     U 217           H5         U 217   3.768  16.128   2.722
  625    H6     U 217           H6         U 217   4.127  15.191   0.485
  626   1H5*    G 218          1H5*        G 218  -0.135   8.788  -1.050
  627   2H5*    G 218          2H5*        G 218   1.090   9.830  -0.327
  628    H4*    G 218           H4*        G 218   1.524   7.289  -1.146
  629    H3*    G 218           H3*        G 218   3.474   9.593  -0.942
  630    H2*    G 218           H2*        G 218   5.193   8.100  -1.531
  631   2HO*    G 218          2HO*        G 218   4.926   6.090  -0.734
  632    H1*    G 218           H1*        G 218   3.472   6.725  -3.406
  633    H8     G 218           H8         G 218   3.689  10.434  -3.842
  634    H1     G 218           H1         G 218   8.388   7.184  -6.881
  635   1H2     G 218          1H2         G 218   8.353   5.208  -6.290
  636   2H2     G 218          2H2         G 218   7.220   4.533  -5.142
  637   1H5*    C 219          1H5*        C 219   4.484   7.227   2.111
  638   2H5*    C 219          2H5*        C 219   4.123   5.791   3.069
  639    H4*    C 219           H4*        C 219   4.818   7.024   4.798
  640    H3*    C 219           H3*        C 219   2.009   7.949   4.400
  641    H2*    C 219           H2*        C 219   2.260   9.715   5.945
  642   2HO*    C 219          2HO*        C 219   4.931   8.970   6.508
  643    H1*    C 219           H1*        C 219   4.734  10.564   4.948
  644   1H4     C 219          1H4         C 219   0.054  14.034   2.179
  645   2H4     C 219          2H4         C 219   0.442  13.170   0.708
  646    H5     C 219           H5         C 219   1.930  11.338   0.612
  647    H6     C 219           H6         C 219   3.426   9.869   1.916
  648   1H5*    G 220          1H5*        G 220   4.551   4.000   6.721
  649   2H5*    G 220          2H5*        G 220   4.960   5.670   6.327
  650    H4*    G 220           H4*        G 220   6.272   3.250   5.545
  651    H3*    G 220           H3*        G 220   6.852   6.194   5.154
  652    H2*    G 220           H2*        G 220   8.697   5.581   3.835
  653   2HO*    G 220          2HO*        G 220   8.496   2.842   4.249
  654    H1*    G 220           H1*        G 220   7.232   3.336   2.717
  655    H8     G 220           H8         G 220   7.118   3.871   0.265
  656    H1     G 220           H1         G 220   7.112  10.257   1.317
  657   1H2     G 220          1H2         G 220   7.068  10.621   3.346
  658   2H2     G 220          2H2         G 220   7.038   9.379   4.579
  659   1H5*    G 221          1H5*        G 221  10.075   5.120   6.586
  660   2H5*    G 221          2H5*        G 221  11.179   6.258   7.358
  661    H4*    G 221           H4*        G 221  11.130   5.782   4.717
  662    H3*    G 221           H3*        G 221  11.944   8.237   6.243
  663    H2*    G 221           H2*        G 221  12.408   9.369   4.210
  664   2HO*    G 221          2HO*        G 221  12.253   8.002   2.240
  665    H1*    G 221           H1*        G 221  10.003   8.700   3.010
  666    H8     G 221           H8         G 221   9.792   9.241   6.753
  667    H1     G 221           H1         G 221   8.878  14.577   3.207
  668   1H2     G 221          1H2         G 221   9.275  14.164   1.226
  669   2H2     G 221          2H2         G 221   9.781  12.604   0.617
  670   1H5*    C 222          1H5*        C 222  15.136   8.080   3.105
  671   2H5*    C 222          2H5*        C 222  16.464   8.836   3.985
  672    H4*    C 222           H4*        C 222  15.459  10.036   1.930
  673    H3*    C 222           H3*        C 222  16.068  11.389   4.562
  674    H2*    C 222           H2*        C 222  15.590  13.464   3.539
  675   2HO*    C 222          2HO*        C 222  15.020  12.562   1.013
  676    H1*    C 222           H1*        C 222  13.308  12.409   2.184
  677   1H4     C 222          1H4         C 222  11.099  15.872   7.104
  678   2H4     C 222          2H4         C 222  11.149  14.423   8.083
  679    H5     C 222           H5         C 222  12.075  12.375   7.356
  680    H6     C 222           H6         C 222  13.193  11.203   5.492
  681   1H5*    U 223          1H5*        U 223  17.381  14.231   1.991
  682   2H5*    U 223          2H5*        U 223  18.966  14.722   2.586
  683    H4*    U 223           H4*        U 223  17.319  16.560   2.550
  684    H3*    U 223           H3*        U 223  18.520  15.743   5.195
  685    H2*    U 223           H2*        U 223  17.416  17.519   6.234
  686   2HO*    U 223          2HO*        U 223  16.951  19.338   4.964
  687    H1*    U 223           H1*        U 223  15.133  17.264   4.431
  688    H3     U 223           H3         U 223  13.309  17.356   8.619
  689    H5     U 223           H5         U 223  14.974  13.530   8.261
  690    H6     U 223           H6         U 223  15.998  14.279   6.163
  691   1H5*    U 224          1H5*        U 224  20.329  21.010   3.407
  692   2H5*    U 224          2H5*        U 224  18.987  20.077   4.071
  693    H4*    U 224           H4*        U 224  20.443  18.964   1.713
  694    H3*    U 224           H3*        U 224  18.836  21.477   1.619
  695    H2*    U 224           H2*        U 224  17.633  20.762  -0.282
  696   2HO*    U 224          2HO*        U 224  18.462  18.600  -1.165
  697    H1*    U 224           H1*        U 224  16.984  18.273   0.667
  698    H3     U 224           H3         U 224  13.061  20.157   1.712
  699    H5     U 224           H5         U 224  15.753  22.272   4.126
  700    H6     U 224           H6         U 224  17.557  21.003   3.056
  701   1H5*    A 225          1H5*        A 225  20.761  21.220  -2.505
  702   2H5*    A 225          2H5*        A 225  20.497  22.802  -3.240
  703    H4*    A 225           H4*        A 225  19.250  20.784  -4.209
  704    H3*    A 225           H3*        A 225  17.954  23.420  -3.545
  705    H2*    A 225           H2*        A 225  15.927  22.640  -4.503
  706   2HO*    A 225          2HO*        A 225  16.220  20.332  -5.447
  707    H1*    A 225           H1*        A 225  16.035  20.176  -3.163
  708    H8     A 225           H8         A 225  17.198  22.895  -0.898
  709   1H6     A 225          1H6         A 225  11.201  23.854   0.544
  710   2H6     A 225          2H6         A 225  12.846  24.267   0.975
  711    H2     A 225           H2         A 225  11.372  21.046  -2.895
  712   1H5*    G 226          1H5*        G 226  17.679  22.052  -7.347
  713   2H5*    G 226          2H5*        G 226  17.644  23.044  -8.804
  714    H4*    G 226           H4*        G 226  15.737  21.615  -8.830
  715    H3*    G 226           H3*        G 226  15.114  24.507  -8.283
  716    H2*    G 226           H2*        G 226  12.787  24.003  -8.373
  717   2HO*    G 226          2HO*        G 226  12.969  21.293  -8.695
  718    H1*    G 226           H1*        G 226  13.035  21.824  -6.629
  719    H8     G 226           H8         G 226  15.311  24.370  -5.292
  720    H1     G 226           H1         G 226   9.110  25.722  -4.022
  721   1H2     G 226          1H2         G 226   7.893  24.501  -5.154
  722   2H2     G 226          2H2         G 226   8.468  23.291  -6.279
  723   1H5*    G 227          1H5*        G 227  13.589  24.522 -12.478
  724   2H5*    G 227          2H5*        G 227  15.016  23.676 -13.076
  725    H4*    G 227           H4*        G 227  14.245  24.848 -14.928
  726    H3*    G 227           H3*        G 227  16.531  26.277 -13.623
  727    H2*    G 227           H2*        G 227  16.442  28.001 -15.265
  728   2HO*    G 227          2HO*        G 227  15.159  27.616 -17.114
  729    H1*    G 227           H1*        G 227  13.698  28.400 -14.947
  730    H8     G 227           H8         G 227  15.263  27.610 -11.648
  731    H1     G 227           H1         G 227  15.823  33.828 -13.353
  732   1H2     G 227          1H2         G 227  15.237  34.059 -15.317
  733   2H2     G 227          2H2         G 227  14.676  32.762 -16.348
  734   1H5*    A 228          1H5*        A 228  17.256  26.037 -17.794
  735   2H5*    A 228          2H5*        A 228  18.922  25.607 -18.174
  736    H4*    A 228           H4*        A 228  18.317  27.622 -19.341
  737    H3*    A 228           H3*        A 228  20.351  27.924 -17.148
  738    H2*    A 228           H2*        A 228  20.634  30.213 -17.724
  739   2HO*    A 228          2HO*        A 228  20.295  30.584 -19.836
  740    H1*    A 228           H1*        A 228  17.891  30.737 -17.776
  741    H8     A 228           H8         A 228  18.614  28.334 -15.024
  742   1H6     A 228          1H6         A 228  19.929  33.276 -11.448
  743   2H6     A 228          2H6         A 228  19.669  31.547 -11.435
  744    H2     A 228           H2         A 228  19.481  34.675 -15.642
  745   1H5*    G 229          1H5*        G 229  22.332  29.558 -20.846
  746   2H5*    G 229          2H5*        G 229  23.976  28.924 -20.766
  747    H4*    G 229           H4*        G 229  23.988  31.332 -21.055
  748    H3*    G 229           H3*        G 229  25.073  30.242 -18.475
  749    H2*    G 229           H2*        G 229  25.730  32.438 -17.822
  750   2HO*    G 229          2HO*        G 229  26.114  33.790 -19.486
  751    H1*    G 229           H1*        G 229  23.229  33.539 -18.388
  752    H8     G 229           H8         G 229  22.513  30.207 -17.011
  753    H1     G 229           H1         G 229  24.182  34.460 -12.426
  754   1H2     G 229          1H2         G 229  24.961  36.153 -13.308
  755   2H2     G 229          2H2         G 229  25.135  36.386 -15.033
  756   1H5*    G 230          1H5*        G 230  28.165  32.901 -20.266
  757   2H5*    G 230          2H5*        G 230  29.708  32.079 -20.035
  758    H4*    G 230           H4*        G 230  29.790  34.369 -19.216
  759    H3*    G 230           H3*        G 230  30.117  32.144 -17.230
  760    H2*    G 230           H2*        G 230  30.531  33.732 -15.502
  761   2HO*    G 230          2HO*        G 230  30.708  35.985 -16.204
  762    H1*    G 230           H1*        G 230  28.273  35.251 -16.122
  763    H8     G 230           H8         G 230  27.273  31.748 -16.653
  764    H1     G 230           H1         G 230  27.456  33.345 -10.384
  765   1H2     G 230          1H2         G 230  28.409  35.160 -10.163
  766   2H2     G 230          2H2         G 230  29.061  36.109 -11.481
  767   1H5*    G 231          1H5*        G 231  33.659  34.791 -16.718
  768   2H5*    G 231          2H5*        G 231  35.043  33.706 -16.591
  769    H4*    G 231           H4*        G 231  35.003  35.269 -14.739
  770    H3*    G 231           H3*        G 231  34.579  32.364 -14.098
  771    H2*    G 231           H2*        G 231  34.578  32.878 -11.771
  772   2HO*    G 231          2HO*        G 231  34.760  35.603 -11.962
  773    H1*    G 231           H1*        G 231  32.717  34.939 -12.052
  774    H8     G 231           H8         G 231  31.752  32.276 -14.434
  775    H1     G 231           H1         G 231  29.972  30.973  -8.350
  776   1H2     G 231          1H2         G 231  30.885  32.303  -7.066
  777   2H2     G 231          2H2         G 231  31.971  33.582  -7.564
  778   1H5*    C 232          1H5*        C 232  37.776  33.644 -11.540
  779   2H5*    C 232          2H5*        C 232  39.028  32.401 -11.513
  780    H4*    C 232           H4*        C 232  38.302  32.886  -9.267
  781    H3*    C 232           H3*        C 232  37.607  30.168 -10.338
  782    H2*    C 232           H2*        C 232  36.701  29.557  -8.229
  783   2HO*    C 232          2HO*        C 232  37.103  32.012  -7.005
  784    H1*    C 232           H1*        C 232  35.228  31.954  -8.008
  785   1H4     C 232          1H4         C 232  31.031  27.668 -10.201
  786   2H4     C 232          2H4         C 232  31.646  27.914 -11.820
  787    H5     C 232           H5         C 232  33.512  29.271 -12.327
  788    H6     C 232           H6         C 232  35.267  30.737 -11.395
  789   1H5*    A 233          1H5*        A 233  39.984  29.498  -6.616
  790   2H5*    A 233          2H5*        A 233  40.938  28.037  -6.868
  791    H4*    A 233           H4*        A 233  39.529  27.887  -4.875
  792    H3*    A 233           H3*        A 233  39.032  25.961  -7.130
  793    H2*    A 233           H2*        A 233  37.415  24.830  -5.806
  794   2HO*    A 233          2HO*        A 233  37.878  24.927  -3.689
  795    H1*    A 233           H1*        A 233  36.106  27.186  -5.058
  796    H8     A 233           H8         A 233  37.226  27.451  -8.604
  797   1H6     A 233          1H6         A 233  31.923  24.561 -10.179
  798   2H6     A 233          2H6         A 233  33.310  25.420 -10.810
  799    H2     A 233           H2         A 233  32.352  24.369  -5.760
  800   1H5*    G 234          1H5*        G 234  39.786  23.129  -3.566
  801   2H5*    G 234          2H5*        G 234  41.083  22.175  -4.285
  802    H4*    G 234           H4*        G 234  39.510  20.641  -3.420
  803    H3*    G 234           H3*        G 234  39.421  20.872  -6.413
  804    H2*    G 234           H2*        G 234  37.785  19.141  -6.504
  805   2HO*    G 234          2HO*        G 234  37.299  18.094  -4.423
  806    H1*    G 234           H1*        G 234  36.165  20.336  -4.572
  807    H8     G 234           H8         G 234  37.706  22.987  -6.692
  808    H1     G 234           H1         G 234  32.484  20.266  -9.375
  809   1H2     G 234          1H2         G 234  31.942  18.597  -8.291
  810   2H2     G 234          2H2         G 234  32.779  18.022  -6.866
  811   1H    GLY  15          1H        GLY  15   6.899  -4.049   1.078
  812   1HA   GLY  15          1HA       GLY  15   5.911  -2.290  -0.782
  813   2HA   GLY  15          2HA       GLY  15   5.686  -2.098   0.950
  814    H    ARG  16           H        ARG  16   8.409  -1.718  -1.326
  815    HA   ARG  16           HA       ARG  16   8.696   1.053  -0.415
  816   1HB   ARG  16          2HB       ARG  16  10.649  -1.146  -0.076
  817   2HB   ARG  16          3HB       ARG  16  11.300   0.383  -0.651
  818   1HG   ARG  16          2HG       ARG  16  10.281   1.509   1.295
  819   2HG   ARG  16          3HG       ARG  16   9.738  -0.064   1.883
  820   1HD   ARG  16          2HD       ARG  16  12.599   0.132   1.210
  821   2HD   ARG  16          3HD       ARG  16  12.072   1.096   2.589
  822    HE   ARG  16           HE       ARG  16  10.998  -1.378   3.024
  823   1HH1  ARG  16          2HH1      ARG  16  14.204  -0.137   2.477
  824   2HH1  ARG  16          1HH1      ARG  16  14.981  -1.368   3.417
  825   1HH2  ARG  16          2HH2      ARG  16  12.010  -3.003   4.264
  826   2HH2  ARG  16          1HH2      ARG  16  13.732  -2.997   4.433
  827    H    ALA  17           H        ALA  17   9.579   2.461  -1.924
  828    HA   ALA  17           HA       ALA  17  10.468   1.415  -4.490
  829   1HB   ALA  17          1HB       ALA  17   8.248   1.523  -5.109
  830   2HB   ALA  17          2HB       ALA  17   7.926   2.934  -4.099
  831   3HB   ALA  17          3HB       ALA  17   8.841   3.112  -5.598
  832    H    ARG  18           H        ARG  18  11.336   3.152  -2.101
  833    HA   ARG  18           HA       ARG  18  11.687   5.794  -2.806
  834   1HB   ARG  18          2HB       ARG  18  12.698   4.047  -0.835
  835   2HB   ARG  18          3HB       ARG  18  14.097   4.810  -1.581
  836   1HG   ARG  18          2HG       ARG  18  11.853   6.589  -0.859
  837   2HG   ARG  18          3HG       ARG  18  12.766   5.877   0.472
  838   1HD   ARG  18          2HD       ARG  18  14.087   7.273  -1.840
  839   2HD   ARG  18          3HD       ARG  18  13.567   8.127  -0.388
  840    HE   ARG  18           HE       ARG  18  15.146   5.947   0.379
  841   1HH1  ARG  18          2HH1      ARG  18  15.446   8.998  -1.272
  842   2HH1  ARG  18          1HH1      ARG  18  17.099   9.233  -0.810
  843   1HH2  ARG  18          2HH2      ARG  18  17.323   6.245   0.993
  844   2HH2  ARG  18          1HH2      ARG  18  18.166   7.666   0.477
  845    H    GLY  19           H        GLY  19  12.988   6.914  -4.157
  846   1HA   GLY  19          1HA       GLY  19  14.932   7.256  -5.471
  847   2HA   GLY  19          2HA       GLY  19  15.193   5.519  -5.493
  848    H    LEU  20           H        LEU  20  12.239   5.205  -6.143
  849    HA   LEU  20           HA       LEU  20  12.520   5.733  -9.024
  850   1HB   LEU  20          2HB       LEU  20  11.465   3.489  -7.453
  851   2HB   LEU  20          3HB       LEU  20  10.466   3.958  -8.828
  852    HG   LEU  20           HG       LEU  20  13.276   3.698  -9.535
  853   1HD1  LEU  20          1HD1      LEU  20  12.796   1.955  -7.628
  854   2HD1  LEU  20          2HD1      LEU  20  13.694   1.498  -9.075
  855   3HD1  LEU  20          3HD1      LEU  20  11.986   1.086  -8.932
  856   1HD2  LEU  20          1HD2      LEU  20  12.287   2.270 -11.297
  857   2HD2  LEU  20          2HD2      LEU  20  11.528   3.858 -11.186
  858   3HD2  LEU  20          3HD2      LEU  20  10.716   2.443 -10.517
  859    H    CYS  21           H        CYS  21  11.238   7.303  -9.925
  860    HA   CYS  21           HA       CYS  21   9.285   8.563  -8.342
  861   1HB   CYS  21          2HB       CYS  21  10.627   9.681 -10.133
  862   2HB   CYS  21          3HB       CYS  21   9.712   8.797 -11.339
  863    H    TYR  22           H        TYR  22   7.018   8.585  -8.727
  864    HA   TYR  22           HA       TYR  22   5.975   6.156 -10.030
  865   1HB   TYR  22          2HB       TYR  22   5.411   5.785  -7.831
  866   2HB   TYR  22          3HB       TYR  22   5.282   7.500  -7.461
  867    HD1  TYR  22           HD1      TYR  22   3.576   4.920  -9.566
  868    HD2  TYR  22           HD2      TYR  22   3.173   8.360  -7.093
  869    HE1  TYR  22           HE1      TYR  22   1.130   4.774  -9.770
  870    HE2  TYR  22           HE2      TYR  22   0.725   8.223  -7.291
  871    HH   TYR  22           HH       TYR  22  -0.991   7.168  -8.222
  872    H    THR  23           H        THR  23   5.793   9.591  -9.771
  873    HA   THR  23           HA       THR  23   3.234  10.003 -10.897
  874    HB   THR  23           HB       THR  23   5.595  11.873 -11.136
  875    HG1  THR  23           HG1      THR  23   3.854  11.323  -8.968
  876   1HG2  THR  23          1HG2      THR  23   3.264  13.304 -10.665
  877   2HG2  THR  23          2HG2      THR  23   2.770  12.035 -11.785
  878   3HG2  THR  23          3HG2      THR  23   4.088  13.125 -12.213
  879    H    CYS  24           H        CYS  24   6.536   9.798 -12.380
  880    HA   CYS  24           HA       CYS  24   5.168   9.760 -14.970
  881   1HB   CYS  24          2HB       CYS  24   7.250  10.511 -15.973
  882   2HB   CYS  24          3HB       CYS  24   6.757  11.623 -14.711
  883    H    GLY  25           H        GLY  25   7.518   8.277 -12.813
  884   1HA   GLY  25          1HA       GLY  25   7.741   5.900 -12.634
  885   2HA   GLY  25          2HA       GLY  25   7.292   5.766 -14.328
  886    H    SER  26           H        SER  26   9.658   8.021 -13.025
  887    HA   SER  26           HA       SER  26  11.688   6.748 -14.716
  888   1HB   SER  26          2HB       SER  26  11.086   9.262 -14.852
  889   2HB   SER  26          3HB       SER  26  12.005   9.415 -13.354
  890    HG   SER  26           HG       SER  26  13.011   9.517 -15.693
  891    HA   PRO  27           HA       PRO  27  13.439   5.075 -10.970
  892   1HB   PRO  27          2HB       PRO  27  15.517   3.821 -12.187
  893   2HB   PRO  27          3HB       PRO  27  13.870   3.181 -12.199
  894   1HG   PRO  27          2HG       PRO  27  15.317   4.726 -14.316
  895   2HG   PRO  27          3HG       PRO  27  14.274   3.302 -14.486
  896   1HD   PRO  27          2HD       PRO  27  13.405   5.814 -15.001
  897   2HD   PRO  27          3HD       PRO  27  12.339   4.548 -14.359
  898    H    GLY  28           H        GLY  28  14.125   7.032 -10.018
  899   1HA   GLY  28          1HA       GLY  28  16.801   7.402  -9.587
  900   2HA   GLY  28          2HA       GLY  28  16.446   8.428 -10.969
  901    H    HIS  29           H        HIS  29  14.349   9.785 -10.601
  902    HA   HIS  29           HA       HIS  29  14.754  11.191  -8.069
  903   1HB   HIS  29          2HB       HIS  29  13.640  13.064  -9.094
  904   2HB   HIS  29          3HB       HIS  29  14.837  12.447 -10.229
  905    HD1  HIS  29           HD1      HIS  29  14.015  12.013 -12.527
  906    HD2  HIS  29           HD2      HIS  29  10.918  12.111  -9.759
  907    HE1  HIS  29           HE1      HIS  29  11.902  11.819 -13.876
  908    H    TYR  30           H        TYR  30  12.441  12.425  -7.579
  909    HA   TYR  30           HA       TYR  30  10.405  10.313  -7.378
  910   1HB   TYR  30          2HB       TYR  30  11.938  11.312  -5.236
  911   2HB   TYR  30          3HB       TYR  30  10.339  12.026  -5.063
  912    HD1  TYR  30           HD1      TYR  30  11.916   8.709  -5.760
  913    HD2  TYR  30           HD2      TYR  30   8.743  10.839  -3.890
  914    HE1  TYR  30           HE1      TYR  30  11.093   6.609  -4.778
  915    HE2  TYR  30           HE2      TYR  30   7.912   8.746  -2.901
  916    HH   TYR  30           HH       TYR  30   9.433   6.222  -2.393
  917    H    GLN  31           H        GLN  31   8.301  11.379  -6.422
  918    HA   GLN  31           HA       GLN  31   7.244  13.069  -8.325
  919   1HB   GLN  31          2HB       GLN  31   5.777  11.836  -6.897
  920   2HB   GLN  31          3HB       GLN  31   6.422  12.615  -5.459
  921   1HG   GLN  31          2HG       GLN  31   5.247  14.546  -5.804
  922   2HG   GLN  31          3HG       GLN  31   5.155  14.307  -7.547
  923   1HE2  GLN  31          1HE2      GLN  31   3.297  13.625  -8.343
  924   2HE2  GLN  31          2HE2      GLN  31   2.020  12.885  -7.445
  925    H    ALA  32           H        ALA  32   8.682  13.910  -5.202
  926    HA   ALA  32           HA       ALA  32   8.120  16.647  -5.216
  927   1HB   ALA  32          1HB       ALA  32   9.363  14.951  -3.492
  928   2HB   ALA  32          2HB       ALA  32  10.719  15.918  -4.072
  929   3HB   ALA  32          3HB       ALA  32   9.329  16.707  -3.327
  930    H    GLN  33           H        GLN  33  10.420  14.806  -7.024
  931    HA   GLN  33           HA       GLN  33  11.531  17.308  -8.114
  932   1HB   GLN  33          2HB       GLN  33  12.926  14.660  -7.698
  933   2HB   GLN  33          3HB       GLN  33  13.609  16.007  -8.599
  934   1HG   GLN  33          2HG       GLN  33  12.962  17.219  -6.265
  935   2HG   GLN  33          3HG       GLN  33  13.366  15.596  -5.709
  936   1HE2  GLN  33          1HE2      GLN  33  14.600  18.018  -7.994
  937   2HE2  GLN  33          2HE2      GLN  33  16.262  17.830  -7.559
  938    H    CYS  34           H        CYS  34   9.145  15.630  -8.993
  939    HA   CYS  34           HA       CYS  34  10.083  14.351 -11.375
  940   1HB   CYS  34          2HB       CYS  34   8.114  13.543 -10.041
  941   2HB   CYS  34          3HB       CYS  34   7.229  14.968 -10.548
  942    HA   PRO  35           HA       PRO  35  10.125  18.187 -13.655
  943   1HB   PRO  35          2HB       PRO  35  10.592  17.069 -16.085
  944   2HB   PRO  35          3HB       PRO  35  11.846  17.249 -14.852
  945   1HG   PRO  35          2HG       PRO  35  10.216  14.840 -15.560
  946   2HG   PRO  35          3HG       PRO  35  11.949  14.952 -15.206
  947   1HD   PRO  35          2HD       PRO  35  10.141  14.098 -13.379
  948   2HD   PRO  35          3HD       PRO  35  11.609  14.989 -12.926
  949    H    LYS  36           H        LYS  36   7.887  15.627 -13.960
  950    HA   LYS  36           HA       LYS  36   6.296  17.047 -15.968
  951   1HB   LYS  36          2HB       LYS  36   6.813  14.395 -15.712
  952   2HB   LYS  36          3HB       LYS  36   5.288  14.508 -14.844
  953   1HG   LYS  36          2HG       LYS  36   4.178  14.532 -16.754
  954   2HG   LYS  36          3HG       LYS  36   5.054  15.975 -17.270
  955   1HD   LYS  36          2HD       LYS  36   6.914  14.469 -18.015
  956   2HD   LYS  36          3HD       LYS  36   5.856  13.096 -17.678
  957   1HE   LYS  36          2HE       LYS  36   4.191  14.461 -19.210
  958   2HE   LYS  36          3HE       LYS  36   5.692  15.148 -19.827
  959   1HZ   LYS  36          1HZ       LYS  36   6.327  12.595 -19.899
  960   2HZ   LYS  36          2HZ       LYS  36   5.532  13.360 -21.182
  961   3HZ   LYS  36          3HZ       LYS  36   4.651  12.433 -20.073
  962    H    LYS  37           H        LYS  37   6.673  17.145 -12.736
  963    HA   LYS  37           HA       LYS  37   3.863  17.265 -12.005
  964   1HB   LYS  37          2HB       LYS  37   6.402  17.021 -10.600
  965   2HB   LYS  37          3HB       LYS  37   5.341  18.208  -9.850
  966   1HG   LYS  37          2HG       LYS  37   4.582  15.362 -10.475
  967   2HG   LYS  37          3HG       LYS  37   5.087  15.960  -8.893
  968   1HD   LYS  37          2HD       LYS  37   2.932  17.522 -10.095
  969   2HD   LYS  37          3HD       LYS  37   2.500  15.835  -9.810
  970   1HE   LYS  37          2HE       LYS  37   2.555  16.067  -7.565
  971   2HE   LYS  37          3HE       LYS  37   3.929  17.170  -7.608
  972   1HZ   LYS  37          1HZ       LYS  37   2.224  18.521  -6.902
  973   2HZ   LYS  37          2HZ       LYS  37   1.061  17.772  -7.875
  974   3HZ   LYS  37          3HZ       LYS  37   2.202  18.811  -8.569
  975    H    ARG  38           H        ARG  38   6.645  19.456 -12.221
  976    HA   ARG  38           HA       ARG  38   4.865  21.744 -11.804
  977   1HB   ARG  38          2HB       ARG  38   7.036  21.530 -10.535
  978   2HB   ARG  38          3HB       ARG  38   7.873  21.763 -12.064
  979   1HG   ARG  38          2HG       ARG  38   7.789  23.842 -10.859
  980   2HG   ARG  38          3HG       ARG  38   6.778  23.956 -12.300
  981   1HD   ARG  38          2HD       ARG  38   4.933  24.314 -11.093
  982   2HD   ARG  38          3HD       ARG  38   5.307  22.990  -9.991
  983    HE   ARG  38           HE       ARG  38   7.017  24.964  -9.241
  984   1HH1  ARG  38          2HH1      ARG  38   3.568  24.773  -9.676
  985   2HH1  ARG  38          1HH1      ARG  38   3.218  25.958  -8.462
  986   1HH2  ARG  38          2HH2      ARG  38   6.570  26.526  -7.640
  987   2HH2  ARG  38          1HH2      ARG  38   4.926  26.955  -7.306
  988    H    LYS  39           H        LYS  39   4.206  22.990 -13.430
  989    HA   LYS  39           HA       LYS  39   5.749  23.557 -15.737
  990   1HB   LYS  39          2HB       LYS  39   4.536  21.105 -15.912
  991   2HB   LYS  39          3HB       LYS  39   3.342  22.152 -16.667
  992   1HG   LYS  39          2HG       LYS  39   5.472  23.051 -17.951
  993   2HG   LYS  39          3HG       LYS  39   6.080  21.441 -17.555
  994   1HD   LYS  39          2HD       LYS  39   3.405  21.896 -18.857
  995   2HD   LYS  39          3HD       LYS  39   4.893  21.682 -19.783
  996   1HE   LYS  39          2HE       LYS  39   5.070  19.474 -19.247
  997   2HE   LYS  39          3HE       LYS  39   4.290  19.680 -17.680
  998   1HZ   LYS  39          1HZ       LYS  39   2.844  19.824 -20.266
  999   2HZ   LYS  39          2HZ       LYS  39   2.167  19.777 -18.716
 1000   3HZ   LYS  39          3HZ       LYS  39   2.962  18.417 -19.333
 1001    H    SER  40           H        SER  40   5.237  25.668 -15.610
 1002    HA   SER  40           HA       SER  40   2.460  26.403 -16.150
 1003   1HB   SER  40          2HB       SER  40   2.899  28.358 -14.441
 1004   2HB   SER  40          3HB       SER  40   2.339  26.788 -13.868
 1005    HG   SER  40           HG       SER  40   4.117  26.625 -12.781
 1006    H    GLY  41           H        GLY  41   2.260  28.068 -17.546
 1007   1HA   GLY  41          1HA       GLY  41   4.747  29.222 -18.580
 1008   2HA   GLY  41          2HA       GLY  41   3.188  29.229 -19.391
 1009    H    ASN  42           H        ASN  42   1.458  30.536 -18.201
 1010    HA   ASN  42           HA       ASN  42   2.645  32.930 -16.973
 1011   1HB   ASN  42          2HB       ASN  42   1.162  34.361 -18.278
 1012   2HB   ASN  42          3HB       ASN  42   2.162  33.387 -19.352
 1013   1HD2  ASN  42          1HD2      ASN  42  -0.885  34.479 -18.805
 1014   2HD2  ASN  42          2HD2      ASN  42  -1.778  33.307 -19.708
 1015    H    SER  43           H        SER  43   1.587  33.715 -15.239
 1016    HA   SER  43           HA       SER  43  -1.111  32.694 -14.674
 1017   1HB   SER  43          2HB       SER  43   0.650  33.093 -12.331
 1018   2HB   SER  43          3HB       SER  43  -0.553  31.840 -12.640
 1019    HG   SER  43           HG       SER  43   1.063  30.609 -13.133
 1020    H    ARG  44           H        ARG  44  -1.970  33.942 -12.620
 1021    HA   ARG  44           HA       ARG  44  -1.452  36.800 -13.106
 1022   1HB   ARG  44          2HB       ARG  44  -3.967  35.303 -12.430
 1023   2HB   ARG  44          3HB       ARG  44  -3.823  37.020 -12.077
 1024   1HG   ARG  44          2HG       ARG  44  -3.387  37.468 -14.442
 1025   2HG   ARG  44          3HG       ARG  44  -3.547  35.745 -14.791
 1026   1HD   ARG  44          2HD       ARG  44  -5.608  36.923 -15.316
 1027   2HD   ARG  44          3HD       ARG  44  -5.856  35.800 -13.980
 1028    HE   ARG  44           HE       ARG  44  -6.302  37.580 -12.605
 1029   1HH1  ARG  44          2HH1      ARG  44  -4.865  38.732 -15.558
 1030   2HH1  ARG  44          1HH1      ARG  44  -5.167  40.401 -15.207
 1031   1HH2  ARG  44          2HH2      ARG  44  -6.705  39.774 -12.130
 1032   2HH2  ARG  44          1HH2      ARG  44  -6.213  40.994 -13.257
 1033    H    GLU  45           H        GLU  45  -1.817  38.235 -11.235
 1034    HA   GLU  45           HA       GLU  45  -1.234  38.910  -9.140
 1035   1HB   GLU  45          2HB       GLU  45  -2.693  36.342  -8.656
 1036   2HB   GLU  45          3HB       GLU  45  -1.922  37.163  -7.305
 1037   1HG   GLU  45          2HG       GLU  45  -3.474  38.768  -7.231
 1038   2HG   GLU  45          3HG       GLU  45  -3.560  38.906  -8.986
 1039    H    ARG  46           H        ARG  46   0.689  37.324 -10.746
 1040    HA   ARG  46           HA       ARG  46   2.287  36.079  -8.623
 1041   1HB   ARG  46          2HB       ARG  46   1.710  34.980 -10.943
 1042   2HB   ARG  46          3HB       ARG  46   3.045  35.972 -11.514
 1043   1HG   ARG  46          2HG       ARG  46   4.606  34.838 -10.223
 1044   2HG   ARG  46          3HG       ARG  46   3.376  34.183  -9.140
 1045   1HD   ARG  46          2HD       ARG  46   3.851  32.332 -10.407
 1046   2HD   ARG  46          3HD       ARG  46   2.517  33.022 -11.330
 1047    HE   ARG  46           HE       ARG  46   3.972  33.463 -13.047
 1048   1HH1  ARG  46          2HH1      ARG  46   5.778  32.705 -10.168
 1049   2HH1  ARG  46          1HH1      ARG  46   7.302  32.631 -10.988
 1050   1HH2  ARG  46          2HH2      ARG  46   5.973  33.369 -14.137
 1051   2HH2  ARG  46          1HH2      ARG  46   7.413  33.010 -13.245
 1052    H    CYS  47           H        CYS  47   4.829  36.363  -9.025
 1053    HA   CYS  47           HA       CYS  47   5.237  39.196  -9.657
 1054   1HB   CYS  47          2HB       CYS  47   5.305  38.822  -7.212
 1055   2HB   CYS  47          3HB       CYS  47   6.573  37.632  -7.424
 1056    H    GLN  48           H        GLN  48   6.522  39.332 -11.367
 1057    HA   GLN  48           HA       GLN  48   8.224  37.084 -12.132
 1058   1HB   GLN  48          2HB       GLN  48   6.600  38.801 -13.590
 1059   2HB   GLN  48          3HB       GLN  48   8.227  39.371 -13.937
 1060   1HG   GLN  48          2HG       GLN  48   8.255  36.547 -14.106
 1061   2HG   GLN  48          3HG       GLN  48   6.856  37.130 -15.007
 1062   1HE2  GLN  48          1HE2      GLN  48   9.809  36.137 -15.502
 1063   2HE2  GLN  48          2HE2      GLN  48  10.321  37.172 -16.785
 1064    H    LEU  49           H        LEU  49   8.896  38.900  -9.909
 1065    HA   LEU  49           HA       LEU  49  11.473  39.879 -10.947
 1066   1HB   LEU  49          2HB       LEU  49   9.411  41.346  -9.670
 1067   2HB   LEU  49          3HB       LEU  49  10.771  41.251  -8.552
 1068    HG   LEU  49           HG       LEU  49  11.425  42.037 -11.322
 1069   1HD1  LEU  49          1HD1      LEU  49  10.762  44.461 -10.320
 1070   2HD1  LEU  49          2HD1      LEU  49   9.442  43.471  -9.699
 1071   3HD1  LEU  49          3HD1      LEU  49   9.755  43.535 -11.433
 1072   1HD2  LEU  49          1HD2      LEU  49  13.170  43.088 -10.329
 1073   2HD2  LEU  49          2HD2      LEU  49  12.817  41.932  -9.043
 1074   3HD2  LEU  49          3HD2      LEU  49  12.218  43.588  -8.931
 1075    H    CYS  50           H        CYS  50   9.682  38.396  -8.204
 1076    HA   CYS  50           HA       CYS  50  12.288  37.460  -7.259
 1077   1HB   CYS  50          2HB       CYS  50  11.759  37.839  -5.001
 1078   2HB   CYS  50          3HB       CYS  50  11.278  39.315  -5.817
 1079    H    ASN  51           H        ASN  51   9.851  36.586  -8.942
 1080    HA   ASN  51           HA       ASN  51   8.680  34.683  -9.369
 1081   1HB   ASN  51          2HB       ASN  51  11.146  33.871  -8.230
 1082   2HB   ASN  51          3HB       ASN  51   9.896  32.840  -7.540
 1083   1HD2  ASN  51          1HD2      ASN  51  10.492  31.008  -8.616
 1084   2HD2  ASN  51          2HD2      ASN  51  10.319  30.813 -10.323
 1085    H    GLY  52           H        GLY  52   8.069  36.442  -6.966
 1086   1HA   GLY  52          1HA       GLY  52   6.989  34.816  -4.917
 1087   2HA   GLY  52          2HA       GLY  52   6.570  36.494  -5.228
 1088    H    MET  53           H        MET  53   4.754  34.478  -4.386
 1089    HA   MET  53           HA       MET  53   3.000  34.356  -6.749
 1090   1HB   MET  53          2HB       MET  53   3.847  32.241  -4.921
 1091   2HB   MET  53          3HB       MET  53   2.098  32.350  -5.075
 1092   1HG   MET  53          2HG       MET  53   2.192  31.994  -7.413
 1093   2HG   MET  53          3HG       MET  53   3.940  32.209  -7.442
 1094   1HE   MET  53          1HE       MET  53   1.058  29.387  -6.394
 1095   2HE   MET  53          2HE       MET  53   1.361  30.105  -7.975
 1096   3HE   MET  53          3HE       MET  53   1.882  28.452  -7.642
 1097    H    GLY  54           H        GLY  54   1.731  36.108  -6.344
 1098   1HA   GLY  54          1HA       GLY  54  -0.530  36.142  -5.000
 1099   2HA   GLY  54          2HA       GLY  54   0.583  36.442  -3.673
 1100    H    HIS  55           H        HIS  55   2.333  38.207  -4.484
 1101    HA   HIS  55           HA       HIS  55   0.724  40.576  -4.966
 1102   1HB   HIS  55          2HB       HIS  55   2.792  41.811  -4.405
 1103   2HB   HIS  55          3HB       HIS  55   2.347  40.652  -3.155
 1104    HD1  HIS  55           HD1      HIS  55   3.755  38.336  -3.229
 1105    HD2  HIS  55           HD2      HIS  55   5.336  41.550  -5.334
 1106    HE1  HIS  55           HE1      HIS  55   6.171  37.757  -3.626
 1107    H    ASN  56           H        ASN  56   2.313  42.316  -6.224
 1108    HA   ASN  56           HA       ASN  56   2.822  41.069  -8.846
 1109   1HB   ASN  56          2HB       ASN  56   1.100  43.255  -8.119
 1110   2HB   ASN  56          3HB       ASN  56   2.352  43.830  -9.216
 1111   1HD2  ASN  56          1HD2      ASN  56  -0.673  42.703  -9.131
 1112   2HD2  ASN  56          2HD2      ASN  56  -0.775  41.958 -10.686
 1113    H    ALA  57           H        ALA  57   4.536  41.914 -10.104
 1114    HA   ALA  57           HA       ALA  57   6.889  42.480  -8.714
 1115   1HB   ALA  57          1HB       ALA  57   7.467  41.689 -10.740
 1116   2HB   ALA  57          2HB       ALA  57   6.064  42.402 -11.536
 1117   3HB   ALA  57          3HB       ALA  57   7.478  43.394 -11.187
 1118    H    LYS  58           H        LYS  58   4.507  44.617 -10.158
 1119    HA   LYS  58           HA       LYS  58   5.986  47.005 -10.074
 1120   1HB   LYS  58          2HB       LYS  58   3.033  46.418 -10.025
 1121   2HB   LYS  58          3HB       LYS  58   3.644  48.066  -9.952
 1122   1HG   LYS  58          2HG       LYS  58   4.966  46.800 -12.094
 1123   2HG   LYS  58          3HG       LYS  58   3.253  46.392 -12.223
 1124   1HD   LYS  58          2HD       LYS  58   3.526  48.402 -13.430
 1125   2HD   LYS  58          3HD       LYS  58   2.785  48.864 -11.896
 1126   1HE   LYS  58          2HE       LYS  58   5.633  48.885 -11.626
 1127   2HE   LYS  58          3HE       LYS  58   5.173  49.833 -13.041
 1128   1HZ   LYS  58          1HZ       LYS  58   4.738  51.462 -11.618
 1129   2HZ   LYS  58          2HZ       LYS  58   4.854  50.446 -10.271
 1130   3HZ   LYS  58          3HZ       LYS  58   3.389  50.576 -11.109
 1131    H    GLN  59           H        GLN  59   4.483  45.157  -7.589
 1132    HA   GLN  59           HA       GLN  59   4.915  47.355  -5.678
 1133   1HB   GLN  59          2HB       GLN  59   2.549  46.261  -6.077
 1134   2HB   GLN  59          3HB       GLN  59   3.185  45.011  -5.016
 1135   1HG   GLN  59          2HG       GLN  59   3.508  46.580  -3.246
 1136   2HG   GLN  59          3HG       GLN  59   3.116  47.932  -4.308
 1137   1HE2  GLN  59          1HE2      GLN  59   0.888  47.401  -5.502
 1138   2HE2  GLN  59          2HE2      GLN  59  -0.397  47.031  -4.407
 1139    H    CYS  60           H        CYS  60   6.691  44.968  -6.799
 1140    HA   CYS  60           HA       CYS  60   7.199  43.635  -4.278
 1141   1HB   CYS  60          2HB       CYS  60   7.100  42.317  -6.384
 1142   2HB   CYS  60          3HB       CYS  60   8.480  43.205  -6.998
 1143    H    ARG  61           H        ARG  61   9.034  43.994  -3.107
 1144    HA   ARG  61           HA       ARG  61  10.792  45.139  -2.226
 1145   1HB   ARG  61          2HB       ARG  61  11.538  45.306  -5.150
 1146   2HB   ARG  61          3HB       ARG  61  12.612  45.746  -3.829
 1147   1HG   ARG  61          2HG       ARG  61  11.868  43.241  -3.093
 1148   2HG   ARG  61          3HG       ARG  61  11.862  43.108  -4.852
 1149   1HD   ARG  61          2HD       ARG  61  14.175  44.420  -4.514
 1150   2HD   ARG  61          3HD       ARG  61  14.110  43.551  -2.982
 1151    HE   ARG  61           HE       ARG  61  14.561  42.434  -5.593
 1152   1HH1  ARG  61          2HH1      ARG  61  13.472  41.795  -2.349
 1153   2HH1  ARG  61          1HH1      ARG  61  13.811  40.098  -2.431
 1154   1HH2  ARG  61          2HH2      ARG  61  15.011  40.201  -5.713
 1155   2HH2  ARG  61          1HH2      ARG  61  14.688  39.192  -4.344
 1156    H    LYS  62           H        LYS  62   9.187  46.792  -1.621
 1157    HA   LYS  62           HA       LYS  62  10.119  49.388  -2.230
 1158   1HB   LYS  62          2HB       LYS  62   8.733  48.773  -4.300
 1159   2HB   LYS  62          3HB       LYS  62   7.327  48.891  -3.249
 1160   1HG   LYS  62          2HG       LYS  62   7.943  51.221  -2.735
 1161   2HG   LYS  62          3HG       LYS  62   9.291  51.090  -3.867
 1162   1HD   LYS  62          2HD       LYS  62   7.434  50.344  -5.545
 1163   2HD   LYS  62          3HD       LYS  62   6.351  51.153  -4.410
 1164   1HE   LYS  62          2HE       LYS  62   8.585  52.848  -4.864
 1165   2HE   LYS  62          3HE       LYS  62   7.989  52.300  -6.430
 1166   1HZ   LYS  62          1HZ       LYS  62   6.828  54.271  -5.865
 1167   2HZ   LYS  62          2HZ       LYS  62   6.458  53.706  -4.314
 1168   3HZ   LYS  62          3HZ       LYS  62   5.735  52.995  -5.669
 1169    H    ARG  63           H        ARG  63   9.719  50.630  -0.512
 1170    HA   ARG  63           HA       ARG  63   8.895  51.346   1.483
 1171   1HB   ARG  63          2HB       ARG  63   6.895  51.818   0.131
 1172   2HB   ARG  63          3HB       ARG  63   6.312  50.185   0.424
 1173   1HG   ARG  63          2HG       ARG  63   5.124  51.548   1.912
 1174   2HG   ARG  63          3HG       ARG  63   6.365  50.764   2.892
 1175   1HD   ARG  63          2HD       ARG  63   7.549  52.699   3.189
 1176   2HD   ARG  63          3HD       ARG  63   6.999  53.396   1.666
 1177    HE   ARG  63           HE       ARG  63   5.811  53.748   4.217
 1178   1HH1  ARG  63          2HH1      ARG  63   5.048  53.409   0.838
 1179   2HH1  ARG  63          1HH1      ARG  63   3.568  54.302   0.949
 1180   1HH2  ARG  63          2HH2      ARG  63   3.864  54.925   4.376
 1181   2HH2  ARG  63          1HH2      ARG  63   2.895  55.164   2.961
 1182    H    ASP  64           H        ASP  64  10.079  49.989   2.812
 1183    HA   ASP  64           HA       ASP  64  10.478  48.350   4.340
 1184   1HB   ASP  64          2HB       ASP  64   7.464  48.488   4.469
 1185   2HB   ASP  64          3HB       ASP  64   8.429  47.512   5.572
  Start of MODEL    4
    1   1H5*    C 160          1H5*        C 160  30.729  24.293 -12.174
    2   2H5*    C 160          2H5*        C 160  29.134  23.602 -11.873
    3    H4*    C 160           H4*        C 160  30.381  22.834 -10.084
    4    H3*    C 160           H3*        C 160  28.866  25.294  -9.250
    5    H2*    C 160           H2*        C 160  29.680  25.030  -7.030
    6   2HO*    C 160          2HO*        C 160  29.671  22.840  -6.781
    7    H1*    C 160           H1*        C 160  32.330  24.678  -7.854
    8   1H4     C 160          1H4         C 160  31.888  30.920  -6.584
    9   2H4     C 160          2H4         C 160  31.195  31.183  -8.168
   10    H5     C 160           H5         C 160  30.643  29.443  -9.668
   11    H6     C 160           H6         C 160  30.621  26.999 -10.018
   12   1H5*    U 161          1H5*        U 161  27.771  22.377  -6.362
   13   2H5*    U 161          2H5*        U 161  26.027  22.408  -6.104
   14    H4*    U 161           H4*        U 161  27.093  22.702  -3.995
   15    H3*    U 161           H3*        U 161  25.794  25.193  -5.076
   16    H2*    U 161           H2*        U 161  26.282  26.310  -3.032
   17   2HO*    U 161          2HO*        U 161  27.670  24.294  -1.798
   18    H1*    U 161           H1*        U 161  28.958  25.467  -3.028
   19    H3     U 161           H3         U 161  28.904  29.984  -3.836
   20    H5     U 161           H5         U 161  28.337  28.185  -7.576
   21    H6     U 161           H6         U 161  28.079  26.049  -6.398
   22   1H5*    G 162          1H5*        G 162  24.406  24.241  -1.245
   23   2H5*    G 162          2H5*        G 162  22.661  24.348  -1.017
   24    H4*    G 162           H4*        G 162  23.658  25.560   0.749
   25    H3*    G 162           H3*        G 162  22.437  27.319  -1.360
   26    H2*    G 162           H2*        G 162  22.942  29.242  -0.046
   27   2HO*    G 162          2HO*        G 162  23.718  28.847   2.117
   28    H1*    G 162           H1*        G 162  25.602  28.492   0.339
   29    H8     G 162           H8         G 162  24.667  27.493  -3.104
   30    H1     G 162           H1         G 162  26.007  33.804  -2.586
   31   1H2     G 162          1H2         G 162  26.133  34.320  -0.594
   32   2H2     G 162          2H2         G 162  25.908  33.208   0.739
   33   1H5*    C 163          1H5*        C 163  21.171  28.478   2.226
   34   2H5*    C 163          2H5*        C 163  19.440  28.681   2.494
   35    H4*    C 163           H4*        C 163  20.374  30.693   3.206
   36    H3*    C 163           H3*        C 163  19.247  30.976   0.431
   37    H2*    C 163           H2*        C 163  19.770  33.292   0.463
   38   2HO*    C 163          2HO*        C 163  20.624  34.085   2.586
   39    H1*    C 163           H1*        C 163  22.379  32.879   1.394
   40   1H4     C 163          1H4         C 163  23.044  33.204  -4.943
   41   2H4     C 163          2H4         C 163  22.504  31.546  -5.082
   42    H5     C 163           H5         C 163  21.731  30.257  -3.260
   43    H6     C 163           H6         C 163  21.281  30.244  -0.832
   44   1H5*    C 164          1H5*        C 164  17.804  34.063   2.645
   45   2H5*    C 164          2H5*        C 164  16.048  34.224   2.614
   46    H4*    C 164           H4*        C 164  16.807  36.350   2.074
   47    H3*    C 164           H3*        C 164  16.059  34.854  -0.423
   48    H2*    C 164           H2*        C 164  16.520  36.795  -1.721
   49   2HO*    C 164          2HO*        C 164  17.315  38.657  -0.181
   50    H1*    C 164           H1*        C 164  19.014  37.210  -0.523
   51   1H4     C 164          1H4         C 164  20.382  33.791  -5.732
   52   2H4     C 164          2H4         C 164  19.870  32.335  -4.909
   53    H5     C 164           H5         C 164  18.907  32.312  -2.753
   54    H6     C 164           H6         C 164  18.191  33.695  -0.837
   55   1H5*    C 165          1H5*        C 165  13.761  38.469  -0.533
   56   2H5*    C 165          2H5*        C 165  12.179  38.196  -1.265
   57    H4*    C 165           H4*        C 165  13.434  39.842  -2.523
   58    H3*    C 165           H3*        C 165  12.876  37.223  -3.897
   59    H2*    C 165           H2*        C 165  13.794  38.104  -5.907
   60   2HO*    C 165          2HO*        C 165  14.578  40.550  -4.952
   61    H1*    C 165           H1*        C 165  16.082  39.094  -4.599
   62   1H4     C 165          1H4         C 165  17.806  33.431  -7.026
   63   2H4     C 165          2H4         C 165  17.230  32.664  -5.563
   64    H5     C 165           H5         C 165  16.091  33.806  -3.839
   65    H6     C 165           H6         C 165  15.213  35.989  -3.086
   66   1H5*    U 166          1H5*        U 166  11.710  40.287  -6.258
   67   2H5*    U 166          2H5*        U 166  10.016  40.281  -6.744
   68    H4*    U 166           H4*        U 166  11.184  40.719  -8.712
   69    H3*    U 166           H3*        U 166  10.372  37.831  -8.565
   70    H2*    U 166           H2*        U 166  11.280  37.453 -10.725
   71   2HO*    U 166          2HO*        U 166  12.164  40.121 -10.956
   72    H1*    U 166           H1*        U 166  13.699  38.721 -10.150
   73    H3     U 166           H3         U 166  14.595  34.243 -10.367
   74    H5     U 166           H5         U 166  13.151  34.865  -6.485
   75    H6     U 166           H6         U 166  12.569  37.145  -7.173
   76   1H5*    C 167          1H5*        C 167   8.372  39.112 -12.424
   77   2H5*    C 167          2H5*        C 167   6.746  38.464 -12.217
   78    H4*    C 167           H4*        C 167   7.653  37.692 -14.303
   79    H3*    C 167           H3*        C 167   7.282  35.612 -12.171
   80    H2*    C 167           H2*        C 167   8.000  33.914 -13.669
   81   2HO*    C 167          2HO*        C 167   8.221  34.524 -15.908
   82    H1*    C 167           H1*        C 167  10.249  35.393 -14.506
   83   1H4     C 167          1H4         C 167  12.376  31.352 -10.020
   84   2H4     C 167          2H4         C 167  12.011  32.561  -8.810
   85    H5     C 167           H5         C 167  10.895  34.590  -9.272
   86    H6     C 167           H6         C 167   9.844  35.972 -11.027
   87   1H5*    A 168          1H5*        A 168   3.973  33.914 -15.020
   88   2H5*    A 168          2H5*        A 168   2.808  35.039 -15.718
   89    H4*    A 168           H4*        A 168   2.345  33.326 -13.266
   90    H3*    A 168           H3*        A 168   1.975  32.711 -16.094
   91    H2*    A 168           H2*        A 168  -0.257  33.284 -16.052
   92   2HO*    A 168          2HO*        A 168  -1.338  31.434 -14.831
   93    H1*    A 168           H1*        A 168  -0.093  33.007 -12.999
   94    H8     A 168           H8         A 168  -1.937  34.488 -15.939
   95   1H6     A 168          1H6         A 168  -6.101  36.574 -11.783
   96   2H6     A 168          2H6         A 168  -5.767  36.404 -13.492
   97    H2     A 168           H2         A 168  -2.657  34.860  -9.560
   98   1H5*    U 169          1H5*        U 169   2.909  31.377 -17.977
   99   2H5*    U 169          2H5*        U 169   4.450  30.520 -17.999
  100    H4*    U 169           H4*        U 169   4.513  33.358 -17.123
  101    H3*    U 169           H3*        U 169   3.624  32.563 -19.861
  102    H2*    U 169           H2*        U 169   5.050  34.176 -20.873
  103   2HO*    U 169          2HO*        U 169   5.776  35.831 -19.579
  104    H1*    U 169           H1*        U 169   7.307  33.369 -19.479
  105    H3     U 169           H3         U 169   8.283  31.453 -23.422
  106    H5     U 169           H5         U 169   4.943  29.281 -22.131
  107    H6     U 169           H6         U 169   4.792  30.828 -20.236
  108   1H5*    C 170          1H5*        C 170   0.062  34.690 -18.441
  109   2H5*    C 170          2H5*        C 170  -0.660  36.016 -19.353
  110    H4*    C 170           H4*        C 170  -1.120  36.332 -17.024
  111    H3*    C 170           H3*        C 170   0.800  38.280 -18.254
  112    H2*    C 170           H2*        C 170   0.963  39.466 -16.205
  113   2HO*    C 170          2HO*        C 170  -1.000  39.397 -15.269
  114    H1*    C 170           H1*        C 170   1.309  37.092 -14.700
  115   1H4     C 170          1H4         C 170   7.207  39.420 -15.467
  116   2H4     C 170          2H4         C 170   7.268  38.700 -17.061
  117    H5     C 170           H5         C 170   5.438  37.615 -18.085
  118    H6     C 170           H6         C 170   3.075  36.947 -17.830
  119   1H5*    C 171          1H5*        C 171  -1.308  41.793 -20.239
  120   2H5*    C 171          2H5*        C 171   0.403  42.146 -20.000
  121    H4*    C 171           H4*        C 171  -1.830  42.238 -18.105
  122    H3*    C 171           H3*        C 171   0.856  43.575 -18.385
  123    H2*    C 171           H2*        C 171   0.694  44.304 -16.132
  124   2HO*    C 171          2HO*        C 171  -1.819  43.049 -15.810
  125    H1*    C 171           H1*        C 171  -0.138  41.767 -15.214
  126   1H4     C 171          1H4         C 171   6.155  42.135 -14.067
  127   2H4     C 171          2H4         C 171   6.436  41.404 -15.631
  128    H5     C 171           H5         C 171   4.730  40.974 -17.208
  129    H6     C 171           H6         C 171   2.311  41.140 -17.675
  130   1H5*    G 172          1H5*        G 172  -1.630  47.468 -18.521
  131   2H5*    G 172          2H5*        G 172  -0.970  48.260 -19.951
  132    H4*    G 172           H4*        G 172  -0.555  49.674 -18.089
  133    H3*    G 172           H3*        G 172   1.891  48.276 -19.134
  134    H2*    G 172           H2*        G 172   3.240  49.496 -17.595
  135   2HO*    G 172          2HO*        G 172   1.043  50.759 -16.397
  136    H1*    G 172           H1*        G 172   1.613  48.873 -15.414
  137    H8     G 172           H8         G 172   1.878  46.019 -17.843
  138    H1     G 172           H1         G 172   6.689  46.249 -13.521
  139   1H2     G 172          1H2         G 172   6.585  48.020 -12.469
  140   2H2     G 172          2H2         G 172   5.376  49.257 -12.720
  141   1H5*    U 173          1H5*        U 173   2.880  52.277 -19.099
  142   2H5*    U 173          2H5*        U 173   3.587  52.845 -20.611
  143    H4*    U 173           H4*        U 173   5.108  53.408 -18.893
  144    H3*    U 173           H3*        U 173   6.023  51.039 -20.513
  145    H2*    U 173           H2*        U 173   8.090  51.075 -19.342
  146   2HO*    U 173          2HO*        U 173   8.400  52.945 -17.890
  147    H1*    U 173           H1*        U 173   6.794  51.355 -16.833
  148    H3     U 173           H3         U 173   8.812  47.277 -16.648
  149    H5     U 173           H5         U 173   5.412  46.653 -19.012
  150    H6     U 173           H6         U 173   5.072  49.081 -18.989
  151   1H5*    C 174          1H5*        C 174   9.104  53.918 -20.869
  152   2H5*    C 174          2H5*        C 174   9.720  54.024 -22.519
  153    H4*    C 174           H4*        C 174  11.554  53.556 -21.074
  154    H3*    C 174           H3*        C 174  10.712  51.244 -22.800
  155    H2*    C 174           H2*        C 174  12.529  49.960 -21.978
  156   2HO*    C 174          2HO*        C 174  14.259  51.123 -21.322
  157    H1*    C 174           H1*        C 174  12.003  50.762 -19.289
  158   1H4     C 174          1H4         C 174   9.695  44.823 -19.691
  159   2H4     C 174          2H4         C 174   8.274  45.440 -20.504
  160    H5     C 174           H5         C 174   8.004  47.695 -21.151
  161    H6     C 174           H6         C 174   9.040  49.937 -21.176
  162   1H5*    U 175          1H5*        U 175  12.194  53.752 -27.246
  163   2H5*    U 175          2H5*        U 175  11.153  52.330 -27.304
  164    H4*    U 175           H4*        U 175  13.298  50.965 -27.585
  165    H3*    U 175           H3*        U 175  14.439  53.734 -27.907
  166    H2*    U 175           H2*        U 175  15.897  52.932 -29.579
  167   2HO*    U 175          2HO*        U 175  14.970  50.277 -29.232
  168    H1*    U 175           H1*        U 175  13.812  51.280 -30.702
  169    H3     U 175           H3         U 175  14.664  53.768 -34.346
  170    H5     U 175           H5         U 175  13.388  56.610 -31.547
  171    H6     U 175           H6         U 175  13.325  54.805 -29.890
  172   1H5*    C 176          1H5*        C 176  15.621  51.515 -24.053
  173   2H5*    C 176          2H5*        C 176  16.743  52.575 -23.199
  174    H4*    C 176           H4*        C 176  18.474  50.910 -23.259
  175    H3*    C 176           H3*        C 176  16.664  49.425 -25.150
  176    H2*    C 176           H2*        C 176  17.555  47.369 -24.368
  177   2HO*    C 176          2HO*        C 176  19.552  47.443 -23.397
  178    H1*    C 176           H1*        C 176  17.317  48.108 -21.662
  179   1H4     C 176          1H4         C 176  12.076  44.655 -22.840
  180   2H4     C 176          2H4         C 176  11.325  46.061 -23.562
  181    H5     C 176           H5         C 176  12.436  48.116 -23.905
  182    H6     C 176           H6         C 176  14.562  49.342 -23.637
  183   1H5*    G 177          1H5*        G 177  20.942  48.080 -26.217
  184   2H5*    G 177          2H5*        G 177  20.861  47.758 -27.950
  185    H4*    G 177           H4*        G 177  21.679  45.837 -26.641
  186    H3*    G 177           H3*        G 177  19.186  45.573 -28.291
  187    H2*    G 177           H2*        G 177  19.055  43.258 -27.740
  188   2HO*    G 177          2HO*        G 177  20.893  42.411 -26.480
  189    H1*    G 177           H1*        G 177  19.343  43.719 -25.002
  190    H8     G 177           H8         G 177  17.292  46.513 -26.223
  191    H1     G 177           H1         G 177  13.913  41.016 -25.721
  192   1H2     G 177          1H2         G 177  15.207  39.434 -25.443
  193   2H2     G 177          2H2         G 177  16.948  39.576 -25.359
  194   1H5*    C 178          1H5*        C 178  21.750  42.416 -29.599
  195   2H5*    C 178          2H5*        C 178  21.690  42.247 -31.353
  196    H4*    C 178           H4*        C 178  21.110  40.156 -30.302
  197    H3*    C 178           H3*        C 178  18.920  41.567 -31.795
  198    H2*    C 178           H2*        C 178  17.441  39.758 -31.375
  199   2HO*    C 178          2HO*        C 178  18.436  37.834 -31.154
  200    H1*    C 178           H1*        C 178  18.128  39.629 -28.641
  201   1H4     C 178          1H4         C 178  12.714  43.029 -28.893
  202   2H4     C 178          2H4         C 178  13.668  44.473 -29.151
  203    H5     C 178           H5         C 178  16.008  44.465 -29.471
  204    H6     C 178           H6         C 178  18.029  43.055 -29.624
  205   1H5*    U 179          1H5*        U 179  19.131  37.610 -33.627
  206   2H5*    U 179          2H5*        U 179  19.085  37.824 -35.377
  207    H4*    U 179           H4*        U 179  17.364  36.290 -34.741
  208    H3*    U 179           H3*        U 179  16.399  38.981 -35.669
  209    H2*    U 179           H2*        U 179  14.151  38.231 -35.514
  210   2HO*    U 179          2HO*        U 179  13.808  35.985 -35.334
  211    H1*    U 179           H1*        U 179  14.508  37.142 -32.953
  212    H3     U 179           H3         U 179  11.807  40.824 -32.535
  213    H5     U 179           H5         U 179  15.720  42.317 -32.486
  214    H6     U 179           H6         U 179  16.479  40.070 -33.112
  215   1H5*    U 180          1H5*        U 180  14.494  36.217 -37.813
  216   2H5*    U 180          2H5*        U 180  14.300  36.454 -39.551
  217    H4*    U 180           H4*        U 180  12.134  36.224 -38.589
  218    H3*    U 180           H3*        U 180  12.823  38.985 -39.530
  219    H2*    U 180           H2*        U 180  10.678  39.782 -38.907
  220   2HO*    U 180          2HO*        U 180   9.101  38.149 -38.297
  221    H1*    U 180           H1*        U 180  10.784  38.502 -36.382
  222    H3     U 180           H3         U 180  10.849  42.865 -35.199
  223    H5     U 180           H5         U 180  14.631  42.244 -36.887
  224    H6     U 180           H6         U 180  13.869  40.002 -37.524
  225   1H5*    A 181          1H5*        A 181  10.559  37.584 -43.606
  226   2H5*    A 181          2H5*        A 181  11.305  38.795 -44.649
  227    H4*    A 181           H4*        A 181   8.829  39.052 -44.198
  228    H3*    A 181           H3*        A 181  10.802  41.285 -43.782
  229    H2*    A 181           H2*        A 181   9.007  42.763 -43.291
  230   2HO*    A 181          2HO*        A 181   7.014  42.197 -44.069
  231    H1*    A 181           H1*        A 181   7.782  40.979 -41.513
  232    H8     A 181           H8         A 181  11.519  40.877 -41.229
  233   1H6     A 181          1H6         A 181  10.992  45.533 -37.104
  234   2H6     A 181          2H6         A 181  12.106  44.383 -37.810
  235    H2     A 181           H2         A 181   7.015  44.874 -38.973
  236   1H5*    U 182          1H5*        U 182   9.283  39.865 -47.705
  237   2H5*    U 182          2H5*        U 182  10.928  39.489 -47.191
  238    H4*    U 182           H4*        U 182  11.756  39.792 -49.445
  239    H3*    U 182           H3*        U 182   8.960  40.734 -50.091
  240    H2*    U 182           H2*        U 182   9.223  39.912 -52.270
  241   2HO*    U 182          2HO*        U 182  11.622  39.247 -52.695
  242    H1*    U 182           H1*        U 182  10.815  37.671 -51.270
  243    H3     U 182           H3         U 182   7.726  35.619 -53.902
  244    H5     U 182           H5         U 182   5.539  36.939 -50.583
  245    H6     U 182           H6         U 182   7.554  38.134 -49.856
  246   1H5*    U 183          1H5*        U 183   9.523  46.126 -50.026
  247   2H5*    U 183          2H5*        U 183   9.499  45.548 -51.692
  248    H4*    U 183           H4*        U 183  12.164  45.407 -51.132
  249    H3*    U 183           H3*        U 183  11.038  47.465 -49.293
  250    H2*    U 183           H2*        U 183  12.718  49.044 -49.870
  251   2HO*    U 183          2HO*        U 183  13.893  47.392 -51.800
  252    H1*    U 183           H1*        U 183  12.343  48.801 -52.595
  253    H3     U 183           H3         U 183  10.259  52.714 -51.663
  254    H5     U 183           H5         U 183   7.561  49.802 -50.333
  255    H6     U 183           H6         U 183   9.291  48.128 -50.795
  256   1H5*    C 184          1H5*        C 184  11.369  46.127 -45.371
  257   2H5*    C 184          2H5*        C 184  12.487  47.414 -45.821
  258    H4*    C 184           H4*        C 184  12.689  45.365 -43.699
  259    H3*    C 184           H3*        C 184  13.507  48.246 -44.038
  260    H2*    C 184           H2*        C 184  15.154  47.989 -42.439
  261   2HO*    C 184          2HO*        C 184  14.749  46.169 -40.867
  262    H1*    C 184           H1*        C 184  15.272  45.071 -43.035
  263   1H4     C 184          1H4         C 184  21.366  46.905 -43.498
  264   2H4     C 184          2H4         C 184  20.975  47.830 -44.931
  265    H5     C 184           H5         C 184  18.783  48.101 -45.766
  266    H6     C 184           H6         C 184  16.401  47.544 -45.428
  267   1H5*    G 185          1H5*        G 185  10.735  50.487 -39.626
  268   2H5*    G 185          2H5*        G 185  12.447  50.597 -40.030
  269    H4*    G 185           H4*        G 185  11.107  49.135 -37.788
  270    H3*    G 185           H3*        G 185  13.267  51.179 -38.052
  271    H2*    G 185           H2*        G 185  14.420  50.314 -36.155
  272   2HO*    G 185          2HO*        G 185  12.891  48.138 -35.621
  273    H1*    G 185           H1*        G 185  14.373  47.691 -37.107
  274    H8     G 185           H8         G 185  14.832  50.175 -39.885
  275    H1     G 185           H1         G 185  20.338  48.501 -36.923
  276   1H2     G 185          1H2         G 185  19.904  47.394 -35.239
  277   2H2     G 185          2H2         G 185  18.289  46.981 -34.707
  278   1H5*    G 186          1H5*        G 186   9.649  52.588 -33.632
  279   2H5*    G 186          2H5*        G 186   9.816  53.483 -35.143
  280    H4*    G 186           H4*        G 186  11.289  54.159 -32.587
  281    H3*    G 186           H3*        G 186   8.617  55.082 -33.588
  282    H2*    G 186           H2*        G 186   9.053  57.282 -32.784
  283   2HO*    G 186          2HO*        G 186  11.051  57.533 -31.532
  284    H1*    G 186           H1*        G 186  11.555  57.419 -34.013
  285    H8     G 186           H8         G 186   8.949  55.564 -36.020
  286    H1     G 186           H1         G 186   9.072  61.950 -37.059
  287   1H2     G 186          1H2         G 186  10.339  62.846 -35.701
  288   2H2     G 186          2H2         G 186  11.236  61.992 -34.465
  289   1H5*    G 187          1H5*        G 187   7.453  51.872 -29.794
  290   2H5*    G 187          2H5*        G 187   8.570  52.536 -30.985
  291    H4*    G 187           H4*        G 187   5.709  52.910 -31.614
  292    H3*    G 187           H3*        G 187   6.838  50.156 -31.240
  293    H2*    G 187           H2*        G 187   5.700  49.403 -33.192
  294   2HO*    G 187          2HO*        G 187   4.085  50.757 -34.043
  295    H1*    G 187           H1*        G 187   6.639  51.508 -34.763
  296    H8     G 187           H8         G 187   9.437  50.669 -32.529
  297    H1     G 187           H1         G 187   8.755  46.391 -37.338
  298   1H2     G 187          1H2         G 187   6.944  46.693 -38.278
  299   2H2     G 187          2H2         G 187   5.784  47.923 -37.829
  300   1H5*    G 188          1H5*        G 188   3.014  49.384 -32.674
  301   2H5*    G 188          2H5*        G 188   2.160  48.694 -31.294
  302    H4*    G 188           H4*        G 188   1.616  47.254 -33.018
  303    H3*    G 188           H3*        G 188   3.913  46.111 -31.452
  304    H2*    G 188           H2*        G 188   3.842  44.147 -32.800
  305   2HO*    G 188          2HO*        G 188   1.894  44.920 -34.556
  306    H1*    G 188           H1*        G 188   3.826  45.594 -35.193
  307    H8     G 188           H8         G 188   6.087  47.449 -32.972
  308    H1     G 188           H1         G 188   8.824  42.082 -35.337
  309   1H2     G 188          1H2         G 188   7.378  40.901 -36.213
  310   2H2     G 188          2H2         G 188   5.679  41.304 -36.294
  311   1H5*    A 189          1H5*        A 189   1.069  42.516 -31.107
  312   2H5*    A 189          2H5*        A 189   1.449  42.082 -29.439
  313    H4*    A 189           H4*        A 189   1.886  40.292 -31.128
  314    H3*    A 189           H3*        A 189   4.061  41.272 -29.292
  315    H2*    A 189           H2*        A 189   5.504  39.571 -30.122
  316   2HO*    A 189          2HO*        A 189   4.489  37.804 -30.909
  317    H1*    A 189           H1*        A 189   4.930  40.170 -32.801
  318    H8     A 189           H8         A 189   5.138  43.351 -30.901
  319   1H6     A 189          1H6         A 189  11.323  43.117 -31.708
  320   2H6     A 189          2H6         A 189  10.000  44.129 -31.171
  321    H2     A 189           H2         A 189   9.606  39.222 -32.985
  322   1H5*    G 190          1H5*        G 190   3.778  36.768 -28.676
  323   2H5*    G 190          2H5*        G 190   3.993  36.598 -26.934
  324    H4*    G 190           H4*        G 190   5.544  35.189 -28.192
  325    H3*    G 190           H3*        G 190   6.676  37.370 -26.461
  326    H2*    G 190           H2*        G 190   8.878  36.590 -26.931
  327   2HO*    G 190          2HO*        G 190   8.986  34.581 -28.215
  328    H1*    G 190           H1*        G 190   8.450  36.530 -29.690
  329    H8     G 190           H8         G 190   6.641  39.498 -28.472
  330    H1     G 190           H1         G 190  13.030  40.465 -28.824
  331   1H2     G 190          1H2         G 190  13.986  38.660 -29.111
  332   2H2     G 190          2H2         G 190  13.176  37.114 -29.236
  333   1H5*    C 191          1H5*        C 191   8.656  34.068 -25.560
  334   2H5*    C 191          2H5*        C 191   8.601  33.552 -23.874
  335    H4*    C 191           H4*        C 191  10.863  33.516 -24.377
  336    H3*    C 191           H3*        C 191  10.182  36.092 -22.979
  337    H2*    C 191           H2*        C 191  12.483  36.683 -22.975
  338   2HO*    C 191          2HO*        C 191  13.929  34.926 -23.880
  339    H1*    C 191           H1*        C 191  12.833  36.052 -25.682
  340   1H4     C 191          1H4         C 191  11.641  42.315 -25.766
  341   2H4     C 191          2H4         C 191   9.941  41.998 -25.501
  342    H5     C 191           H5         C 191   9.047  39.847 -25.117
  343    H6     C 191           H6         C 191   9.569  37.444 -24.891
  344   1H5*    G 192          1H5*        G 192  13.483  34.236 -21.142
  345   2H5*    G 192          2H5*        G 192  13.298  34.130 -19.391
  346    H4*    G 192           H4*        G 192  15.447  35.012 -19.776
  347    H3*    G 192           H3*        G 192  13.476  37.083 -18.864
  348    H2*    G 192           H2*        G 192  15.200  38.727 -18.831
  349   2HO*    G 192          2HO*        G 192  17.049  36.799 -19.806
  350    H1*    G 192           H1*        G 192  16.074  38.111 -21.409
  351    H8     G 192           H8         G 192  12.369  37.786 -21.303
  352    H1     G 192           H1         G 192  14.378  43.902 -21.970
  353   1H2     G 192          1H2         G 192  16.413  43.997 -21.649
  354   2H2     G 192          2H2         G 192  17.425  42.625 -21.257
  355   1H5*    G 193          1H5*        G 193  16.889  37.400 -16.495
  356   2H5*    G 193          2H5*        G 193  16.555  37.719 -14.793
  357    H4*    G 193           H4*        G 193  17.987  39.439 -15.691
  358    H3*    G 193           H3*        G 193  15.208  40.265 -14.912
  359    H2*    G 193           H2*        G 193  15.725  42.534 -15.423
  360   2HO*    G 193          2HO*        G 193  18.189  42.412 -16.393
  361    H1*    G 193           H1*        G 193  16.759  41.911 -17.939
  362    H8     G 193           H8         G 193  13.912  39.628 -17.468
  363    H1     G 193           H1         G 193  12.036  45.642 -18.951
  364   1H2     G 193          1H2         G 193  13.642  46.924 -18.787
  365   2H2     G 193          2H2         G 193  15.257  46.442 -18.319
  366   1H5*    A 194          1H5*        A 194  17.671  43.203 -12.590
  367   2H5*    A 194          2H5*        A 194  17.160  42.819 -10.946
  368    H4*    A 194           H4*        A 194  16.992  45.159 -11.165
  369    H3*    A 194           H3*        A 194  14.324  43.782 -11.255
  370    H2*    A 194           H2*        A 194  13.229  45.886 -11.366
  371   2HO*    A 194          2HO*        A 194  15.455  47.489 -11.427
  372    H1*    A 194           H1*        A 194  14.865  46.861 -13.402
  373    H8     A 194           H8         A 194  14.214  43.206 -13.879
  374   1H6     A 194          1H6         A 194   9.038  44.864 -16.947
  375   2H6     A 194          2H6         A 194  10.077  43.514 -16.546
  376    H2     A 194           H2         A 194  10.754  48.497 -15.051
  377   1H5*    C 195          1H5*        C 195  13.807  46.595  -7.969
  378   2H5*    C 195          2H5*        C 195  12.956  45.737  -6.683
  379    H4*    C 195           H4*        C 195  11.733  47.720  -7.348
  380    H3*    C 195           H3*        C 195  10.445  45.066  -7.944
  381    H2*    C 195           H2*        C 195   8.500  46.182  -8.703
  382   2HO*    C 195          2HO*        C 195   8.128  48.094  -7.727
  383    H1*    C 195           H1*        C 195  10.032  48.095 -10.166
  384   1H4     C 195          1H4         C 195   7.714  43.949 -14.464
  385   2H4     C 195          2H4         C 195   9.145  42.971 -14.226
  386    H5     C 195           H5         C 195  10.781  43.410 -12.580
  387    H6     C 195           H6         C 195  11.453  44.911 -10.738
  388   1H5*    G 196          1H5*        G 196   7.968  46.051  -4.285
  389   2H5*    G 196          2H5*        G 196   8.140  44.640  -3.241
  390    H4*    G 196           H4*        G 196   5.858  44.754  -3.720
  391    H3*    G 196           H3*        G 196   7.218  42.683  -5.425
  392    H2*    G 196           H2*        G 196   5.101  42.043  -6.312
  393   2HO*    G 196          2HO*        G 196   3.829  44.069  -4.781
  394    H1*    G 196           H1*        G 196   4.369  44.683  -6.891
  395    H8     G 196           H8         G 196   8.012  43.832  -7.467
  396    H1     G 196           H1         G 196   4.175  42.805 -12.575
  397   1H2     G 196          1H2         G 196   2.206  43.065 -12.021
  398   2H2     G 196          2H2         G 196   1.674  43.497 -10.412
  399   1H5*    A 197          1H5*        A 197   7.956  39.108  -1.231
  400   2H5*    A 197          2H5*        A 197   6.679  38.511  -2.293
  401    H4*    A 197           H4*        A 197   6.516  39.394   0.568
  402    H3*    A 197           H3*        A 197   5.783  36.920  -0.969
  403    H2*    A 197           H2*        A 197   3.924  36.570   0.343
  404   2HO*    A 197          2HO*        A 197   4.514  38.157   2.489
  405    H1*    A 197           H1*        A 197   3.889  39.475   1.054
  406    H8     A 197           H8         A 197   2.732  37.751  -2.150
  407   1H6     A 197          1H6         A 197  -3.057  38.914  -0.130
  408   2H6     A 197          2H6         A 197  -2.123  38.278  -1.465
  409    H2     A 197           H2         A 197  -0.202  40.182   3.029
  410   1H5*    U 198          1H5*        U 198   9.628  34.775   3.189
  411   2H5*    U 198          2H5*        U 198   9.375  34.226   1.532
  412    H4*    U 198           H4*        U 198   7.933  32.503   2.185
  413    H3*    U 198           H3*        U 198   7.587  33.971   4.803
  414    H2*    U 198           H2*        U 198   7.244  31.959   5.869
  415   2HO*    U 198          2HO*        U 198   5.520  31.225   4.720
  416    H1*    U 198           H1*        U 198   8.688  30.554   3.658
  417    H3     U 198           H3         U 198  11.351  28.224   6.379
  418    H5     U 198           H5         U 198  10.357  31.536   8.741
  419    H6     U 198           H6         U 198   9.092  32.398   6.825
  420   1H5*    G 199          1H5*        G 199   2.041  34.121   2.806
  421   2H5*    G 199          2H5*        G 199   2.593  35.291   4.004
  422    H4*    G 199           H4*        G 199   0.597  34.537   4.894
  423    H3*    G 199           H3*        G 199   2.876  33.020   6.138
  424    H2*    G 199           H2*        G 199   1.336  31.902   7.570
  425   2HO*    G 199          2HO*        G 199  -0.634  32.872   7.866
  426    H1*    G 199           H1*        G 199  -0.373  31.214   5.466
  427    H8     G 199           H8         G 199   3.315  31.079   6.395
  428    H1     G 199           H1         G 199   0.898  25.569   4.009
  429   1H2     G 199          1H2         G 199  -1.035  25.887   3.367
  430   2H2     G 199          2H2         G 199  -1.876  27.418   3.460
  431   1H5*    A 200          1H5*        A 200   3.880  36.652   9.561
  432   2H5*    A 200          2H5*        A 200   5.271  36.812   8.489
  433    H4*    A 200           H4*        A 200   5.605  35.986  10.925
  434    H3*    A 200           H3*        A 200   6.928  34.853   8.472
  435    H2*    A 200           H2*        A 200   8.191  33.382   9.841
  436   2HO*    A 200          2HO*        A 200   7.227  33.993  12.288
  437    H1*    A 200           H1*        A 200   5.977  32.543  11.325
  438    H8     A 200           H8         A 200   4.792  32.936   7.854
  439   1H6     A 200          1H6         A 200   7.148  27.284   6.646
  440   2H6     A 200          2H6         A 200   6.130  28.560   6.015
  441    H2     A 200           H2         A 200   8.612  28.577  10.638
  442   1H5*    C 201          1H5*        C 201  11.864  36.814  11.118
  443   2H5*    C 201          2H5*        C 201  11.586  35.526   9.946
  444    H4*    C 201           H4*        C 201   9.646  35.933  12.199
  445    H3*    C 201           H3*        C 201  12.376  34.661  12.442
  446    H2*    C 201           H2*        C 201  11.467  33.147  14.015
  447   2HO*    C 201          2HO*        C 201   8.889  34.148  14.002
  448    H1*    C 201           H1*        C 201   9.088  32.821  12.432
  449   1H4     C 201          1H4         C 201  12.228  27.358  11.499
  450   2H4     C 201          2H4         C 201  13.466  28.206  10.601
  451    H5     C 201           H5         C 201  13.515  30.552  10.323
  452    H6     C 201           H6         C 201  12.378  32.680  10.847
  453   1H5*    C 202          1H5*        C 202  11.284  36.012  16.469
  454   2H5*    C 202          2H5*        C 202  12.676  36.012  17.551
  455    H4*    C 202           H4*        C 202  10.914  34.305  18.060
  456    H3*    C 202           H3*        C 202  13.768  33.446  17.567
  457    H2*    C 202           H2*        C 202  13.177  31.274  18.276
  458   2HO*    C 202          2HO*        C 202  10.935  31.138  19.244
  459    H1*    C 202           H1*        C 202  10.662  31.410  16.882
  460   1H4     C 202          1H4         C 202  14.349  27.394  13.527
  461   2H4     C 202          2H4         C 202  15.023  28.772  12.687
  462    H5     C 202           H5         C 202  14.548  31.017  13.248
  463    H6     C 202           H6         C 202  13.298  32.506  14.770
  464   1H5*    C 203          1H5*        C 203  13.345  32.708  22.131
  465   2H5*    C 203          2H5*        C 203  15.025  32.715  22.666
  466    H4*    C 203           H4*        C 203  13.807  30.575  23.060
  467    H3*    C 203           H3*        C 203  16.338  30.613  21.424
  468    H2*    C 203           H2*        C 203  16.312  28.237  21.404
  469   2HO*    C 203          2HO*        C 203  14.474  27.299  22.748
  470    H1*    C 203           H1*        C 203  13.559  28.149  20.745
  471   1H4     C 203          1H4         C 203  16.653  27.238  15.225
  472   2H4     C 203          2H4         C 203  16.797  28.972  15.046
  473    H5     C 203           H5         C 203  16.137  30.524  16.700
  474    H6     C 203           H6         C 203  15.167  30.797  18.954
  475   1H5*    U 204          1H5*        U 204  17.060  28.164  25.000
  476   2H5*    U 204          2H5*        U 204  18.765  28.181  25.448
  477    H4*    U 204           H4*        U 204  17.883  25.920  24.968
  478    H3*    U 204           H3*        U 204  20.178  27.011  23.360
  479    H2*    U 204           H2*        U 204  20.401  24.904  22.272
  480   2HO*    U 204          2HO*        U 204  19.843  23.305  23.626
  481    H1*    U 204           H1*        U 204  17.671  24.734  21.681
  482    H3     U 204           H3         U 204  20.136  25.508  17.842
  483    H5     U 204           H5         U 204  19.080  29.275  19.337
  484    H6     U 204           H6         U 204  18.310  28.142  21.372
  485   1H5*    A 205          1H5*        A 205  22.817  24.825  26.755
  486   2H5*    A 205          2H5*        A 205  24.393  25.478  26.308
  487    H4*    A 205           H4*        A 205  23.784  23.040  25.678
  488    H3*    A 205           H3*        A 205  25.162  25.033  23.895
  489    H2*    A 205           H2*        A 205  25.416  23.356  22.234
  490   2HO*    A 205          2HO*        A 205  24.731  21.150  22.930
  491    H1*    A 205           H1*        A 205  22.758  22.512  22.395
  492    H8     A 205           H8         A 205  22.627  26.163  22.789
  493   1H6     A 205          1H6         A 205  23.083  26.650  16.584
  494   2H6     A 205          2H6         A 205  22.741  27.534  18.054
  495    H2     A 205           H2         A 205  23.962  22.444  17.717
  496   1H5*    G 206          1H5*        G 206  29.108  25.478  23.176
  497   2H5*    G 206          2H5*        G 206  27.932  26.183  22.066
  498    H4*    G 206           H4*        G 206  29.935  25.077  21.011
  499    H3*    G 206           H3*        G 206  27.112  24.387  20.251
  500    H2*    G 206           H2*        G 206  27.926  22.941  18.542
  501   2HO*    G 206          2HO*        G 206  29.693  24.123  17.871
  502    H1*    G 206           H1*        G 206  29.688  21.620  20.249
  503    H8     G 206           H8         G 206  26.067  22.703  19.991
  504    H1     G 206           H1         G 206  26.929  16.712  22.281
  505   1H2     G 206          1H2         G 206  28.939  16.377  22.598
  506   2H2     G 206          2H2         G 206  30.203  17.546  22.289
  507   1H5*    U 207          1H5*        U 207  26.181  25.503  15.952
  508   2H5*    U 207          2H5*        U 207  27.593  25.811  14.941
  509    H4*    U 207           H4*        U 207  25.473  27.306  14.730
  510    H3*    U 207           H3*        U 207  28.334  28.233  14.691
  511    H2*    U 207           H2*        U 207  27.606  30.455  14.287
  512   2HO*    U 207          2HO*        U 207  25.286  30.707  13.835
  513    H1*    U 207           H1*        U 207  25.688  30.422  16.310
  514    H3     U 207           H3         U 207  28.738  33.005  18.360
  515    H5     U 207           H5         U 207  30.676  29.301  18.101
  516    H6     U 207           H6         U 207  28.754  28.498  16.807
  517   1H5*    A 208          1H5*        A 208  28.540  29.500   9.506
  518   2H5*    A 208          2H5*        A 208  26.951  29.168   8.818
  519    H4*    A 208           H4*        A 208  28.557  28.086   7.450
  520    H3*    A 208           H3*        A 208  26.887  26.272   9.132
  521    H2*    A 208           H2*        A 208  28.017  24.342   8.316
  522   2HO*    A 208          2HO*        A 208  28.842  24.607   6.324
  523    H1*    A 208           H1*        A 208  30.553  25.400   8.834
  524    H8     A 208           H8         A 208  27.545  25.910  11.156
  525   1H6     A 208          1H6         A 208  30.133  21.448  14.670
  526   2H6     A 208          2H6         A 208  28.803  22.581  14.570
  527    H2     A 208           H2         A 208  32.609  21.950  11.015
  528   1H5*    G 209          1H5*        G 209  25.545  24.814   5.968
  529   2H5*    G 209          2H5*        G 209  23.866  24.278   6.024
  530    H4*    G 209           H4*        G 209  25.552  22.659   6.930
  531    H3*    G 209           H3*        G 209  23.190  23.572   8.546
  532    H2*    G 209           H2*        G 209  23.791  22.052  10.280
  533   2HO*    G 209          2HO*        G 209  26.094  21.263   8.820
  534    H1*    G 209           H1*        G 209  26.445  22.910  10.349
  535    H8     G 209           H8         G 209  24.450  25.939   9.709
  536    H1     G 209           H1         G 209  24.196  24.070  15.900
  537   1H2     G 209          1H2         G 209  24.984  22.173  16.079
  538   2H2     G 209          2H2         G 209  25.620  21.229  14.750
  539   1H5*    A 210          1H5*        A 210  23.584  19.490   9.561
  540   2H5*    A 210          2H5*        A 210  22.024  18.797   9.117
  541    H4*    A 210           H4*        A 210  22.504  18.203  11.381
  542    H3*    A 210           H3*        A 210  20.317  20.254  11.080
  543    H2*    A 210           H2*        A 210  19.882  20.083  13.407
  544   2HO*    A 210          2HO*        A 210  20.827  18.297  14.521
  545    H1*    A 210           H1*        A 210  22.620  20.226  14.082
  546    H8     A 210           H8         A 210  21.744  22.636  11.364
  547   1H6     A 210          1H6         A 210  20.201  26.669  15.869
  548   2H6     A 210          2H6         A 210  20.459  26.498  14.148
  549    H2     A 210           H2         A 210  20.926  22.705  17.741
  550   1H5*    G 211          1H5*        G 211  18.504  16.630  13.167
  551   2H5*    G 211          2H5*        G 211  16.837  16.582  12.599
  552    H4*    G 211           H4*        G 211  17.032  16.607  15.058
  553    H3*    G 211           H3*        G 211  15.561  18.823  13.659
  554    H2*    G 211           H2*        G 211  14.915  19.718  15.770
  555   2HO*    G 211          2HO*        G 211  15.819  18.326  17.642
  556    H1*    G 211           H1*        G 211  17.517  19.644  16.785
  557    H8     G 211           H8         G 211  17.842  20.590  13.237
  558    H1     G 211           H1         G 211  15.889  25.516  16.952
  559   1H2     G 211          1H2         G 211  15.348  24.805  18.810
  560   2H2     G 211          2H2         G 211  15.413  23.124  19.290
  561   1H5*    G 212          1H5*        G 212  11.869  16.924  16.100
  562   2H5*    G 212          2H5*        G 212  10.728  17.138  14.772
  563    H4*    G 212           H4*        G 212  10.047  18.184  16.936
  564    H3*    G 212           H3*        G 212  10.244  19.794  14.406
  565    H2*    G 212           H2*        G 212   9.360  21.689  15.550
  566   2HO*    G 212          2HO*        G 212   9.155  20.769  18.062
  567    H1*    G 212           H1*        G 212  11.156  21.449  17.678
  568    H8     G 212           H8         G 212  12.878  20.553  14.496
  569    H1     G 212           H1         G 212  12.546  26.933  15.529
  570   1H2     G 212          1H2         G 212  11.277  27.309  17.111
  571   2H2     G 212          2H2         G 212  10.430  26.079  18.022
  572   1H5*    G 213          1H5*        G 213   5.595  18.871  14.195
  573   2H5*    G 213          2H5*        G 213   5.340  18.938  12.451
  574    H4*    G 213           H4*        G 213   4.284  20.794  13.749
  575    H3*    G 213           H3*        G 213   6.217  21.364  11.513
  576    H2*    G 213           H2*        G 213   5.731  23.687  11.720
  577   2HO*    G 213          2HO*        G 213   3.490  23.227  12.174
  578    H1*    G 213           H1*        G 213   6.074  23.655  14.510
  579    H8     G 213           H8         G 213   8.659  21.491  12.951
  580    H1     G 213           H1         G 213  10.135  27.787  12.705
  581   1H2     G 213          1H2         G 213   8.487  28.903  13.247
  582   2H2     G 213          2H2         G 213   6.936  28.232  13.700
  583   1H5*    G 214          1H5*        G 214   4.878  24.619   9.985
  584   2H5*    G 214          2H5*        G 214   4.583  24.062   8.339
  585    H4*    G 214           H4*        G 214   6.496  25.637   8.576
  586    H3*    G 214           H3*        G 214   6.866  22.912   7.368
  587    H2*    G 214           H2*        G 214   9.134  23.437   6.870
  588   2HO*    G 214          2HO*        G 214   9.329  25.556   6.451
  589    H1*    G 214           H1*        G 214   9.670  24.357   9.453
  590    H8     G 214           H8         G 214   7.428  21.491   9.929
  591    H1     G 214           H1         G 214  13.458  19.665   8.450
  592   1H2     G 214          1H2         G 214  14.530  21.298   7.790
  593   2H2     G 214          2H2         G 214  13.890  22.921   7.656
  594   1H5*    G 215          1H5*        G 215   8.141  25.499   3.028
  595   2H5*    G 215          2H5*        G 215   6.717  24.615   2.483
  596    H4*    G 215           H4*        G 215   8.774  24.307   1.088
  597    H3*    G 215           H3*        G 215   7.294  21.971   2.267
  598    H2*    G 215           H2*        G 215   8.738  20.476   1.103
  599   2HO*    G 215          2HO*        G 215  10.375  21.645  -0.308
  600    H1*    G 215           H1*        G 215  11.057  21.764   1.972
  601    H8     G 215           H8         G 215   8.598  21.842   4.752
  602    H1     G 215           H1         G 215  11.661  16.165   4.236
  603   1H2     G 215          1H2         G 215  12.705  16.105   2.458
  604   2H2     G 215          2H2         G 215  12.745  17.400   1.283
  605   1H5*    C 216          1H5*        C 216   5.306  21.972  -1.998
  606   2H5*    C 216          2H5*        C 216   3.942  20.880  -1.758
  607    H4*    C 216           H4*        C 216   6.026  19.965  -2.921
  608    H3*    C 216           H3*        C 216   4.627  18.578  -0.643
  609    H2*    C 216           H2*        C 216   6.071  16.714  -0.924
  610   2HO*    C 216          2HO*        C 216   6.656  16.449  -2.996
  611    H1*    C 216           H1*        C 216   8.381  18.307  -1.067
  612   1H4     C 216          1H4         C 216   8.015  16.415   5.030
  613   2H4     C 216          2H4         C 216   6.979  17.784   5.365
  614    H5     C 216           H5         C 216   6.162  19.253   3.707
  615    H6     C 216           H6         C 216   6.138  19.775   1.293
  616   1H5*    U 217          1H5*        U 217   3.702  15.370  -3.864
  617   2H5*    U 217          2H5*        U 217   2.158  14.814  -3.217
  618    H4*    U 217           H4*        U 217   3.992  13.096  -3.326
  619    H3*    U 217           H3*        U 217   2.512  13.687  -0.772
  620    H2*    U 217           H2*        U 217   3.638  11.862   0.267
  621   2HO*    U 217          2HO*        U 217   5.082  10.620  -1.241
  622    H1*    U 217           H1*        U 217   6.155  12.708  -0.641
  623    H3     U 217           H3         U 217   6.351  13.531   3.813
  624    H5     U 217           H5         U 217   3.906  16.591   2.330
  625    H6     U 217           H6         U 217   3.956  15.446   0.163
  626   1H5*    G 218          1H5*        G 218  -0.264   9.459  -1.934
  627   2H5*    G 218          2H5*        G 218  -0.404   8.959  -0.249
  628    H4*    G 218           H4*        G 218   0.930   7.261  -0.767
  629    H3*    G 218           H3*        G 218   2.934   9.501  -0.823
  630    H2*    G 218           H2*        G 218   4.592   8.032  -1.621
  631   2HO*    G 218          2HO*        G 218   4.396   6.070  -0.718
  632    H1*    G 218           H1*        G 218   2.698   6.714  -3.363
  633    H8     G 218           H8         G 218   2.863  10.438  -3.684
  634    H1     G 218           H1         G 218   7.236   7.322  -7.296
  635   1H2     G 218          1H2         G 218   7.264   5.326  -6.776
  636   2H2     G 218          2H2         G 218   6.252   4.605  -5.546
  637   1H5*    C 219          1H5*        C 219   4.254   6.701   1.986
  638   2H5*    C 219          2H5*        C 219   3.792   5.366   3.041
  639    H4*    C 219           H4*        C 219   5.038   6.561   4.510
  640    H3*    C 219           H3*        C 219   2.239   7.593   4.745
  641    H2*    C 219           H2*        C 219   2.892   9.288   6.238
  642   2HO*    C 219          2HO*        C 219   5.280   9.058   6.921
  643    H1*    C 219           H1*        C 219   5.205  10.011   4.812
  644   1H4     C 219          1H4         C 219   0.387  13.986   3.198
  645   2H4     C 219          2H4         C 219   0.402  13.184   1.642
  646    H5     C 219           H5         C 219   1.677  11.253   1.169
  647    H6     C 219           H6         C 219   3.268   9.600   2.082
  648   1H5*    G 220          1H5*        G 220   5.229   3.559   6.484
  649   2H5*    G 220          2H5*        G 220   5.319   5.295   6.184
  650    H4*    G 220           H4*        G 220   6.736   3.117   4.911
  651    H3*    G 220           H3*        G 220   7.017   6.128   4.956
  652    H2*    G 220           H2*        G 220   8.592   5.961   3.245
  653   2HO*    G 220          2HO*        G 220   9.161   3.403   3.020
  654    H1*    G 220           H1*        G 220   7.199   3.576   2.200
  655    H8     G 220           H8         G 220   6.660   4.129  -0.196
  656    H1     G 220           H1         G 220   6.725  10.502   0.926
  657   1H2     G 220          1H2         G 220   6.994  10.843   2.942
  658   2H2     G 220          2H2         G 220   7.173   9.591   4.149
  659   1H5*    G 221          1H5*        G 221  10.505   5.228   5.841
  660   2H5*    G 221          2H5*        G 221  11.565   6.394   6.631
  661    H4*    G 221           H4*        G 221  11.009   6.345   3.973
  662    H3*    G 221           H3*        G 221  11.907   8.616   5.747
  663    H2*    G 221           H2*        G 221  11.986  10.012   3.831
  664   2HO*    G 221          2HO*        G 221  11.966   8.987   1.785
  665    H1*    G 221           H1*        G 221   9.484   9.106   2.879
  666    H8     G 221           H8         G 221   9.235   9.605   6.534
  667    H1     G 221           H1         G 221   8.817  15.144   3.213
  668   1H2     G 221          1H2         G 221   9.356  14.813   1.251
  669   2H2     G 221          2H2         G 221   9.848  13.265   0.602
  670   1H5*    C 222          1H5*        C 222  15.693   7.975   3.581
  671   2H5*    C 222          2H5*        C 222  16.938   8.888   4.433
  672    H4*    C 222           H4*        C 222  15.782   9.949   2.388
  673    H3*    C 222           H3*        C 222  16.214  11.393   5.009
  674    H2*    C 222           H2*        C 222  15.493  13.375   3.961
  675   2HO*    C 222          2HO*        C 222  15.441  11.918   1.493
  676    H1*    C 222           H1*        C 222  13.445  11.964   2.500
  677   1H4     C 222          1H4         C 222  10.413  15.438   6.942
  678   2H4     C 222          2H4         C 222  10.658  14.129   8.077
  679    H5     C 222           H5         C 222  11.951  12.210   7.612
  680    H6     C 222           H6         C 222  13.344  11.061   5.927
  681   1H5*    U 223          1H5*        U 223  16.955  14.489   2.661
  682   2H5*    U 223          2H5*        U 223  18.635  14.905   2.999
  683    H4*    U 223           H4*        U 223  17.340  16.847   3.394
  684    H3*    U 223           H3*        U 223  18.286  15.508   5.914
  685    H2*    U 223           H2*        U 223  17.264  17.150   7.221
  686   2HO*    U 223          2HO*        U 223  16.984  18.574   4.732
  687    H1*    U 223           H1*        U 223  15.076  17.402   5.291
  688    H3     U 223           H3         U 223  12.938  17.018   9.298
  689    H5     U 223           H5         U 223  14.424  13.180   8.527
  690    H6     U 223           H6         U 223  15.641  14.140   6.626
  691   1H5*    U 224          1H5*        U 224  20.522  18.263   2.152
  692   2H5*    U 224          2H5*        U 224  18.978  17.885   2.915
  693    H4*    U 224           H4*        U 224  19.880  16.299   0.535
  694    H3*    U 224           H3*        U 224  19.118  19.162   0.460
  695    H2*    U 224           H2*        U 224  17.483  18.865  -1.221
  696   2HO*    U 224          2HO*        U 224  17.408  16.511  -2.032
  697    H1*    U 224           H1*        U 224  16.208  16.735  -0.023
  698    H3     U 224           H3         U 224  13.228  19.769   1.356
  699    H5     U 224           H5         U 224  16.765  21.107   3.155
  700    H6     U 224           H6         U 224  17.927  19.285   1.995
  701   1H5*    A 225          1H5*        A 225  20.419  18.057  -3.618
  702   2H5*    A 225          2H5*        A 225  20.766  19.472  -4.611
  703    H4*    A 225           H4*        A 225  18.731  18.155  -5.264
  704    H3*    A 225           H3*        A 225  18.539  21.106  -4.658
  705    H2*    A 225           H2*        A 225  16.305  21.071  -5.443
  706   2HO*    A 225          2HO*        A 225  16.077  18.442  -6.105
  707    H1*    A 225           H1*        A 225  15.733  18.648  -4.057
  708    H8     A 225           H8         A 225  17.551  20.984  -1.832
  709   1H6     A 225          1H6         A 225  12.048  23.624  -0.526
  710   2H6     A 225          2H6         A 225  13.734  23.557  -0.063
  711    H2     A 225           H2         A 225  11.479  20.841  -3.942
  712   1H5*    G 226          1H5*        G 226  17.532  19.864  -8.383
  713   2H5*    G 226          2H5*        G 226  17.808  20.771  -9.870
  714    H4*    G 226           H4*        G 226  15.511  20.174  -9.807
  715    H3*    G 226           H3*        G 226  16.023  23.087  -9.265
  716    H2*    G 226           H2*        G 226  13.674  23.481  -9.250
  717   2HO*    G 226          2HO*        G 226  12.433  22.002 -10.308
  718    H1*    G 226           H1*        G 226  13.173  21.351  -7.498
  719    H8     G 226           H8         G 226  16.282  22.880  -6.287
  720    H1     G 226           H1         G 226  11.067  26.393  -4.755
  721   1H2     G 226          1H2         G 226   9.438  25.707  -5.817
  722   2H2     G 226          2H2         G 226   9.479  24.379  -6.955
  723   1H5*    G 227          1H5*        G 227  16.022  22.336 -14.631
  724   2H5*    G 227          2H5*        G 227  17.731  22.713 -14.414
  725    H4*    G 227           H4*        G 227  16.888  23.958 -16.278
  726    H3*    G 227           H3*        G 227  17.577  25.567 -13.840
  727    H2*    G 227           H2*        G 227  17.073  27.582 -15.009
  728   2HO*    G 227          2HO*        G 227  16.269  26.990 -17.354
  729    H1*    G 227           H1*        G 227  14.591  26.650 -15.886
  730    H8     G 227           H8         G 227  15.720  25.634 -12.398
  731    H1     G 227           H1         G 227  12.138  31.018 -12.639
  732   1H2     G 227          1H2         G 227  11.806  31.537 -14.608
  733   2H2     G 227          2H2         G 227  12.409  30.647 -15.987
  734   1H5*    A 228          1H5*        A 228  19.599  27.584 -17.445
  735   2H5*    A 228          2H5*        A 228  20.984  28.383 -16.701
  736    H4*    A 228           H4*        A 228  19.352  29.876 -17.907
  737    H3*    A 228           H3*        A 228  20.180  30.368 -15.056
  738    H2*    A 228           H2*        A 228  18.956  32.404 -15.064
  739   2HO*    A 228          2HO*        A 228  17.929  32.846 -17.287
  740    H1*    A 228           H1*        A 228  16.666  31.237 -16.174
  741    H8     A 228           H8         A 228  18.147  28.819 -13.784
  742   1H6     A 228          1H6         A 228  15.110  31.845  -9.249
  743   2H6     A 228          2H6         A 228  16.036  30.407  -9.620
  744    H2     A 228           H2         A 228  14.814  34.256 -12.969
  745   1H5*    G 229          1H5*        G 229  21.192  34.154 -17.414
  746   2H5*    G 229          2H5*        G 229  22.716  34.677 -16.696
  747    H4*    G 229           H4*        G 229  20.984  36.441 -16.744
  748    H3*    G 229           H3*        G 229  22.172  35.552 -14.134
  749    H2*    G 229           H2*        G 229  20.928  37.230 -12.985
  750   2HO*    G 229          2HO*        G 229  19.511  38.152 -15.163
  751    H1*    G 229           H1*        G 229  18.515  36.506 -14.193
  752    H8     G 229           H8         G 229  20.279  33.335 -13.615
  753    H1     G 229           H1         G 229  17.720  35.748  -8.184
  754   1H2     G 229          1H2         G 229  17.127  37.696  -8.507
  755   2H2     G 229          2H2         G 229  17.299  38.549 -10.025
  756   1H5*    G 230          1H5*        G 230  22.915  40.242 -14.243
  757   2H5*    G 230          2H5*        G 230  24.505  40.233 -13.481
  758    H4*    G 230           H4*        G 230  22.851  41.732 -12.388
  759    H3*    G 230           H3*        G 230  24.206  39.540 -10.845
  760    H2*    G 230           H2*        G 230  23.158  40.297  -8.844
  761   2HO*    G 230          2HO*        G 230  21.688  42.280  -9.326
  762    H1*    G 230           H1*        G 230  20.617  40.363  -9.994
  763    H8     G 230           H8         G 230  22.252  37.420 -11.471
  764    H1     G 230           H1         G 230  20.298  36.360  -5.393
  765   1H2     G 230          1H2         G 230  19.785  38.153  -4.513
  766   2H2     G 230          2H2         G 230  19.870  39.711  -5.303
  767   1H5*    G 231          1H5*        G 231  24.633  43.219  -8.403
  768   2H5*    G 231          2H5*        G 231  26.369  43.298  -8.104
  769    H4*    G 231           H4*        G 231  25.255  43.588  -6.023
  770    H3*    G 231           H3*        G 231  26.633  40.944  -6.348
  771    H2*    G 231           H2*        G 231  26.044  40.342  -4.119
  772   2HO*    G 231          2HO*        G 231  24.635  42.799  -3.844
  773    H1*    G 231           H1*        G 231  23.355  41.000  -4.469
  774    H8     G 231           H8         G 231  24.591  39.527  -7.645
  775    H1     G 231           H1         G 231  23.155  35.076  -3.171
  776   1H2     G 231          1H2         G 231  22.847  36.001  -1.354
  777   2H2     G 231          2H2         G 231  22.961  37.724  -1.083
  778   1H5*    C 232          1H5*        C 232  27.582  42.490  -2.692
  779   2H5*    C 232          2H5*        C 232  29.304  42.483  -2.311
  780    H4*    C 232           H4*        C 232  28.212  41.440  -0.499
  781    H3*    C 232           H3*        C 232  29.617  39.483  -2.296
  782    H2*    C 232           H2*        C 232  29.050  37.714  -0.815
  783   2HO*    C 232          2HO*        C 232  27.634  38.857   1.088
  784    H1*    C 232           H1*        C 232  26.363  38.508  -0.624
  785   1H4     C 232          1H4         C 232  26.353  34.021  -5.163
  786   2H4     C 232          2H4         C 232  26.913  35.204  -6.325
  787    H5     C 232           H5         C 232  27.506  37.420  -5.763
  788    H6     C 232           H6         C 232  27.709  39.064  -3.931
  789   1H5*    A 233          1H5*        A 233  30.888  38.962   1.743
  790   2H5*    A 233          2H5*        A 233  32.603  38.582   1.888
  791    H4*    A 233           H4*        A 233  31.307  36.905   3.022
  792    H3*    A 233           H3*        A 233  32.717  36.009   0.522
  793    H2*    A 233           H2*        A 233  32.017  33.773   0.935
  794   2HO*    A 233          2HO*        A 233  30.872  33.455   3.026
  795    H1*    A 233           H1*        A 233  29.355  34.498   1.385
  796    H8     A 233           H8         A 233  30.715  36.620  -1.348
  797   1H6     A 233          1H6         A 233  29.308  31.976  -5.273
  798   2H6     A 233          2H6         A 233  29.823  33.645  -5.178
  799    H2     A 233           H2         A 233  28.818  30.481  -1.118
  800   1H5*    G 234          1H5*        G 234  33.770  33.269   3.530
  801   2H5*    G 234          2H5*        G 234  35.522  33.263   3.730
  802    H4*    G 234           H4*        G 234  34.956  31.010   3.623
  803    H3*    G 234           H3*        G 234  35.982  31.977   0.973
  804    H2*    G 234           H2*        G 234  35.787  29.777   0.081
  805   2HO*    G 234          2HO*        G 234  34.638  28.587   2.274
  806    H1*    G 234           H1*        G 234  33.162  29.459   0.970
  807    H8     G 234           H8         G 234  33.665  32.994  -0.094
  808    H1     G 234           H1         G 234  32.501  28.971  -5.028
  809   1H2     G 234          1H2         G 234  32.598  27.021  -4.364
  810   2H2     G 234          2H2         G 234  32.943  26.547  -2.716
  811   1H    GLY  15          1H        GLY  15   7.304  -2.450   0.752
  812   1HA   GLY  15          1HA       GLY  15   8.762  -3.722  -0.790
  813   2HA   GLY  15          2HA       GLY  15   7.713  -3.167  -2.087
  814    H    ARG  16           H        ARG  16   7.589  -0.489  -0.617
  815    HA   ARG  16           HA       ARG  16   8.623   1.534  -0.738
  816   1HB   ARG  16          2HB       ARG  16  10.311   0.248   0.675
  817   2HB   ARG  16          3HB       ARG  16  11.244   0.048  -0.802
  818   1HG   ARG  16          2HG       ARG  16  11.744   2.304  -0.946
  819   2HG   ARG  16          3HG       ARG  16  10.396   2.770   0.092
  820   1HD   ARG  16          2HD       ARG  16  12.242   3.045   1.473
  821   2HD   ARG  16          3HD       ARG  16  11.638   1.450   1.923
  822    HE   ARG  16           HE       ARG  16  13.640   1.354  -0.124
  823   1HH1  ARG  16          2HH1      ARG  16  13.096   1.544   3.309
  824   2HH1  ARG  16          1HH1      ARG  16  14.628   0.847   3.723
  825   1HH2  ARG  16          2HH2      ARG  16  15.660   0.436   0.407
  826   2HH2  ARG  16          1HH2      ARG  16  16.085   0.218   2.071
  827    H    ALA  17           H        ALA  17   8.103   2.360  -2.684
  828    HA   ALA  17           HA       ALA  17   9.510   1.440  -5.073
  829   1HB   ALA  17          1HB       ALA  17   7.044   3.064  -4.601
  830   2HB   ALA  17          2HB       ALA  17   7.861   3.119  -6.163
  831   3HB   ALA  17          3HB       ALA  17   7.250   1.586  -5.542
  832    H    ARG  18           H        ARG  18  10.661   3.187  -2.869
  833    HA   ARG  18           HA       ARG  18  11.009   5.811  -3.631
  834   1HB   ARG  18          2HB       ARG  18  11.855   4.791  -1.525
  835   2HB   ARG  18          3HB       ARG  18  13.139   4.023  -2.448
  836   1HG   ARG  18          2HG       ARG  18  14.045   5.959  -1.415
  837   2HG   ARG  18          3HG       ARG  18  13.896   6.298  -3.141
  838   1HD   ARG  18          2HD       ARG  18  11.466   7.097  -2.044
  839   2HD   ARG  18          3HD       ARG  18  12.680   7.632  -0.882
  840    HE   ARG  18           HE       ARG  18  13.333   8.289  -3.599
  841   1HH1  ARG  18          2HH1      ARG  18  11.578   9.289  -0.763
  842   2HH1  ARG  18          1HH1      ARG  18  11.582  10.968  -1.194
  843   1HH2  ARG  18          2HH2      ARG  18  13.345  10.495  -4.176
  844   2HH2  ARG  18          1HH2      ARG  18  12.586  11.653  -3.135
  845    H    GLY  19           H        GLY  19  12.157   6.884  -5.145
  846   1HA   GLY  19          1HA       GLY  19  13.958   7.160  -6.673
  847   2HA   GLY  19          2HA       GLY  19  14.138   5.413  -6.731
  848    H    LEU  20           H        LEU  20  11.120   5.221  -7.019
  849    HA   LEU  20           HA       LEU  20  11.072   5.756  -9.911
  850   1HB   LEU  20          2HB       LEU  20  10.173   3.536  -8.241
  851   2HB   LEU  20          3HB       LEU  20   8.962   4.076  -9.403
  852    HG   LEU  20           HG       LEU  20  11.563   3.748 -10.640
  853   1HD1  LEU  20          1HD1      LEU  20  11.499   1.243 -10.522
  854   2HD1  LEU  20          2HD1      LEU  20  10.368   1.404  -9.178
  855   3HD1  LEU  20          3HD1      LEU  20  12.002   2.051  -9.036
  856   1HD2  LEU  20          1HD2      LEU  20   9.946   2.023 -11.885
  857   2HD2  LEU  20          2HD2      LEU  20   9.904   3.760 -12.182
  858   3HD2  LEU  20          3HD2      LEU  20   8.730   3.024 -11.090
  859    H    CYS  21           H        CYS  21   9.706   7.323 -10.698
  860    HA   CYS  21           HA       CYS  21   8.016   8.663  -8.862
  861   1HB   CYS  21          2HB       CYS  21   9.229   9.773 -10.754
  862   2HB   CYS  21          3HB       CYS  21   8.150   8.971 -11.879
  863    H    TYR  22           H        TYR  22   5.742   8.735  -8.949
  864    HA   TYR  22           HA       TYR  22   4.464   6.423 -10.255
  865   1HB   TYR  22          2HB       TYR  22   4.174   5.967  -8.008
  866   2HB   TYR  22          3HB       TYR  22   4.083   7.667  -7.565
  867    HD1  TYR  22           HD1      TYR  22   2.168   5.167  -9.583
  868    HD2  TYR  22           HD2      TYR  22   2.026   8.494  -6.935
  869    HE1  TYR  22           HE1      TYR  22  -0.287   5.017  -9.536
  870    HE2  TYR  22           HE2      TYR  22  -0.429   8.352  -6.879
  871    HH   TYR  22           HH       TYR  22  -2.236   7.361  -7.720
  872    H    THR  23           H        THR  23   4.469   9.838  -9.843
  873    HA   THR  23           HA       THR  23   1.806  10.394 -10.631
  874    HB   THR  23           HB       THR  23   4.239  12.161 -10.952
  875    HG1  THR  23           HG1      THR  23   2.508  11.641  -8.772
  876   1HG2  THR  23          1HG2      THR  23   2.310  12.926 -12.245
  877   2HG2  THR  23          2HG2      THR  23   2.614  13.998 -10.878
  878   3HG2  THR  23          3HG2      THR  23   1.297  12.829 -10.805
  879    H    CYS  24           H        CYS  24   4.907  10.132 -12.483
  880    HA   CYS  24           HA       CYS  24   3.264  10.301 -14.902
  881   1HB   CYS  24          2HB       CYS  24   5.254  11.025 -16.094
  882   2HB   CYS  24          3HB       CYS  24   4.962  12.080 -14.726
  883    H    GLY  25           H        GLY  25   5.730   8.590 -13.077
  884   1HA   GLY  25          1HA       GLY  25   5.866   6.204 -13.052
  885   2HA   GLY  25          2HA       GLY  25   5.232   6.185 -14.692
  886    H    SER  26           H        SER  26   7.827   8.271 -13.560
  887    HA   SER  26           HA       SER  26   9.620   6.933 -15.465
  888   1HB   SER  26          2HB       SER  26   9.501   9.744 -14.395
  889   2HB   SER  26          3HB       SER  26  10.973   9.116 -15.138
  890    HG   SER  26           HG       SER  26   9.498   8.532 -16.949
  891    HA   PRO  27           HA       PRO  27  11.672   5.344 -11.823
  892   1HB   PRO  27          2HB       PRO  27  13.495   3.867 -13.188
  893   2HB   PRO  27          3HB       PRO  27  11.821   3.350 -12.954
  894   1HG   PRO  27          2HG       PRO  27  13.087   4.646 -15.337
  895   2HG   PRO  27          3HG       PRO  27  11.941   3.294 -15.275
  896   1HD   PRO  27          2HD       PRO  27  11.179   5.825 -15.863
  897   2HD   PRO  27          3HD       PRO  27  10.123   4.684 -15.006
  898    H    GLY  28           H        GLY  28  12.651   7.211 -11.026
  899   1HA   GLY  28          1HA       GLY  28  15.377   7.426 -11.038
  900   2HA   GLY  28          2HA       GLY  28  14.864   8.453 -12.368
  901    H    HIS  29           H        HIS  29  12.397   9.292 -11.111
  902    HA   HIS  29           HA       HIS  29  13.416  10.854  -8.836
  903   1HB   HIS  29          2HB       HIS  29  12.313  12.853  -9.678
  904   2HB   HIS  29          3HB       HIS  29  13.446  12.246 -10.882
  905    HD1  HIS  29           HD1      HIS  29  12.525  11.730 -13.157
  906    HD2  HIS  29           HD2      HIS  29   9.542  12.312 -10.323
  907    HE1  HIS  29           HE1      HIS  29  10.368  11.772 -14.450
  908    H    TYR  30           H        TYR  30  11.262  12.243  -8.091
  909    HA   TYR  30           HA       TYR  30   9.093  10.279  -7.787
  910   1HB   TYR  30          2HB       TYR  30  10.851  11.233  -5.747
  911   2HB   TYR  30          3HB       TYR  30   9.236  11.851  -5.423
  912    HD1  TYR  30           HD1      TYR  30  10.825   8.635  -6.494
  913    HD2  TYR  30           HD2      TYR  30   7.895  10.552  -4.078
  914    HE1  TYR  30           HE1      TYR  30  10.186   6.455  -5.547
  915    HE2  TYR  30           HE2      TYR  30   7.250   8.380  -3.124
  916    HH   TYR  30           HH       TYR  30   7.544   6.179  -3.193
  917    H    GLN  31           H        GLN  31   7.172  11.484  -6.593
  918    HA   GLN  31           HA       GLN  31   6.060  13.273  -8.369
  919   1HB   GLN  31          2HB       GLN  31   4.725  12.075  -6.730
  920   2HB   GLN  31          3HB       GLN  31   5.488  12.962  -5.418
  921   1HG   GLN  31          2HG       GLN  31   4.204  14.779  -5.715
  922   2HG   GLN  31          3HG       GLN  31   4.197  14.620  -7.471
  923   1HE2  GLN  31          1HE2      GLN  31   3.200  12.346  -4.954
  924   2HE2  GLN  31          2HE2      GLN  31   1.561  12.205  -5.484
  925    H    ALA  32           H        ALA  32   7.860  13.966  -5.399
  926    HA   ALA  32           HA       ALA  32   7.514  16.739  -5.353
  927   1HB   ALA  32          1HB       ALA  32   9.226  16.812  -3.769
  928   2HB   ALA  32          2HB       ALA  32   8.540  15.198  -3.580
  929   3HB   ALA  32          3HB       ALA  32  10.053  15.415  -4.460
  930    H    GLN  33           H        GLN  33   9.513  14.737  -7.352
  931    HA   GLN  33           HA       GLN  33  10.704  17.156  -8.541
  932   1HB   GLN  33          2HB       GLN  33  11.926  14.393  -8.458
  933   2HB   GLN  33          3HB       GLN  33  12.661  15.838  -9.139
  934   1HG   GLN  33          2HG       GLN  33  12.999  16.800  -7.037
  935   2HG   GLN  33          3HG       GLN  33  11.871  15.696  -6.254
  936   1HE2  GLN  33          1HE2      GLN  33  15.061  16.374  -6.764
  937   2HE2  GLN  33          2HE2      GLN  33  15.744  14.836  -6.374
  938    H    CYS  34           H        CYS  34   8.111  15.707  -9.200
  939    HA   CYS  34           HA       CYS  34   8.703  14.383 -11.667
  940   1HB   CYS  34          2HB       CYS  34   6.803  13.737 -10.159
  941   2HB   CYS  34          3HB       CYS  34   6.005  15.241 -10.572
  942    HA   PRO  35           HA       PRO  35   8.876  18.231 -13.923
  943   1HB   PRO  35          2HB       PRO  35   9.009  17.108 -16.391
  944   2HB   PRO  35          3HB       PRO  35  10.385  17.157 -15.283
  945   1HG   PRO  35          2HG       PRO  35   8.482  14.915 -15.844
  946   2HG   PRO  35          3HG       PRO  35  10.245  14.866 -15.656
  947   1HD   PRO  35          2HD       PRO  35   8.548  14.154 -13.670
  948   2HD   PRO  35          3HD       PRO  35  10.127  14.902 -13.354
  949    H    LYS  36           H        LYS  36   6.400  15.881 -14.034
  950    HA   LYS  36           HA       LYS  36   4.759  17.475 -15.865
  951   1HB   LYS  36          2HB       LYS  36   4.967  14.678 -15.270
  952   2HB   LYS  36          3HB       LYS  36   3.327  15.216 -14.932
  953   1HG   LYS  36          2HG       LYS  36   3.070  14.710 -17.119
  954   2HG   LYS  36          3HG       LYS  36   3.640  16.370 -17.308
  955   1HD   LYS  36          2HD       LYS  36   5.821  14.457 -17.106
  956   2HD   LYS  36          3HD       LYS  36   4.746  14.113 -18.464
  957   1HE   LYS  36          2HE       LYS  36   4.963  16.658 -18.937
  958   2HE   LYS  36          3HE       LYS  36   6.396  16.551 -17.917
  959   1HZ   LYS  36          1HZ       LYS  36   6.779  16.265 -20.362
  960   2HZ   LYS  36          2HZ       LYS  36   5.953  14.794 -20.262
  961   3HZ   LYS  36          3HZ       LYS  36   7.387  15.019 -19.393
  962    H    LYS  37           H        LYS  37   5.446  17.479 -12.686
  963    HA   LYS  37           HA       LYS  37   2.797  17.685 -11.585
  964   1HB   LYS  37          2HB       LYS  37   5.403  17.367 -10.563
  965   2HB   LYS  37          3HB       LYS  37   4.819  18.900  -9.930
  966   1HG   LYS  37          2HG       LYS  37   3.040  16.521  -9.777
  967   2HG   LYS  37          3HG       LYS  37   4.393  16.653  -8.653
  968   1HD   LYS  37          2HD       LYS  37   3.578  18.863  -7.954
  969   2HD   LYS  37          3HD       LYS  37   2.210  18.698  -9.058
  970   1HE   LYS  37          2HE       LYS  37   1.385  16.801  -7.823
  971   2HE   LYS  37          3HE       LYS  37   2.815  16.801  -6.792
  972   1HZ   LYS  37          1HZ       LYS  37   2.144  18.761  -5.747
  973   2HZ   LYS  37          2HZ       LYS  37   0.720  17.857  -5.869
  974   3HZ   LYS  37          3HZ       LYS  37   1.005  19.135  -6.941
  975    H    ARG  38           H        ARG  38   1.649  19.329 -12.486
  976    HA   ARG  38           HA       ARG  38   2.184  21.976 -11.609
  977   1HB   ARG  38          2HB       ARG  38   3.687  21.488 -13.740
  978   2HB   ARG  38          3HB       ARG  38   2.188  21.838 -14.589
  979   1HG   ARG  38          2HG       ARG  38   2.418  24.022 -14.275
  980   2HG   ARG  38          3HG       ARG  38   2.747  23.814 -12.554
  981   1HD   ARG  38          2HD       ARG  38   4.900  23.048 -14.435
  982   2HD   ARG  38          3HD       ARG  38   4.551  24.770 -14.283
  983    HE   ARG  38           HE       ARG  38   4.768  23.671 -11.716
  984   1HH1  ARG  38          2HH1      ARG  38   6.751  24.366 -14.492
  985   2HH1  ARG  38          1HH1      ARG  38   8.198  24.588 -13.566
  986   1HH2  ARG  38          2HH2      ARG  38   6.667  23.961 -10.486
  987   2HH2  ARG  38          1HH2      ARG  38   8.150  24.356 -11.287
  988    H    LYS  39           H        LYS  39   0.493  23.482 -12.223
  989    HA   LYS  39           HA       LYS  39  -1.752  22.676 -13.760
  990   1HB   LYS  39          2HB       LYS  39  -2.123  21.210 -11.820
  991   2HB   LYS  39          3HB       LYS  39  -2.088  22.610 -10.755
  992   1HG   LYS  39          2HG       LYS  39  -4.150  23.359 -11.444
  993   2HG   LYS  39          3HG       LYS  39  -4.055  22.519 -12.994
  994   1HD   LYS  39          2HD       LYS  39  -5.680  21.441 -11.541
  995   2HD   LYS  39          3HD       LYS  39  -4.307  20.370 -11.830
  996   1HE   LYS  39          2HE       LYS  39  -3.611  20.462  -9.673
  997   2HE   LYS  39          3HE       LYS  39  -4.132  22.132  -9.463
  998   1HZ   LYS  39          1HZ       LYS  39  -5.376  20.148  -8.304
  999   2HZ   LYS  39          2HZ       LYS  39  -6.198  20.086  -9.781
 1000   3HZ   LYS  39          3HZ       LYS  39  -6.217  21.506  -8.862
 1001    H    SER  40           H        SER  40  -1.069  24.582 -10.820
 1002    HA   SER  40           HA       SER  40  -1.331  26.791 -10.346
 1003   1HB   SER  40          2HB       SER  40  -0.142  26.769 -12.779
 1004   2HB   SER  40          3HB       SER  40  -1.628  27.636 -13.168
 1005    HG   SER  40           HG       SER  40  -0.817  29.307 -12.210
 1006    H    GLY  41           H        GLY  41  -3.621  25.234 -10.300
 1007   1HA   GLY  41          1HA       GLY  41  -5.729  26.670 -11.694
 1008   2HA   GLY  41          2HA       GLY  41  -5.931  25.264 -10.659
 1009    H    ASN  42           H        ASN  42  -6.866  25.602  -8.760
 1010    HA   ASN  42           HA       ASN  42  -6.579  28.234  -7.489
 1011   1HB   ASN  42          2HB       ASN  42  -9.106  26.808  -8.220
 1012   2HB   ASN  42          3HB       ASN  42  -9.073  27.790  -6.758
 1013   1HD2  ASN  42          1HD2      ASN  42  -8.766  27.809 -10.231
 1014   2HD2  ASN  42          2HD2      ASN  42  -9.019  29.505 -10.440
 1015    H    SER  43           H        SER  43  -6.973  28.236  -5.189
 1016    HA   SER  43           HA       SER  43  -6.713  27.426  -3.080
 1017   1HB   SER  43          2HB       SER  43  -7.649  24.749  -4.114
 1018   2HB   SER  43          3HB       SER  43  -7.810  25.401  -2.484
 1019    HG   SER  43           HG       SER  43  -9.672  26.105  -3.130
 1020    H    ARG  44           H        ARG  44  -4.387  27.700  -3.764
 1021    HA   ARG  44           HA       ARG  44  -2.990  25.106  -3.705
 1022   1HB   ARG  44          2HB       ARG  44  -2.749  27.113  -5.584
 1023   2HB   ARG  44          3HB       ARG  44  -1.387  27.413  -4.514
 1024   1HG   ARG  44          2HG       ARG  44  -0.255  25.678  -5.312
 1025   2HG   ARG  44          3HG       ARG  44  -1.651  24.606  -5.179
 1026   1HD   ARG  44          2HD       ARG  44  -2.522  25.441  -7.285
 1027   2HD   ARG  44          3HD       ARG  44  -1.185  26.583  -7.407
 1028    HE   ARG  44           HE       ARG  44   0.147  24.885  -8.170
 1029   1HH1  ARG  44          2HH1      ARG  44  -2.709  23.527  -6.714
 1030   2HH1  ARG  44          1HH1      ARG  44  -2.362  21.911  -7.230
 1031   1HH2  ARG  44          2HH2      ARG  44   0.614  22.761  -8.857
 1032   2HH2  ARG  44          1HH2      ARG  44  -0.472  21.476  -8.449
 1033    H    GLU  45           H        GLU  45  -0.659  25.425  -2.796
 1034    HA   GLU  45           HA       GLU  45  -0.944  26.841  -0.235
 1035   1HB   GLU  45          2HB       GLU  45   0.816  24.504  -0.996
 1036   2HB   GLU  45          3HB       GLU  45   0.835  25.297   0.573
 1037   1HG   GLU  45          2HG       GLU  45  -1.473  24.648   0.953
 1038   2HG   GLU  45          3HG       GLU  45  -1.537  23.896  -0.639
 1039    H    ARG  46           H        ARG  46   1.152  26.378  -3.012
 1040    HA   ARG  46           HA       ARG  46   3.075  28.307  -1.937
 1041   1HB   ARG  46          2HB       ARG  46   3.654  26.026  -3.097
 1042   2HB   ARG  46          3HB       ARG  46   3.400  26.936  -4.579
 1043   1HG   ARG  46          2HG       ARG  46   5.202  28.349  -4.168
 1044   2HG   ARG  46          3HG       ARG  46   5.246  27.947  -2.451
 1045   1HD   ARG  46          2HD       ARG  46   5.904  25.622  -3.098
 1046   2HD   ARG  46          3HD       ARG  46   6.037  26.184  -4.763
 1047    HE   ARG  46           HE       ARG  46   7.912  26.614  -2.646
 1048   1HH1  ARG  46          2HH1      ARG  46   6.647  27.926  -5.611
 1049   2HH1  ARG  46          1HH1      ARG  46   8.082  28.824  -5.980
 1050   1HH2  ARG  46          2HH2      ARG  46   9.807  27.791  -3.118
 1051   2HH2  ARG  46          1HH2      ARG  46   9.880  28.745  -4.560
 1052    H    CYS  47           H        CYS  47   4.058  29.868  -3.742
 1053    HA   CYS  47           HA       CYS  47   1.777  30.888  -5.274
 1054   1HB   CYS  47          2HB       CYS  47   2.179  32.323  -3.317
 1055   2HB   CYS  47          3HB       CYS  47   3.854  32.530  -3.787
 1056    H    GLN  48           H        GLN  48   2.243  30.721  -7.360
 1057    HA   GLN  48           HA       GLN  48   5.010  30.475  -8.256
 1058   1HB   GLN  48          2HB       GLN  48   2.646  29.207  -9.001
 1059   2HB   GLN  48          3HB       GLN  48   2.989  30.298 -10.337
 1060   1HG   GLN  48          2HG       GLN  48   3.990  28.209 -10.840
 1061   2HG   GLN  48          3HG       GLN  48   5.285  29.335 -10.437
 1062   1HE2  GLN  48          1HE2      GLN  48   6.210  27.006 -10.288
 1063   2HE2  GLN  48          2HE2      GLN  48   6.238  26.336  -8.696
 1064    H    LEU  49           H        LEU  49   3.938  33.050  -7.395
 1065    HA   LEU  49           HA       LEU  49   4.316  34.530  -9.912
 1066   1HB   LEU  49          2HB       LEU  49   2.034  34.529  -8.269
 1067   2HB   LEU  49          3HB       LEU  49   2.844  36.069  -7.988
 1068    HG   LEU  49           HG       LEU  49   2.470  35.284 -10.813
 1069   1HD1  LEU  49          1HD1      LEU  49   0.342  34.573  -9.988
 1070   2HD1  LEU  49          2HD1      LEU  49   0.130  36.138 -10.771
 1071   3HD1  LEU  49          3HD1      LEU  49   0.175  36.033  -9.011
 1072   1HD2  LEU  49          1HD2      LEU  49   2.568  37.512 -11.169
 1073   2HD2  LEU  49          2HD2      LEU  49   3.346  37.503  -9.585
 1074   3HD2  LEU  49          3HD2      LEU  49   1.631  37.896  -9.724
 1075    H    CYS  50           H        CYS  50   4.809  34.400  -6.357
 1076    HA   CYS  50           HA       CYS  50   6.969  36.327  -6.774
 1077   1HB   CYS  50          2HB       CYS  50   6.451  37.560  -4.840
 1078   2HB   CYS  50          3HB       CYS  50   4.917  37.366  -5.666
 1079    H    ASN  51           H        ASN  51   6.417  33.312  -6.480
 1080    HA   ASN  51           HA       ASN  51   7.425  31.480  -5.586
 1081   1HB   ASN  51          2HB       ASN  51   9.569  33.310  -4.519
 1082   2HB   ASN  51          3HB       ASN  51   9.722  31.633  -5.038
 1083   1HD2  ASN  51          1HD2      ASN  51   8.733  31.458  -7.434
 1084   2HD2  ASN  51          2HD2      ASN  51   9.481  32.551  -8.545
 1085    H    GLY  52           H        GLY  52   5.669  33.325  -3.921
 1086   1HA   GLY  52          1HA       GLY  52   6.541  33.230  -1.236
 1087   2HA   GLY  52          2HA       GLY  52   4.878  33.434  -1.768
 1088    H    MET  53           H        MET  53   5.740  31.937   0.505
 1089    HA   MET  53           HA       MET  53   4.890  29.241  -0.326
 1090   1HB   MET  53          2HB       MET  53   7.269  29.310   0.385
 1091   2HB   MET  53          3HB       MET  53   6.757  29.910   1.957
 1092   1HG   MET  53          2HG       MET  53   7.201  27.556   2.098
 1093   2HG   MET  53          3HG       MET  53   5.475  27.843   2.305
 1094   1HE   MET  53          1HE       MET  53   3.795  27.230   1.148
 1095   2HE   MET  53          2HE       MET  53   3.690  26.590  -0.492
 1096   3HE   MET  53          3HE       MET  53   3.988  25.500   0.863
 1097    H    GLY  54           H        GLY  54   2.724  29.540   0.126
 1098   1HA   GLY  54          1HA       GLY  54   1.592  28.842   2.430
 1099   2HA   GLY  54          2HA       GLY  54   1.942  30.534   2.753
 1100    H    HIS  55           H        HIS  55   1.289  31.911   0.635
 1101    HA   HIS  55           HA       HIS  55  -1.582  31.528   0.437
 1102   1HB   HIS  55          2HB       HIS  55  -1.562  33.747  -0.661
 1103   2HB   HIS  55          3HB       HIS  55  -0.764  33.768   0.909
 1104    HD1  HIS  55           HD1      HIS  55   1.938  33.705   0.794
 1105    HD2  HIS  55           HD2      HIS  55  -0.050  34.694  -2.717
 1106    HE1  HIS  55           HE1      HIS  55   3.668  34.789  -0.675
 1107    H    ASN  56           H        ASN  56  -2.304  32.497  -1.948
 1108    HA   ASN  56           HA       ASN  56  -1.067  30.648  -3.883
 1109   1HB   ASN  56          2HB       ASN  56  -3.379  30.016  -3.156
 1110   2HB   ASN  56          3HB       ASN  56  -3.958  31.536  -3.832
 1111   1HD2  ASN  56          1HD2      ASN  56  -5.185  30.800  -5.462
 1112   2HD2  ASN  56          2HD2      ASN  56  -4.594  29.861  -6.787
 1113    H    ALA  57           H        ALA  57  -0.940  31.323  -6.061
 1114    HA   ALA  57           HA       ALA  57  -0.136  33.945  -6.488
 1115   1HB   ALA  57          1HB       ALA  57  -1.143  32.769  -8.922
 1116   2HB   ALA  57          2HB       ALA  57   0.518  33.130  -8.449
 1117   3HB   ALA  57          3HB       ALA  57  -0.219  31.596  -7.983
 1118    H    LYS  58           H        LYS  58  -3.265  32.422  -7.166
 1119    HA   LYS  58           HA       LYS  58  -4.492  34.583  -8.443
 1120   1HB   LYS  58          2HB       LYS  58  -5.694  32.412  -6.716
 1121   2HB   LYS  58          3HB       LYS  58  -6.636  33.525  -7.700
 1122   1HG   LYS  58          2HG       LYS  58  -4.526  31.715  -8.842
 1123   2HG   LYS  58          3HG       LYS  58  -6.223  31.254  -8.694
 1124   1HD   LYS  58          2HD       LYS  58  -6.899  32.697 -10.331
 1125   2HD   LYS  58          3HD       LYS  58  -5.599  33.846 -10.006
 1126   1HE   LYS  58          2HE       LYS  58  -5.150  32.867 -12.124
 1127   2HE   LYS  58          3HE       LYS  58  -4.006  32.170 -10.979
 1128   1HZ   LYS  58          1HZ       LYS  58  -5.071  30.553 -12.528
 1129   2HZ   LYS  58          2HZ       LYS  58  -6.546  30.848 -11.754
 1130   3HZ   LYS  58          3HZ       LYS  58  -5.258  30.175 -10.888
 1131    H    GLN  59           H        GLN  59  -3.681  34.106  -5.134
 1132    HA   GLN  59           HA       GLN  59  -5.259  36.482  -4.397
 1133   1HB   GLN  59          2HB       GLN  59  -5.589  34.085  -3.278
 1134   2HB   GLN  59          3HB       GLN  59  -4.238  34.638  -2.295
 1135   1HG   GLN  59          2HG       GLN  59  -5.690  36.776  -1.994
 1136   2HG   GLN  59          3HG       GLN  59  -7.011  35.716  -2.481
 1137   1HE2  GLN  59          1HE2      GLN  59  -7.890  36.071  -0.377
 1138   2HE2  GLN  59          2HE2      GLN  59  -7.291  35.184   0.978
 1139    H    CYS  60           H        CYS  60  -2.342  36.043  -5.506
 1140    HA   CYS  60           HA       CYS  60  -0.799  36.995  -3.277
 1141   1HB   CYS  60          2HB       CYS  60   0.216  35.423  -4.853
 1142   2HB   CYS  60          3HB       CYS  60  -0.050  36.533  -6.183
 1143    H    ARG  61           H        ARG  61  -0.356  39.088  -2.905
 1144    HA   ARG  61           HA       ARG  61  -0.413  41.359  -3.012
 1145   1HB   ARG  61          2HB       ARG  61   0.197  40.489  -5.756
 1146   2HB   ARG  61          3HB       ARG  61  -0.465  42.114  -5.635
 1147   1HG   ARG  61          2HG       ARG  61   1.923  41.127  -4.091
 1148   2HG   ARG  61          3HG       ARG  61   2.004  42.040  -5.599
 1149   1HD   ARG  61          2HD       ARG  61   0.389  43.157  -3.368
 1150   2HD   ARG  61          3HD       ARG  61   2.145  43.220  -3.229
 1151    HE   ARG  61           HE       ARG  61   1.542  44.187  -5.741
 1152   1HH1  ARG  61          2HH1      ARG  61   0.808  45.035  -2.445
 1153   2HH1  ARG  61          1HH1      ARG  61   0.667  46.729  -2.774
 1154   1HH2  ARG  61          2HH2      ARG  61   1.358  46.416  -6.188
 1155   2HH2  ARG  61          1HH2      ARG  61   0.979  47.515  -4.904
 1156    H    LYS  62           H        LYS  62  -1.681  43.267  -4.061
 1157    HA   LYS  62           HA       LYS  62  -4.356  42.518  -4.924
 1158   1HB   LYS  62          2HB       LYS  62  -3.774  43.955  -2.338
 1159   2HB   LYS  62          3HB       LYS  62  -5.334  44.059  -3.143
 1160   1HG   LYS  62          2HG       LYS  62  -5.869  42.301  -1.877
 1161   2HG   LYS  62          3HG       LYS  62  -4.952  41.369  -3.062
 1162   1HD   LYS  62          2HD       LYS  62  -3.153  41.113  -1.668
 1163   2HD   LYS  62          3HD       LYS  62  -3.468  42.621  -0.807
 1164   1HE   LYS  62          2HE       LYS  62  -3.895  40.724   0.641
 1165   2HE   LYS  62          3HE       LYS  62  -5.400  41.571   0.289
 1166   1HZ   LYS  62          1HZ       LYS  62  -4.743  39.403  -1.518
 1167   2HZ   LYS  62          2HZ       LYS  62  -6.226  39.819  -0.818
 1168   3HZ   LYS  62          3HZ       LYS  62  -5.091  38.931   0.069
 1169    H    ARG  63           H        ARG  63  -5.682  44.793  -4.922
 1170    HA   ARG  63           HA       ARG  63  -4.464  46.317  -6.962
 1171   1HB   ARG  63          2HB       ARG  63  -6.407  47.864  -6.623
 1172   2HB   ARG  63          3HB       ARG  63  -6.851  46.183  -6.890
 1173   1HG   ARG  63          2HG       ARG  63  -7.263  45.874  -4.533
 1174   2HG   ARG  63          3HG       ARG  63  -6.704  47.514  -4.193
 1175   1HD   ARG  63          2HD       ARG  63  -8.601  48.022  -6.042
 1176   2HD   ARG  63          3HD       ARG  63  -9.269  46.569  -5.299
 1177    HE   ARG  63           HE       ARG  63  -8.421  48.574  -3.414
 1178   1HH1  ARG  63          2HH1      ARG  63 -11.031  47.416  -5.407
 1179   2HH1  ARG  63          1HH1      ARG  63 -12.267  48.158  -4.447
 1180   1HH2  ARG  63          2HH2      ARG  63 -10.040  49.556  -2.143
 1181   2HH2  ARG  63          1HH2      ARG  63 -11.702  49.377  -2.590
 1182    H    ASP  64           H        ASP  64  -4.661  46.704  -3.491
 1183    HA   ASP  64           HA       ASP  64  -3.700  48.172  -2.043
 1184   1HB   ASP  64          2HB       ASP  64  -1.594  47.474  -2.885
 1185   2HB   ASP  64          3HB       ASP  64  -1.809  48.375  -4.383
  Start of MODEL    5
    1   1H5*    C 160          1H5*        C 160  30.421  26.525 -12.269
    2   2H5*    C 160          2H5*        C 160  28.891  25.688 -12.013
    3    H4*    C 160           H4*        C 160  30.270  24.785 -10.387
    4    H3*    C 160           H3*        C 160  28.584  26.967  -9.194
    5    H2*    C 160           H2*        C 160  29.518  26.532  -7.054
    6   2HO*    C 160          2HO*        C 160  31.244  24.533  -7.969
    7    H1*    C 160           H1*        C 160  32.148  26.538  -7.968
    8   1H4     C 160          1H4         C 160  31.036  32.554  -6.111
    9   2H4     C 160          2H4         C 160  30.412  32.905  -7.707
   10    H5     C 160           H5         C 160  30.104  31.274  -9.386
   11    H6     C 160           H6         C 160  30.320  28.880  -9.954
   12   1H5*    U 161          1H5*        U 161  28.257  23.815  -6.749
   13   2H5*    U 161          2H5*        U 161  26.619  23.233  -6.453
   14    H4*    U 161           H4*        U 161  27.549  23.469  -4.328
   15    H3*    U 161           H3*        U 161  25.784  25.807  -4.997
   16    H2*    U 161           H2*        U 161  26.139  26.700  -2.819
   17   2HO*    U 161          2HO*        U 161  26.737  25.258  -1.272
   18    H1*    U 161           H1*        U 161  28.910  26.435  -2.961
   19    H3     U 161           H3         U 161  27.941  30.902  -3.302
   20    H5     U 161           H5         U 161  27.575  29.402  -7.195
   21    H6     U 161           H6         U 161  27.798  27.153  -6.243
   22   1H5*    G 162          1H5*        G 162  24.422  24.153  -1.241
   23   2H5*    G 162          2H5*        G 162  22.661  24.112  -1.187
   24    H4*    G 162           H4*        G 162  23.464  25.267   0.748
   25    H3*    G 162           H3*        G 162  22.090  26.992  -1.294
   26    H2*    G 162           H2*        G 162  22.267  28.861   0.173
   27   2HO*    G 162          2HO*        G 162  23.675  27.811   2.209
   28    H1*    G 162           H1*        G 162  24.989  28.454   0.637
   29    H8     G 162           H8         G 162  24.358  27.606  -2.910
   30    H1     G 162           H1         G 162  24.729  33.984  -1.879
   31   1H2     G 162          1H2         G 162  24.689  34.358   0.148
   32   2H2     G 162          2H2         G 162  24.572  33.126   1.385
   33   1H5*    C 163          1H5*        C 163  20.570  27.790   2.269
   34   2H5*    C 163          2H5*        C 163  18.826  27.637   2.475
   35    H4*    C 163           H4*        C 163  19.281  29.738   3.334
   36    H3*    C 163           H3*        C 163  18.329  29.997   0.494
   37    H2*    C 163           H2*        C 163  18.413  32.364   0.685
   38   2HO*    C 163          2HO*        C 163  19.409  32.526   3.233
   39    H1*    C 163           H1*        C 163  20.983  32.377   1.779
   40   1H4     C 163          1H4         C 163  21.995  33.092  -4.480
   41   2H4     C 163          2H4         C 163  21.774  31.373  -4.710
   42    H5     C 163           H5         C 163  21.128  29.888  -2.990
   43    H6     C 163           H6         C 163  20.529  29.687  -0.603
   44   1H5*    C 164          1H5*        C 164  16.283  32.643   2.743
   45   2H5*    C 164          2H5*        C 164  14.534  32.650   2.520
   46    H4*    C 164           H4*        C 164  15.210  34.868   2.188
   47    H3*    C 164           H3*        C 164  14.699  33.474  -0.428
   48    H2*    C 164           H2*        C 164  15.063  35.527  -1.574
   49   2HO*    C 164          2HO*        C 164  15.730  37.096   0.557
   50    H1*    C 164           H1*        C 164  17.440  36.064  -0.183
   51   1H4     C 164          1H4         C 164  19.359  33.263  -5.591
   52   2H4     C 164          2H4         C 164  19.028  31.698  -4.883
   53    H5     C 164           H5         C 164  18.021  31.395  -2.768
   54    H6     C 164           H6         C 164  17.072  32.533  -0.792
   55   1H5*    C 165          1H5*        C 165  11.923  36.841  -0.153
   56   2H5*    C 165          2H5*        C 165  10.558  36.681  -1.259
   57    H4*    C 165           H4*        C 165  12.113  38.581  -1.745
   58    H3*    C 165           H3*        C 165  11.480  36.500  -3.823
   59    H2*    C 165           H2*        C 165  12.700  37.759  -5.431
   60   2HO*    C 165          2HO*        C 165  12.339  39.854  -4.932
   61    H1*    C 165           H1*        C 165  14.915  38.075  -3.739
   62   1H4     C 165          1H4         C 165  16.163  32.980  -7.424
   63   2H4     C 165          2H4         C 165  15.504  31.968  -6.159
   64    H5     C 165           H5         C 165  14.437  32.804  -4.225
   65    H6     C 165           H6         C 165  13.733  34.839  -3.016
   66   1H5*    U 166          1H5*        U 166  10.171  40.209  -5.891
   67   2H5*    U 166          2H5*        U 166   8.540  39.809  -6.429
   68    H4*    U 166           H4*        U 166   9.827  40.605  -8.295
   69    H3*    U 166           H3*        U 166   9.090  37.695  -8.346
   70    H2*    U 166           H2*        U 166  10.068  37.470 -10.500
   71   2HO*    U 166          2HO*        U 166  10.605  39.410 -11.615
   72    H1*    U 166           H1*        U 166  12.436  38.765  -9.760
   73    H3     U 166           H3         U 166  13.206  34.252 -10.391
   74    H5     U 166           H5         U 166  12.177  34.702  -6.356
   75    H6     U 166           H6         U 166  11.540  37.012  -6.879
   76   1H5*    C 167          1H5*        C 167   7.420  39.151 -12.173
   77   2H5*    C 167          2H5*        C 167   5.738  38.620 -12.139
   78    H4*    C 167           H4*        C 167   6.646  37.875 -14.187
   79    H3*    C 167           H3*        C 167   6.318  35.667 -12.174
   80    H2*    C 167           H2*        C 167   7.006  34.080 -13.809
   81   2HO*    C 167          2HO*        C 167   7.483  35.174 -15.993
   82    H1*    C 167           H1*        C 167   9.266  35.553 -14.539
   83   1H4     C 167          1H4         C 167  11.305  31.436 -10.088
   84   2H4     C 167          2H4         C 167  10.888  32.607  -8.857
   85    H5     C 167           H5         C 167   9.765  34.637  -9.297
   86    H6     C 167           H6         C 167   8.758  36.060 -11.046
   87   1H5*    A 168          1H5*        A 168   3.186  34.027 -14.106
   88   2H5*    A 168          2H5*        A 168   2.088  34.777 -15.265
   89    H4*    A 168           H4*        A 168   1.516  33.283 -12.787
   90    H3*    A 168           H3*        A 168   0.171  33.674 -15.459
   91    H2*    A 168           H2*        A 168  -1.861  33.090 -14.534
   92   2HO*    A 168          2HO*        A 168  -1.814  31.380 -13.115
   93    H1*    A 168           H1*        A 168  -0.857  33.935 -11.849
   94    H8     A 168           H8         A 168  -2.723  34.997 -15.006
   95   1H6     A 168          1H6         A 168  -6.425  38.235 -11.164
   96   2H6     A 168          2H6         A 168  -6.184  37.754 -12.829
   97    H2     A 168           H2         A 168  -3.133  36.467  -8.760
   98   1H5*    U 169          1H5*        U 169   0.785  33.550 -17.949
   99   2H5*    U 169          2H5*        U 169  -0.733  32.946 -17.284
  100    H4*    U 169           H4*        U 169   0.529  32.422 -19.941
  101    H3*    U 169           H3*        U 169  -2.215  33.205 -18.966
  102    H2*    U 169           H2*        U 169  -3.144  32.340 -20.946
  103   2HO*    U 169          2HO*        U 169  -0.660  31.704 -22.085
  104    H1*    U 169           H1*        U 169  -1.283  30.114 -20.917
  105    H3     U 169           H3         U 169  -5.390  28.149 -21.162
  106    H5     U 169           H5         U 169  -5.098  29.487 -17.204
  107    H6     U 169           H6         U 169  -3.035  30.644 -17.851
  108   1H5*    C 170          1H5*        C 170  -0.744  37.645 -19.143
  109   2H5*    C 170          2H5*        C 170  -0.208  36.018 -18.721
  110    H4*    C 170           H4*        C 170  -2.260  36.776 -16.888
  111    H3*    C 170           H3*        C 170  -0.395  39.005 -17.531
  112    H2*    C 170           H2*        C 170   0.081  39.434 -15.253
  113   2HO*    C 170          2HO*        C 170  -1.267  37.779 -13.822
  114    H1*    C 170           H1*        C 170   0.660  36.843 -14.572
  115   1H4     C 170          1H4         C 170   6.168  39.242 -16.791
  116   2H4     C 170          2H4         C 170   5.772  38.587 -18.364
  117    H5     C 170           H5         C 170   3.703  37.574 -18.884
  118    H6     C 170           H6         C 170   1.483  36.933 -18.014
  119   1H5*    C 171          1H5*        C 171  -2.950  42.729 -18.394
  120   2H5*    C 171          2H5*        C 171  -1.229  43.110 -18.351
  121    H4*    C 171           H4*        C 171  -3.105  42.580 -16.164
  122    H3*    C 171           H3*        C 171  -0.500  44.077 -16.477
  123    H2*    C 171           H2*        C 171  -0.366  44.224 -14.123
  124   2HO*    C 171          2HO*        C 171  -2.386  44.610 -13.406
  125    H1*    C 171           H1*        C 171  -1.265  41.516 -13.808
  126   1H4     C 171          1H4         C 171   5.013  41.499 -12.542
  127   2H4     C 171          2H4         C 171   5.315  41.265 -14.250
  128    H5     C 171           H5         C 171   3.630  41.323 -15.903
  129    H6     C 171           H6         C 171   1.216  41.622 -16.331
  130   1H5*    G 172          1H5*        G 172  -2.859  47.908 -15.333
  131   2H5*    G 172          2H5*        G 172  -2.542  48.856 -16.786
  132    H4*    G 172           H4*        G 172  -1.658  50.158 -15.080
  133    H3*    G 172           H3*        G 172   0.504  48.600 -16.450
  134    H2*    G 172           H2*        G 172   2.152  49.591 -15.043
  135   2HO*    G 172          2HO*        G 172   0.883  51.103 -13.361
  136    H1*    G 172           H1*        G 172   0.757  49.000 -12.701
  137    H8     G 172           H8         G 172   0.545  46.389 -15.439
  138    H1     G 172           H1         G 172   5.486  45.595 -11.335
  139   1H2     G 172          1H2         G 172   5.603  47.223 -10.076
  140   2H2     G 172          2H2         G 172   4.524  48.599 -10.125
  141   1H5*    U 173          1H5*        U 173   1.666  52.611 -16.195
  142   2H5*    U 173          2H5*        U 173   2.273  53.281 -17.710
  143    H4*    U 173           H4*        U 173   3.904  53.768 -16.090
  144    H3*    U 173           H3*        U 173   4.705  51.474 -17.857
  145    H2*    U 173           H2*        U 173   6.815  51.369 -16.775
  146   2HO*    U 173          2HO*        U 173   7.500  53.269 -15.956
  147    H1*    U 173           H1*        U 173   5.667  51.509 -14.199
  148    H3     U 173           H3         U 173   7.427  47.317 -14.477
  149    H5     U 173           H5         U 173   3.848  47.093 -16.640
  150    H6     U 173           H6         U 173   3.669  49.528 -16.404
  151   1H5*    C 174          1H5*        C 174   7.820  54.342 -18.019
  152   2H5*    C 174          2H5*        C 174   8.406  54.605 -19.661
  153    H4*    C 174           H4*        C 174  10.284  54.058 -18.325
  154    H3*    C 174           H3*        C 174   9.419  51.838 -20.155
  155    H2*    C 174           H2*        C 174  11.277  50.531 -19.459
  156   2HO*    C 174          2HO*        C 174  12.960  51.602 -18.393
  157    H1*    C 174           H1*        C 174  10.801  51.051 -16.726
  158   1H4     C 174          1H4         C 174   8.161  45.332 -17.803
  159   2H4     C 174          2H4         C 174   6.725  46.129 -18.405
  160    H5     C 174           H5         C 174   6.541  48.464 -18.702
  161    H6     C 174           H6         C 174   7.704  50.633 -18.494
  162   1H5*    U 175          1H5*        U 175  12.534  54.861 -21.145
  163   2H5*    U 175          2H5*        U 175  11.998  56.541 -21.174
  164    H4*    U 175           H4*        U 175  11.946  55.755 -23.851
  165    H3*    U 175           H3*        U 175  14.138  54.310 -22.437
  166    H2*    U 175           H2*        U 175  15.735  54.919 -24.091
  167   2HO*    U 175          2HO*        U 175  14.412  56.484 -25.749
  168    H1*    U 175           H1*        U 175  15.100  57.620 -24.012
  169    H3     U 175           H3         U 175  19.042  57.495 -21.791
  170    H5     U 175           H5         U 175  16.294  55.957 -19.030
  171    H6     U 175           H6         U 175  14.619  56.005 -20.820
  172   1H5*    C 176          1H5*        C 176  14.090  51.560 -21.886
  173   2H5*    C 176          2H5*        C 176  15.326  52.670 -21.293
  174    H4*    C 176           H4*        C 176  17.081  51.155 -21.841
  175    H3*    C 176           H3*        C 176  15.051  49.751 -23.522
  176    H2*    C 176           H2*        C 176  16.014  47.628 -23.049
  177   2HO*    C 176          2HO*        C 176  17.926  48.408 -21.264
  178    H1*    C 176           H1*        C 176  16.053  48.068 -20.286
  179   1H4     C 176          1H4         C 176  10.597  44.957 -21.598
  180   2H4     C 176          2H4         C 176   9.785  46.508 -21.596
  181    H5     C 176           H5         C 176  10.908  48.579 -21.438
  182    H6     C 176           H6         C 176  13.106  49.686 -21.239
  183   1H5*    G 177          1H5*        G 177  19.029  47.994 -24.715
  184   2H5*    G 177          2H5*        G 177  18.954  48.038 -26.476
  185    H4*    G 177           H4*        G 177  19.550  45.822 -25.686
  186    H3*    G 177           H3*        G 177  16.913  46.126 -27.091
  187    H2*    G 177           H2*        G 177  16.590  43.767 -26.993
  188   2HO*    G 177          2HO*        G 177  18.454  42.651 -26.957
  189    H1*    G 177           H1*        G 177  17.160  43.631 -24.264
  190    H8     G 177           H8         G 177  15.319  46.790 -24.767
  191    H1     G 177           H1         G 177  11.436  41.612 -24.781
  192   1H2     G 177          1H2         G 177  12.575  39.897 -24.900
  193   2H2     G 177          2H2         G 177  14.322  39.866 -24.984
  194   1H5*    C 178          1H5*        C 178  19.093  43.168 -29.069
  195   2H5*    C 178          2H5*        C 178  18.961  43.186 -30.827
  196    H4*    C 178           H4*        C 178  18.278  41.039 -30.020
  197    H3*    C 178           H3*        C 178  16.090  42.761 -31.139
  198    H2*    C 178           H2*        C 178  14.512  41.020 -30.807
  199   2HO*    C 178          2HO*        C 178  15.329  38.929 -30.414
  200    H1*    C 178           H1*        C 178  15.433  40.508 -28.176
  201   1H4     C 178          1H4         C 178  10.181  44.090 -27.483
  202   2H4     C 178          2H4         C 178  11.163  45.523 -27.692
  203    H5     C 178           H5         C 178  13.455  45.477 -28.261
  204    H6     C 178           H6         C 178  15.388  44.029 -28.775
  205   1H5*    U 179          1H5*        U 179  16.025  39.043 -33.581
  206   2H5*    U 179          2H5*        U 179  15.564  39.486 -35.224
  207    H4*    U 179           H4*        U 179  14.055  37.827 -34.199
  208    H3*    U 179           H3*        U 179  12.952  40.488 -35.067
  209    H2*    U 179           H2*        U 179  10.759  39.732 -34.554
  210   2HO*    U 179          2HO*        U 179  10.950  37.321 -33.667
  211    H1*    U 179           H1*        U 179  11.495  38.727 -32.045
  212    H3     U 179           H3         U 179   8.856  42.479 -31.527
  213    H5     U 179           H5         U 179  12.801  43.868 -31.753
  214    H6     U 179           H6         U 179  13.457  41.598 -32.413
  215   1H5*    U 180          1H5*        U 180  10.784  37.639 -36.762
  216   2H5*    U 180          2H5*        U 180  10.327  37.771 -38.460
  217    H4*    U 180           H4*        U 180   8.333  37.565 -37.178
  218    H3*    U 180           H3*        U 180   8.812  40.284 -38.343
  219    H2*    U 180           H2*        U 180   6.769  41.080 -37.444
  220   2HO*    U 180          2HO*        U 180   5.230  39.557 -37.104
  221    H1*    U 180           H1*        U 180   7.278  39.918 -34.906
  222    H3     U 180           H3         U 180   7.373  44.347 -33.971
  223    H5     U 180           H5         U 180  10.923  43.701 -36.098
  224    H6     U 180           H6         U 180  10.138  41.416 -36.520
  225   1H5*    A 181          1H5*        A 181   6.014  38.644 -41.989
  226   2H5*    A 181          2H5*        A 181   6.585  39.819 -43.174
  227    H4*    A 181           H4*        A 181   4.185  40.050 -42.408
  228    H3*    A 181           H3*        A 181   6.141  42.336 -42.367
  229    H2*    A 181           H2*        A 181   4.396  43.804 -41.703
  230   2HO*    A 181          2HO*        A 181   2.213  42.563 -41.549
  231    H1*    A 181           H1*        A 181   3.468  42.093 -39.692
  232    H8     A 181           H8         A 181   7.209  42.049 -39.925
  233   1H6     A 181          1H6         A 181   7.173  46.896 -35.993
  234   2H6     A 181          2H6         A 181   8.200  45.726 -36.792
  235    H2     A 181           H2         A 181   2.989  46.101 -37.258
  236   1H5*    U 182          1H5*        U 182   4.149  40.547 -46.255
  237   2H5*    U 182          2H5*        U 182   5.638  40.274 -45.351
  238    H4*    U 182           H4*        U 182   6.851  39.777 -47.208
  239    H3*    U 182           H3*        U 182   5.120  41.728 -48.731
  240    H2*    U 182           H2*        U 182   5.805  40.711 -50.738
  241   2HO*    U 182          2HO*        U 182   7.815  39.782 -50.739
  242    H1*    U 182           H1*        U 182   5.732  38.087 -49.497
  243    H3     U 182           H3         U 182   3.032  37.466 -53.078
  244    H5     U 182           H5         U 182   0.858  40.076 -50.628
  245    H6     U 182           H6         U 182   2.840  40.221 -49.192
  246   1H5*    U 183          1H5*        U 183   8.867  45.295 -49.776
  247   2H5*    U 183          2H5*        U 183   9.524  44.609 -51.262
  248    H4*    U 183           H4*        U 183  10.844  43.258 -49.188
  249    H3*    U 183           H3*        U 183  10.416  46.149 -48.468
  250    H2*    U 183           H2*        U 183  12.640  46.391 -47.947
  251   2HO*    U 183          2HO*        U 183  13.236  44.868 -46.516
  252    H1*    U 183           H1*        U 183  13.278  43.989 -49.627
  253    H3     U 183           H3         U 183  14.804  47.099 -53.074
  254    H5     U 183           H5         U 183  16.302  48.037 -49.277
  255    H6     U 183           H6         U 183  14.659  46.469 -48.350
  256   1H5*    C 184          1H5*        C 184  11.271  46.834 -43.778
  257   2H5*    C 184          2H5*        C 184  12.723  46.882 -44.776
  258    H4*    C 184           H4*        C 184  12.209  44.978 -42.479
  259    H3*    C 184           H3*        C 184  13.755  47.550 -42.653
  260    H2*    C 184           H2*        C 184  15.353  46.694 -41.118
  261   2HO*    C 184          2HO*        C 184  14.068  44.202 -40.920
  262    H1*    C 184           H1*        C 184  15.616  44.257 -42.476
  263   1H4     C 184          1H4         C 184  20.333  47.998 -44.656
  264   2H4     C 184          2H4         C 184  19.261  48.540 -45.927
  265    H5     C 184           H5         C 184  16.974  47.962 -46.056
  266    H6     C 184           H6         C 184  15.136  46.708 -44.987
  267   1H5*    G 185          1H5*        G 185  11.608  50.131 -38.222
  268   2H5*    G 185          2H5*        G 185  13.356  49.984 -38.398
  269    H4*    G 185           H4*        G 185  11.727  48.278 -36.507
  270    H3*    G 185           H3*        G 185  12.838  51.023 -36.093
  271    H2*    G 185           H2*        G 185  13.573  50.456 -33.898
  272   2HO*    G 185          2HO*        G 185  13.007  48.147 -33.278
  273    H1*    G 185           H1*        G 185  14.881  48.142 -34.750
  274    H8     G 185           H8         G 185  15.056  51.057 -37.157
  275    H1     G 185           H1         G 185  19.824  50.895 -32.784
  276   1H2     G 185          1H2         G 185  19.439  49.415 -31.400
  277   2H2     G 185          2H2         G 185  18.034  48.373 -31.421
  278   1H5*    G 186          1H5*        G 186   8.493  52.869 -32.638
  279   2H5*    G 186          2H5*        G 186  10.231  53.167 -32.666
  280    H4*    G 186           H4*        G 186   8.957  50.821 -31.246
  281    H3*    G 186           H3*        G 186   9.447  53.614 -30.263
  282    H2*    G 186           H2*        G 186  10.081  52.767 -28.128
  283   2HO*    G 186          2HO*        G 186   9.479  50.671 -27.644
  284    H1*    G 186           H1*        G 186  11.873  50.918 -29.203
  285    H8     G 186           H8         G 186  10.959  54.596 -29.396
  286    H1     G 186           H1         G 186  17.310  53.402 -29.049
  287   1H2     G 186          1H2         G 186  17.639  51.372 -29.195
  288   2H2     G 186          2H2         G 186  16.380  50.172 -29.383
  289   1H5*    G 187          1H5*        G 187   4.930  55.192 -29.719
  290   2H5*    G 187          2H5*        G 187   4.058  54.418 -28.395
  291    H4*    G 187           H4*        G 187   2.551  54.457 -30.186
  292    H3*    G 187           H3*        G 187   3.785  51.742 -29.824
  293    H2*    G 187           H2*        G 187   2.405  50.880 -31.564
  294   2HO*    G 187          2HO*        G 187   0.628  52.112 -32.174
  295    H1*    G 187           H1*        G 187   3.073  52.922 -33.344
  296    H8     G 187           H8         G 187   6.170  52.229 -31.488
  297    H1     G 187           H1         G 187   4.916  47.719 -35.957
  298   1H2     G 187          1H2         G 187   2.986  47.951 -36.646
  299   2H2     G 187          2H2         G 187   1.873  49.183 -36.095
  300   1H5*    G 188          1H5*        G 188  -0.196  50.832 -30.669
  301   2H5*    G 188          2H5*        G 188  -0.820  50.197 -29.146
  302    H4*    G 188           H4*        G 188  -1.569  48.658 -30.703
  303    H3*    G 188           H3*        G 188   0.961  47.645 -29.433
  304    H2*    G 188           H2*        G 188   0.751  45.613 -30.660
  305   2HO*    G 188          2HO*        G 188  -1.306  45.706 -32.123
  306    H1*    G 188           H1*        G 188   0.352  46.933 -33.092
  307    H8     G 188           H8         G 188   2.854  48.948 -31.311
  308    H1     G 188           H1         G 188   5.377  43.529 -33.790
  309   1H2     G 188          1H2         G 188   3.857  42.273 -34.392
  310   2H2     G 188          2H2         G 188   2.151  42.635 -34.247
  311   1H5*    A 189          1H5*        A 189  -1.655  44.152 -28.778
  312   2H5*    A 189          2H5*        A 189  -1.137  43.562 -27.199
  313    H4*    A 189           H4*        A 189  -0.837  41.959 -29.100
  314    H3*    A 189           H3*        A 189   1.481  42.756 -27.350
  315    H2*    A 189           H2*        A 189   2.830  41.137 -28.446
  316   2HO*    A 189          2HO*        A 189   1.704  39.426 -29.172
  317    H1*    A 189           H1*        A 189   1.986  41.946 -31.010
  318    H8     A 189           H8         A 189   2.535  44.903 -28.805
  319   1H6     A 189          1H6         A 189   8.532  44.685 -30.517
  320   2H6     A 189          2H6         A 189   7.332  45.640 -29.675
  321    H2     A 189           H2         A 189   6.529  41.006 -31.999
  322   1H5*    G 190          1H5*        G 190   1.175  38.441 -27.503
  323   2H5*    G 190          2H5*        G 190   1.134  37.855 -25.840
  324    H4*    G 190           H4*        G 190   2.681  36.493 -26.980
  325    H3*    G 190           H3*        G 190   3.979  38.508 -25.182
  326    H2*    G 190           H2*        G 190   6.136  37.656 -25.731
  327   2HO*    G 190          2HO*        G 190   5.667  35.811 -27.555
  328    H1*    G 190           H1*        G 190   5.671  37.776 -28.480
  329    H8     G 190           H8         G 190   4.026  40.707 -26.894
  330    H1     G 190           H1         G 190  10.388  41.519 -27.761
  331   1H2     G 190          1H2         G 190  11.246  39.721 -28.292
  332   2H2     G 190          2H2         G 190  10.371  38.217 -28.475
  333   1H5*    C 191          1H5*        C 191   5.637  34.672 -24.243
  334   2H5*    C 191          2H5*        C 191   6.038  34.527 -22.531
  335    H4*    C 191           H4*        C 191   7.999  34.207 -23.941
  336    H3*    C 191           H3*        C 191   7.972  36.603 -22.118
  337    H2*    C 191           H2*        C 191  10.229  37.057 -22.720
  338   2HO*    C 191          2HO*        C 191  11.373  35.405 -23.803
  339    H1*    C 191           H1*        C 191   9.709  36.782 -25.469
  340   1H4     C 191          1H4         C 191   9.361  43.059 -24.296
  341   2H4     C 191          2H4         C 191   7.675  42.859 -23.872
  342    H5     C 191           H5         C 191   6.598  40.763 -23.719
  343    H6     C 191           H6         C 191   6.875  38.319 -23.938
  344   1H5*    G 192          1H5*        G 192  11.743  34.231 -20.706
  345   2H5*    G 192          2H5*        G 192  11.427  34.292 -18.972
  346    H4*    G 192           H4*        G 192  13.671  35.027 -19.393
  347    H3*    G 192           H3*        G 192  11.755  37.149 -18.470
  348    H2*    G 192           H2*        G 192  13.543  38.722 -18.377
  349   2HO*    G 192          2HO*        G 192  15.515  37.095 -19.388
  350    H1*    G 192           H1*        G 192  14.438  38.113 -20.950
  351    H8     G 192           H8         G 192  10.736  37.935 -20.988
  352    H1     G 192           H1         G 192  12.976  43.998 -21.310
  353   1H2     G 192          1H2         G 192  14.997  44.009 -20.898
  354   2H2     G 192          2H2         G 192  15.944  42.586 -20.521
  355   1H5*    G 193          1H5*        G 193  15.068  37.203 -16.255
  356   2H5*    G 193          2H5*        G 193  14.947  37.274 -14.496
  357    H4*    G 193           H4*        G 193  16.384  39.035 -15.253
  358    H3*    G 193           H3*        G 193  13.732  39.897 -14.146
  359    H2*    G 193           H2*        G 193  14.348  42.184 -14.404
  360   2HO*    G 193          2HO*        G 193  16.669  42.290 -15.459
  361    H1*    G 193           H1*        G 193  15.146  41.850 -17.057
  362    H8     G 193           H8         G 193  12.210  39.674 -16.667
  363    H1     G 193           H1         G 193  10.594  45.922 -17.144
  364   1H2     G 193          1H2         G 193  12.282  47.087 -16.937
  365   2H2     G 193          2H2         G 193  13.896  46.465 -16.673
  366   1H5*    A 194          1H5*        A 194  16.511  42.771 -12.046
  367   2H5*    A 194          2H5*        A 194  16.315  42.078 -10.436
  368    H4*    A 194           H4*        A 194  16.077  44.373 -10.115
  369    H3*    A 194           H3*        A 194  13.438  42.970 -10.149
  370    H2*    A 194           H2*        A 194  12.269  45.014  -9.837
  371   2HO*    A 194          2HO*        A 194  13.543  46.874  -9.288
  372    H1*    A 194           H1*        A 194  13.682  46.337 -11.867
  373    H8     A 194           H8         A 194  12.912  42.788 -12.791
  374   1H6     A 194          1H6         A 194   7.482  44.904 -15.025
  375   2H6     A 194          2H6         A 194   8.526  43.504 -14.929
  376    H2     A 194           H2         A 194   9.468  48.218 -12.830
  377   1H5*    C 195          1H5*        C 195  13.205  45.448  -6.963
  378   2H5*    C 195          2H5*        C 195  12.847  44.636  -5.438
  379    H4*    C 195           H4*        C 195  11.262  46.353  -5.621
  380    H3*    C 195           H3*        C 195  10.097  43.672  -6.309
  381    H2*    C 195           H2*        C 195   7.974  44.646  -6.644
  382   2HO*    C 195          2HO*        C 195   7.744  46.896  -5.908
  383    H1*    C 195           H1*        C 195   9.132  46.897  -8.019
  384   1H4     C 195          1H4         C 195   6.274  43.441 -12.569
  385   2H4     C 195          2H4         C 195   7.646  42.356 -12.582
  386    H5     C 195           H5         C 195   9.450  42.497 -11.063
  387    H6     C 195           H6         C 195  10.390  43.728  -9.140
  388   1H5*    G 196          1H5*        G 196   7.376  44.754  -2.560
  389   2H5*    G 196          2H5*        G 196   7.429  43.143  -1.846
  390    H4*    G 196           H4*        G 196   5.139  43.854  -2.150
  391    H3*    G 196           H3*        G 196   6.078  41.547  -3.832
  392    H2*    G 196           H2*        G 196   3.866  41.267  -4.675
  393   2HO*    G 196          2HO*        G 196   2.525  43.277  -3.578
  394    H1*    G 196           H1*        G 196   3.592  43.970  -5.325
  395    H8     G 196           H8         G 196   7.041  42.505  -5.871
  396    H1     G 196           H1         G 196   3.076  42.016 -10.961
  397   1H2     G 196          1H2         G 196   1.179  42.619 -10.418
  398   2H2     G 196          2H2         G 196   0.732  43.175  -8.821
  399   1H5*    A 197          1H5*        A 197   5.648  40.172   1.322
  400   2H5*    A 197          2H5*        A 197   6.552  38.693   0.994
  401    H4*    A 197           H4*        A 197   4.666  38.141   2.348
  402    H3*    A 197           H3*        A 197   4.467  37.212  -0.507
  403    H2*    A 197           H2*        A 197   2.363  36.352  -0.133
  404   2HO*    A 197          2HO*        A 197   2.839  34.981   1.524
  405    H1*    A 197           H1*        A 197   2.025  38.233   2.170
  406    H8     A 197           H8         A 197   1.407  37.640  -1.550
  407   1H6     A 197          1H6         A 197  -4.048  40.528  -0.626
  408   2H6     A 197          2H6         A 197  -3.080  39.670  -1.804
  409    H2     A 197           H2         A 197  -1.719  40.713   3.153
  410   1H5*    U 198          1H5*        U 198   7.253  34.943   2.866
  411   2H5*    U 198          2H5*        U 198   8.652  34.552   1.865
  412    H4*    U 198           H4*        U 198   7.221  32.164   1.992
  413    H3*    U 198           H3*        U 198   6.921  33.653   4.583
  414    H2*    U 198           H2*        U 198   7.595  31.818   5.806
  415   2HO*    U 198          2HO*        U 198   7.351  29.737   4.203
  416    H1*    U 198           H1*        U 198   9.059  30.787   3.411
  417    H3     U 198           H3         U 198  12.874  30.035   5.603
  418    H5     U 198           H5         U 198  11.073  32.995   7.955
  419    H6     U 198           H6         U 198   9.248  33.047   6.317
  420   1H5*    G 199          1H5*        G 199   1.456  33.804   2.877
  421   2H5*    G 199          2H5*        G 199   2.250  34.974   3.930
  422    H4*    G 199           H4*        G 199   0.341  34.422   5.112
  423    H3*    G 199           H3*        G 199   2.646  32.780   6.126
  424    H2*    G 199           H2*        G 199   1.232  31.852   7.803
  425   2HO*    G 199          2HO*        G 199  -0.802  32.859   8.129
  426    H1*    G 199           H1*        G 199  -0.792  31.218   5.979
  427    H8     G 199           H8         G 199   2.387  30.549   4.241
  428    H1     G 199           H1         G 199   0.858  25.907   8.482
  429   1H2     G 199          1H2         G 199  -0.689  26.553   9.682
  430   2H2     G 199          2H2         G 199  -1.458  28.119   9.558
  431   1H5*    A 200          1H5*        A 200   3.961  36.593   9.416
  432   2H5*    A 200          2H5*        A 200   5.275  36.803   8.259
  433    H4*    A 200           H4*        A 200   5.832  36.060  10.661
  434    H3*    A 200           H3*        A 200   6.982  34.856   8.157
  435    H2*    A 200           H2*        A 200   8.376  33.455   9.472
  436   2HO*    A 200          2HO*        A 200   7.505  34.218  11.953
  437    H1*    A 200           H1*        A 200   6.307  32.622  11.148
  438    H8     A 200           H8         A 200   5.120  33.045   7.614
  439   1H6     A 200          1H6         A 200   6.890  27.134   6.677
  440   2H6     A 200          2H6         A 200   6.040  28.489   5.968
  441    H2     A 200           H2         A 200   8.341  28.401  10.682
  442   1H5*    C 201          1H5*        C 201  11.994  37.117  10.703
  443   2H5*    C 201          2H5*        C 201  11.832  35.760   9.589
  444    H4*    C 201           H4*        C 201   9.954  36.123  11.916
  445    H3*    C 201           H3*        C 201  12.705  34.878  11.957
  446    H2*    C 201           H2*        C 201  11.928  33.350  13.582
  447   2HO*    C 201          2HO*        C 201   9.359  34.454  13.716
  448    H1*    C 201           H1*        C 201   9.422  33.045  12.187
  449   1H4     C 201          1H4         C 201  12.406  27.531  11.060
  450   2H4     C 201          2H4         C 201  13.589  28.358  10.072
  451    H5     C 201           H5         C 201  13.654  30.701   9.781
  452    H6     C 201           H6         C 201  12.589  32.848  10.373
  453   1H5*    C 202          1H5*        C 202  11.917  36.217  16.053
  454   2H5*    C 202          2H5*        C 202  13.389  36.230  17.024
  455    H4*    C 202           H4*        C 202  11.694  34.501  17.662
  456    H3*    C 202           H3*        C 202  14.508  33.672  16.938
  457    H2*    C 202           H2*        C 202  13.997  31.494  17.682
  458   2HO*    C 202          2HO*        C 202  11.846  31.335  18.839
  459    H1*    C 202           H1*        C 202  11.365  31.623  16.513
  460   1H4     C 202          1H4         C 202  14.738  27.591  12.863
  461   2H4     C 202          2H4         C 202  15.345  28.966  11.968
  462    H5     C 202           H5         C 202  14.929  31.213  12.565
  463    H6     C 202           H6         C 202  13.817  32.708  14.185
  464   1H5*    C 203          1H5*        C 203  14.459  32.894  21.481
  465   2H5*    C 203          2H5*        C 203  16.172  32.908  21.900
  466    H4*    C 203           H4*        C 203  15.022  30.746  22.333
  467    H3*    C 203           H3*        C 203  17.397  30.840  20.477
  468    H2*    C 203           H2*        C 203  17.388  28.465  20.419
  469   2HO*    C 203          2HO*        C 203  15.490  27.622  21.914
  470    H1*    C 203           H1*        C 203  14.572  28.378  20.042
  471   1H4     C 203          1H4         C 203  17.075  27.420  14.239
  472   2H4     C 203          2H4         C 203  17.251  29.151  14.053
  473    H5     C 203           H5         C 203  16.799  30.713  15.765
  474    H6     C 203           H6         C 203  16.060  31.001  18.103
  475   1H5*    U 204          1H5*        U 204  17.716  28.439  23.730
  476   2H5*    U 204          2H5*        U 204  19.222  28.160  24.607
  477    H4*    U 204           H4*        U 204  18.263  26.054  23.949
  478    H3*    U 204           H3*        U 204  20.816  26.828  22.564
  479    H2*    U 204           H2*        U 204  20.866  24.709  21.482
  480   2HO*    U 204          2HO*        U 204  20.065  23.555  23.277
  481    H1*    U 204           H1*        U 204  18.212  24.889  20.628
  482    H3     U 204           H3         U 204  21.038  25.388  17.018
  483    H5     U 204           H5         U 204  20.467  29.237  18.565
  484    H6     U 204           H6         U 204  19.367  28.191  20.492
  485   1H5*    A 205          1H5*        A 205  22.769  24.227  26.047
  486   2H5*    A 205          2H5*        A 205  24.439  24.783  25.934
  487    H4*    A 205           H4*        A 205  23.899  22.454  25.048
  488    H3*    A 205           H3*        A 205  25.462  24.513  23.505
  489    H2*    A 205           H2*        A 205  25.869  22.907  21.805
  490   2HO*    A 205          2HO*        A 205  24.578  20.749  22.646
  491    H1*    A 205           H1*        A 205  23.193  22.087  21.682
  492    H8     A 205           H8         A 205  23.114  25.736  22.157
  493   1H6     A 205          1H6         A 205  24.104  26.344  16.025
  494   2H6     A 205          2H6         A 205  23.663  27.206  17.482
  495    H2     A 205           H2         A 205  24.771  22.091  17.126
  496   1H5*    G 206          1H5*        G 206  27.706  23.326  21.132
  497   2H5*    G 206          2H5*        G 206  29.301  23.426  21.878
  498    H4*    G 206           H4*        G 206  27.665  25.682  20.712
  499    H3*    G 206           H3*        G 206  30.077  24.188  19.799
  500    H2*    G 206           H2*        G 206  31.103  26.172  18.971
  501   2HO*    G 206          2HO*        G 206  28.967  26.979  18.359
  502    H1*    G 206           H1*        G 206  30.730  27.569  21.356
  503    H8     G 206           H8         G 206  31.494  23.946  21.978
  504    H1     G 206           H1         G 206  36.750  27.634  21.164
  505   1H2     G 206          1H2         G 206  36.183  29.510  20.522
  506   2H2     G 206          2H2         G 206  34.529  30.009  20.245
  507   1H5*    U 207          1H5*        U 207  27.093  25.002  15.563
  508   2H5*    U 207          2H5*        U 207  28.342  25.163  14.329
  509    H4*    U 207           H4*        U 207  26.489  26.910  14.369
  510    H3*    U 207           H3*        U 207  29.420  27.580  14.253
  511    H2*    U 207           H2*        U 207  28.875  29.880  14.024
  512   2HO*    U 207          2HO*        U 207  26.938  30.274  13.098
  513    H1*    U 207           H1*        U 207  27.040  29.853  16.135
  514    H3     U 207           H3         U 207  30.342  32.118  18.172
  515    H5     U 207           H5         U 207  32.023  28.324  17.607
  516    H6     U 207           H6         U 207  29.996  27.720  16.365
  517   1H5*    A 208          1H5*        A 208  29.536  29.091   9.107
  518   2H5*    A 208          2H5*        A 208  27.945  28.804   8.403
  519    H4*    A 208           H4*        A 208  29.579  27.659   7.089
  520    H3*    A 208           H3*        A 208  27.718  25.948   8.678
  521    H2*    A 208           H2*        A 208  28.763  23.956   7.908
  522   2HO*    A 208          2HO*        A 208  29.113  24.802   5.798
  523    H1*    A 208           H1*        A 208  31.343  24.863   8.502
  524    H8     A 208           H8         A 208  28.310  25.546  10.744
  525   1H6     A 208          1H6         A 208  30.518  20.916  14.299
  526   2H6     A 208          2H6         A 208  29.265  22.131  14.170
  527    H2     A 208           H2         A 208  33.116  21.275  10.713
  528   1H5*    G 209          1H5*        G 209  26.497  24.632   5.408
  529   2H5*    G 209          2H5*        G 209  24.790  24.208   5.283
  530    H4*    G 209           H4*        G 209  26.200  22.427   6.274
  531    H3*    G 209           H3*        G 209  23.887  23.571   7.811
  532    H2*    G 209           H2*        G 209  24.250  21.980   9.546
  533   2HO*    G 209          2HO*        G 209  26.526  20.836   8.499
  534    H1*    G 209           H1*        G 209  26.982  22.547   9.718
  535    H8     G 209           H8         G 209  25.124  25.707   9.066
  536    H1     G 209           H1         G 209  25.053  23.933  15.290
  537   1H2     G 209          1H2         G 209  25.788  22.015  15.468
  538   2H2     G 209          2H2         G 209  26.340  21.032  14.130
  539   1H5*    A 210          1H5*        A 210  23.849  19.326   8.574
  540   2H5*    A 210          2H5*        A 210  22.204  18.844   8.164
  541    H4*    A 210           H4*        A 210  22.732  18.070  10.375
  542    H3*    A 210           H3*        A 210  20.713  20.300  10.248
  543    H2*    A 210           H2*        A 210  20.351  20.072  12.584
  544   2HO*    A 210          2HO*        A 210  21.456  18.202  13.599
  545    H1*    A 210           H1*        A 210  23.098  20.008  13.174
  546    H8     A 210           H8         A 210  22.287  22.493  10.488
  547   1H6     A 210          1H6         A 210  21.293  26.614  15.069
  548   2H6     A 210          2H6         A 210  21.444  26.429  13.336
  549    H2     A 210           H2         A 210  21.823  22.600  16.901
  550   1H5*    G 211          1H5*        G 211  18.706  16.788  12.092
  551   2H5*    G 211          2H5*        G 211  16.998  16.816  11.654
  552    H4*    G 211           H4*        G 211  17.415  16.782  14.098
  553    H3*    G 211           H3*        G 211  15.848  19.020  12.847
  554    H2*    G 211           H2*        G 211  15.394  19.909  15.010
  555   2HO*    G 211          2HO*        G 211  15.359  18.386  16.556
  556    H1*    G 211           H1*        G 211  18.069  19.821  15.798
  557    H8     G 211           H8         G 211  18.112  20.747  12.231
  558    H1     G 211           H1         G 211  16.492  25.705  16.061
  559   1H2     G 211          1H2         G 211  16.097  25.008  17.961
  560   2H2     G 211          2H2         G 211  16.192  23.329  18.445
  561   1H5*    G 212          1H5*        G 212  12.403  17.148  15.609
  562   2H5*    G 212          2H5*        G 212  11.134  17.347  14.401
  563    H4*    G 212           H4*        G 212  10.653  18.406  16.605
  564    H3*    G 212           H3*        G 212  10.635  20.020  14.069
  565    H2*    G 212           H2*        G 212   9.867  21.916  15.290
  566   2HO*    G 212          2HO*        G 212   8.514  20.837  16.720
  567    H1*    G 212           H1*        G 212  11.840  21.663  17.252
  568    H8     G 212           H8         G 212  13.263  20.763  13.923
  569    H1     G 212           H1         G 212  13.085  27.141  15.007
  570   1H2     G 212          1H2         G 212  11.970  27.522  16.699
  571   2H2     G 212          2H2         G 212  11.197  26.295  17.678
  572   1H5*    G 213          1H5*        G 213   5.967  19.128  14.232
  573   2H5*    G 213          2H5*        G 213   5.602  19.166  12.508
  574    H4*    G 213           H4*        G 213   4.609  21.033  13.826
  575    H3*    G 213           H3*        G 213   6.424  21.587  11.491
  576    H2*    G 213           H2*        G 213   5.948  23.912  11.700
  577   2HO*    G 213          2HO*        G 213   4.386  23.846  13.931
  578    H1*    G 213           H1*        G 213   6.448  23.916  14.462
  579    H8     G 213           H8         G 213   8.914  21.703  12.773
  580    H1     G 213           H1         G 213  10.457  27.979  12.422
  581   1H2     G 213          1H2         G 213   8.858  29.117  13.056
  582   2H2     G 213          2H2         G 213   7.328  28.469  13.601
  583   1H5*    G 214          1H5*        G 214   4.954  24.791   9.916
  584   2H5*    G 214          2H5*        G 214   4.637  24.167   8.298
  585    H4*    G 214           H4*        G 214   6.525  25.798   8.460
  586    H3*    G 214           H3*        G 214   6.899  23.061   7.279
  587    H2*    G 214           H2*        G 214   9.142  23.615   6.700
  588   2HO*    G 214          2HO*        G 214   8.886  25.749   6.132
  589    H1*    G 214           H1*        G 214   9.751  24.574   9.248
  590    H8     G 214           H8         G 214   7.545  21.698   9.840
  591    H1     G 214           H1         G 214  13.541  19.897   8.201
  592   1H2     G 214          1H2         G 214  14.579  21.528   7.484
  593   2H2     G 214          2H2         G 214  13.923  23.144   7.347
  594   1H5*    G 215          1H5*        G 215   8.006  25.710   2.884
  595   2H5*    G 215          2H5*        G 215   6.654  24.709   2.355
  596    H4*    G 215           H4*        G 215   8.714  24.532   0.953
  597    H3*    G 215           H3*        G 215   7.453  22.111   2.207
  598    H2*    G 215           H2*        G 215   9.019  20.712   1.081
  599   2HO*    G 215          2HO*        G 215  10.622  22.328  -0.198
  600    H1*    G 215           H1*        G 215  11.219  22.207   1.910
  601    H8     G 215           H8         G 215   8.926  22.288   4.774
  602    H1     G 215           H1         G 215  11.952  16.595   4.217
  603   1H2     G 215          1H2         G 215  12.878  16.484   2.378
  604   2H2     G 215          2H2         G 215  12.839  17.746   1.167
  605   1H5*    C 216          1H5*        C 216   5.466  21.710  -2.042
  606   2H5*    C 216          2H5*        C 216   4.003  20.807  -1.650
  607    H4*    C 216           H4*        C 216   5.815  19.568  -2.914
  608    H3*    C 216           H3*        C 216   4.576  18.502  -0.383
  609    H2*    C 216           H2*        C 216   5.771  16.473  -0.687
  610   2HO*    C 216          2HO*        C 216   6.543  16.035  -2.745
  611    H1*    C 216           H1*        C 216   8.193  17.796  -1.246
  612   1H4     C 216          1H4         C 216   8.418  16.233   4.960
  613   2H4     C 216          2H4         C 216   7.685  17.776   5.335
  614    H5     C 216           H5         C 216   6.880  19.281   3.702
  615    H6     C 216           H6         C 216   6.579  19.679   1.283
  616   1H5*    U 217          1H5*        U 217   4.311  15.785  -3.187
  617   2H5*    U 217          2H5*        U 217   2.798  14.930  -3.492
  618    H4*    U 217           H4*        U 217   4.404  13.261  -3.114
  619    H3*    U 217           H3*        U 217   2.652  13.692  -0.707
  620    H2*    U 217           H2*        U 217   3.713  11.852   0.373
  621   2HO*    U 217          2HO*        U 217   5.347  10.714  -1.017
  622    H1*    U 217           H1*        U 217   6.284  12.795  -0.191
  623    H3     U 217           H3         U 217   5.895  13.495   4.271
  624    H5     U 217           H5         U 217   3.587  16.546   2.567
  625    H6     U 217           H6         U 217   3.938  15.463   0.395
  626   1H5*    G 218          1H5*        G 218   0.180   9.414  -2.301
  627   2H5*    G 218          2H5*        G 218  -0.131   8.875  -0.650
  628    H4*    G 218           H4*        G 218   1.298   7.221  -1.049
  629    H3*    G 218           H3*        G 218   3.235   9.512  -0.844
  630    H2*    G 218           H2*        G 218   5.009   8.104  -1.482
  631   2HO*    G 218          2HO*        G 218   3.240   5.868  -1.461
  632    H1*    G 218           H1*        G 218   3.335   6.754  -3.424
  633    H8     G 218           H8         G 218   3.483  10.484  -3.705
  634    H1     G 218           H1         G 218   8.247   7.448  -6.863
  635   1H2     G 218          1H2         G 218   8.245   5.448  -6.355
  636   2H2     G 218          2H2         G 218   7.120   4.706  -5.240
  637   1H5*    C 219          1H5*        C 219   4.312   6.676   2.038
  638   2H5*    C 219          2H5*        C 219   3.769   5.313   3.017
  639    H4*    C 219           H4*        C 219   4.834   6.513   4.621
  640    H3*    C 219           H3*        C 219   1.995   7.455   4.593
  641    H2*    C 219           H2*        C 219   2.442   9.131   6.182
  642   2HO*    C 219          2HO*        C 219   4.706   8.961   7.148
  643    H1*    C 219           H1*        C 219   4.864   9.954   5.016
  644   1H4     C 219          1H4         C 219   0.118  13.829   2.999
  645   2H4     C 219          2H4         C 219   0.316  13.066   1.437
  646    H5     C 219           H5         C 219   1.692  11.184   1.058
  647    H6     C 219           H6         C 219   3.230   9.554   2.094
  648   1H5*    G 220          1H5*        G 220   4.910   3.479   6.551
  649   2H5*    G 220          2H5*        G 220   4.977   5.218   6.275
  650    H4*    G 220           H4*        G 220   6.565   3.089   5.118
  651    H3*    G 220           H3*        G 220   6.779   6.103   5.251
  652    H2*    G 220           H2*        G 220   8.525   6.002   3.706
  653   2HO*    G 220          2HO*        G 220   8.898   3.280   3.644
  654    H1*    G 220           H1*        G 220   7.286   3.629   2.465
  655    H8     G 220           H8         G 220   6.973   4.248   0.044
  656    H1     G 220           H1         G 220   6.781  10.581   1.358
  657   1H2     G 220          1H2         G 220   6.842  10.864   3.400
  658   2H2     G 220          2H2         G 220   6.931   9.576   4.580
  659   1H5*    G 221          1H5*        G 221  10.238   5.032   6.200
  660   2H5*    G 221          2H5*        G 221  11.361   6.155   6.966
  661    H4*    G 221           H4*        G 221  10.976   5.948   4.295
  662    H3*    G 221           H3*        G 221  11.931   8.276   5.957
  663    H2*    G 221           H2*        G 221  12.217   9.532   3.963
  664   2HO*    G 221          2HO*        G 221  12.931   8.138   2.450
  665    H1*    G 221           H1*        G 221   9.708   8.799   2.934
  666    H8     G 221           H8         G 221   9.677   9.471   6.635
  667    H1     G 221           H1         G 221   8.855  14.752   2.985
  668   1H2     G 221          1H2         G 221   9.195  14.281   1.007
  669   2H2     G 221          2H2         G 221   9.638  12.692   0.424
  670   1H5*    C 222          1H5*        C 222  15.595   8.203   3.406
  671   2H5*    C 222          2H5*        C 222  16.664   9.147   4.443
  672    H4*    C 222           H4*        C 222  15.604  10.141   2.233
  673    H3*    C 222           H3*        C 222  16.098  11.604   4.832
  674    H2*    C 222           H2*        C 222  15.467  13.604   3.751
  675   2HO*    C 222          2HO*        C 222  15.035  12.662   1.230
  676    H1*    C 222           H1*        C 222  13.332  12.296   2.344
  677   1H4     C 222          1H4         C 222  10.598  15.855   6.916
  678   2H4     C 222          2H4         C 222  10.761  14.499   8.008
  679    H5     C 222           H5         C 222  11.917  12.509   7.473
  680    H6     C 222           H6         C 222  13.212  11.320   5.739
  681   1H5*    U 223          1H5*        U 223  16.965  14.615   2.449
  682   2H5*    U 223          2H5*        U 223  18.653  14.997   2.794
  683    H4*    U 223           H4*        U 223  17.380  16.971   3.150
  684    H3*    U 223           H3*        U 223  18.335  15.663   5.683
  685    H2*    U 223           H2*        U 223  17.353  17.345   6.971
  686   2HO*    U 223          2HO*        U 223  17.383  19.355   6.081
  687    H1*    U 223           H1*        U 223  15.137  17.587   5.074
  688    H3     U 223           H3         U 223  13.076  17.269   9.129
  689    H5     U 223           H5         U 223  14.495  13.404   8.361
  690    H6     U 223           H6         U 223  15.686  14.332   6.430
  691   1H5*    U 224          1H5*        U 224  20.646  18.332   1.854
  692   2H5*    U 224          2H5*        U 224  19.093  18.048   2.640
  693    H4*    U 224           H4*        U 224  19.889  16.404   0.258
  694    H3*    U 224           H3*        U 224  19.230  19.293   0.187
  695    H2*    U 224           H2*        U 224  17.557  19.049  -1.466
  696   2HO*    U 224          2HO*        U 224  17.541  16.399  -1.887
  697    H1*    U 224           H1*        U 224  16.225  16.975  -0.233
  698    H3     U 224           H3         U 224  13.381  20.123   1.176
  699    H5     U 224           H5         U 224  16.995  21.345   2.902
  700    H6     U 224           H6         U 224  18.070  19.475   1.736
  701   1H5*    A 225          1H5*        A 225  20.491  18.518  -4.096
  702   2H5*    A 225          2H5*        A 225  20.758  20.110  -4.806
  703    H4*    A 225           H4*        A 225  18.732  18.814  -5.609
  704    H3*    A 225           H3*        A 225  18.555  21.657  -4.618
  705    H2*    A 225           H2*        A 225  16.286  21.716  -5.306
  706   2HO*    A 225          2HO*        A 225  15.878  19.276  -6.289
  707    H1*    A 225           H1*        A 225  15.719  19.191  -4.170
  708    H8     A 225           H8         A 225  17.885  21.382  -2.017
  709   1H6     A 225          1H6         A 225  12.590  23.596   0.435
  710   2H6     A 225          2H6         A 225  14.333  23.598   0.588
  711    H2     A 225           H2         A 225  11.546  21.024  -3.036
  712   1H5*    G 226          1H5*        G 226  17.510  20.795  -8.473
  713   2H5*    G 226          2H5*        G 226  17.859  21.806  -9.875
  714    H4*    G 226           H4*        G 226  15.581  21.213 -10.026
  715    H3*    G 226           H3*        G 226  16.053  24.048  -9.211
  716    H2*    G 226           H2*        G 226  13.712  24.467  -9.075
  717   2HO*    G 226          2HO*        G 226  12.313  22.863  -9.931
  718    H1*    G 226           H1*        G 226  13.243  22.214  -7.480
  719    H8     G 226           H8         G 226  16.429  23.568  -6.272
  720    H1     G 226           H1         G 226  11.369  27.075  -4.274
  721   1H2     G 226          1H2         G 226   9.686  26.516  -5.326
  722   2H2     G 226          2H2         G 226   9.650  25.282  -6.565
  723   1H5*    G 227          1H5*        G 227  15.827  22.939 -14.381
  724   2H5*    G 227          2H5*        G 227  17.482  23.496 -14.624
  725    H4*    G 227           H4*        G 227  16.310  24.429 -16.400
  726    H3*    G 227           H3*        G 227  16.769  26.420 -14.220
  727    H2*    G 227           H2*        G 227  15.605  28.111 -15.430
  728   2HO*    G 227          2HO*        G 227  14.806  26.469 -17.517
  729    H1*    G 227           H1*        G 227  13.377  26.493 -15.884
  730    H8     G 227           H8         G 227  14.606  25.682 -12.492
  731    H1     G 227           H1         G 227  11.202  31.184 -12.677
  732   1H2     G 227          1H2         G 227  10.905  31.744 -14.639
  733   2H2     G 227          2H2         G 227  11.492  30.857 -16.028
  734   1H5*    A 228          1H5*        A 228  18.401  28.431 -17.856
  735   2H5*    A 228          2H5*        A 228  19.827  29.329 -17.335
  736    H4*    A 228           H4*        A 228  18.144  30.771 -18.381
  737    H3*    A 228           H3*        A 228  18.900  31.245 -15.515
  738    H2*    A 228           H2*        A 228  17.482  33.148 -15.431
  739   2HO*    A 228          2HO*        A 228  16.531  32.859 -18.036
  740    H1*    A 228           H1*        A 228  15.305  31.817 -16.571
  741    H8     A 228           H8         A 228  16.886  29.337 -14.373
  742   1H6     A 228          1H6         A 228  13.964  32.024  -9.557
  743   2H6     A 228          2H6         A 228  14.883  30.622 -10.053
  744    H2     A 228           H2         A 228  13.559  34.688 -13.091
  745   1H5*    G 229          1H5*        G 229  19.731  35.649 -17.490
  746   2H5*    G 229          2H5*        G 229  21.250  35.791 -16.607
  747    H4*    G 229           H4*        G 229  19.657  37.696 -16.307
  748    H3*    G 229           H3*        G 229  20.750  36.165 -13.964
  749    H2*    G 229           H2*        G 229  19.670  37.679 -12.474
  750   2HO*    G 229          2HO*        G 229  18.322  39.311 -14.030
  751    H1*    G 229           H1*        G 229  17.205  37.458 -13.760
  752    H8     G 229           H8         G 229  18.679  34.090 -13.908
  753    H1     G 229           H1         G 229  16.291  35.486  -8.058
  754   1H2     G 229          1H2         G 229  15.873  37.503  -7.948
  755   2H2     G 229          2H2         G 229  16.129  38.644  -9.248
  756   1H5*    G 230          1H5*        G 230  21.315  40.492 -13.486
  757   2H5*    G 230          2H5*        G 230  22.878  40.800 -12.730
  758    H4*    G 230           H4*        G 230  21.062  41.937 -11.560
  759    H3*    G 230           H3*        G 230  22.615  39.827 -10.098
  760    H2*    G 230           H2*        G 230  21.393  40.286  -8.105
  761   2HO*    G 230          2HO*        G 230  20.396  42.254  -7.990
  762    H1*    G 230           H1*        G 230  18.917  40.111  -9.380
  763    H8     G 230           H8         G 230  20.983  37.520 -10.966
  764    H1     G 230           H1         G 230  18.936  35.773  -5.081
  765   1H2     G 230          1H2         G 230  18.156  37.415  -4.107
  766   2H2     G 230          2H2         G 230  18.069  39.026  -4.785
  767   1H5*    G 231          1H5*        G 231  22.777  43.697  -7.268
  768   2H5*    G 231          2H5*        G 231  24.446  43.460  -6.748
  769    H4*    G 231           H4*        G 231  22.798  43.706  -4.895
  770    H3*    G 231           H3*        G 231  24.567  41.286  -5.099
  771    H2*    G 231           H2*        G 231  23.725  40.493  -3.015
  772   2HO*    G 231          2HO*        G 231  21.848  42.441  -2.581
  773    H1*    G 231           H1*        G 231  21.060  40.830  -3.768
  774    H8     G 231           H8         G 231  22.799  39.692  -6.807
  775    H1     G 231           H1         G 231  21.718  34.873  -2.626
  776   1H2     G 231          1H2         G 231  21.128  35.655  -0.810
  777   2H2     G 231          2H2         G 231  20.953  37.362  -0.473
  778   1H5*    C 232          1H5*        C 232  24.922  42.677  -1.356
  779   2H5*    C 232          2H5*        C 232  26.559  43.061  -0.823
  780    H4*    C 232           H4*        C 232  25.726  41.708   0.870
  781    H3*    C 232           H3*        C 232  27.453  40.121  -1.000
  782    H2*    C 232           H2*        C 232  27.133  38.169   0.313
  783   2HO*    C 232          2HO*        C 232  25.398  39.300   2.149
  784    H1*    C 232           H1*        C 232  24.347  38.520   0.457
  785   1H4     C 232          1H4         C 232  25.151  34.452  -4.393
  786   2H4     C 232          2H4         C 232  25.574  35.789  -5.438
  787    H5     C 232           H5         C 232  25.815  38.017  -4.692
  788    H6     C 232           H6         C 232  25.708  39.525  -2.740
  789   1H5*    A 233          1H5*        A 233  28.746  39.497   3.038
  790   2H5*    A 233          2H5*        A 233  30.500  39.392   3.186
  791    H4*    A 233           H4*        A 233  29.502  37.436   4.155
  792    H3*    A 233           H3*        A 233  31.020  36.988   1.599
  793    H2*    A 233           H2*        A 233  30.686  34.645   1.815
  794   2HO*    A 233          2HO*        A 233  29.146  34.804   4.125
  795    H1*    A 233           H1*        A 233  27.948  34.892   2.318
  796    H8     A 233           H8         A 233  29.084  37.409  -0.212
  797   1H6     A 233          1H6         A 233  28.077  33.023  -4.538
  798   2H6     A 233          2H6         A 233  28.452  34.715  -4.294
  799    H2     A 233           H2         A 233  27.696  31.139  -0.532
  800   1H5*    G 234          1H5*        G 234  32.180  34.086   4.298
  801   2H5*    G 234          2H5*        G 234  33.915  34.187   4.591
  802    H4*    G 234           H4*        G 234  33.524  31.920   4.233
  803    H3*    G 234           H3*        G 234  34.608  33.222   1.753
  804    H2*    G 234           H2*        G 234  34.646  31.107   0.655
  805   2HO*    G 234          2HO*        G 234  33.547  29.490   2.475
  806    H1*    G 234           H1*        G 234  32.013  30.504   1.353
  807    H8     G 234           H8         G 234  32.261  34.149   0.638
  808    H1     G 234           H1         G 234  31.743  30.523  -4.698
  809   1H2     G 234          1H2         G 234  31.979  28.535  -4.204
  810   2H2     G 234          2H2         G 234  32.272  27.939  -2.586
  811   1H    GLY  15          1H        GLY  15   4.551  -1.502  -2.089
  812   1HA   GLY  15          1HA       GLY  15   6.338  -1.485  -0.277
  813   2HA   GLY  15          2HA       GLY  15   6.947  -1.655  -1.916
  814    H    ARG  16           H        ARG  16   8.937  -0.756  -1.073
  815    HA   ARG  16           HA       ARG  16   9.058   1.879  -0.025
  816   1HB   ARG  16          2HB       ARG  16  11.239   0.293  -1.392
  817   2HB   ARG  16          3HB       ARG  16  11.466   1.699  -0.362
  818   1HG   ARG  16          2HG       ARG  16  11.375   0.480   1.497
  819   2HG   ARG  16          3HG       ARG  16   9.952  -0.408   0.945
  820   1HD   ARG  16          2HD       ARG  16  11.261  -1.980  -0.224
  821   2HD   ARG  16          3HD       ARG  16  12.703  -0.971  -0.123
  822    HE   ARG  16           HE       ARG  16  11.969  -1.554   2.479
  823   1HH1  ARG  16          2HH1      ARG  16  12.957  -3.308  -0.361
  824   2HH1  ARG  16          1HH1      ARG  16  13.692  -4.598   0.532
  825   1HH2  ARG  16          2HH2      ARG  16  12.933  -3.246   3.666
  826   2HH2  ARG  16          1HH2      ARG  16  13.677  -4.563   2.822
  827    H    ALA  17           H        ALA  17  10.443   0.756  -3.109
  828    HA   ALA  17           HA       ALA  17  10.590   1.732  -5.161
  829   1HB   ALA  17          1HB       ALA  17   8.231   3.403  -4.308
  830   2HB   ALA  17          2HB       ALA  17   8.756   3.052  -5.956
  831   3HB   ALA  17          3HB       ALA  17   8.109   1.761  -4.943
  832    H    ARG  18           H        ARG  18  11.666   3.019  -2.557
  833    HA   ARG  18           HA       ARG  18  11.797   5.783  -2.833
  834   1HB   ARG  18          2HB       ARG  18  14.010   4.009  -1.796
  835   2HB   ARG  18          3HB       ARG  18  13.742   5.702  -1.404
  836   1HG   ARG  18          2HG       ARG  18  11.362   4.375  -0.751
  837   2HG   ARG  18          3HG       ARG  18  12.676   3.356  -0.158
  838   1HD   ARG  18          2HD       ARG  18  12.963   6.243   0.354
  839   2HD   ARG  18          3HD       ARG  18  11.644   5.445   1.208
  840    HE   ARG  18           HE       ARG  18  14.450   5.148   1.702
  841   1HH1  ARG  18          2HH1      ARG  18  11.347   3.586   1.929
  842   2HH1  ARG  18          1HH1      ARG  18  11.824   2.537   3.223
  843   1HH2  ARG  18          2HH2      ARG  18  15.089   3.774   3.407
  844   2HH2  ARG  18          1HH2      ARG  18  13.952   2.646   4.063
  845    H    GLY  19           H        GLY  19  12.791   7.113  -4.213
  846   1HA   GLY  19          1HA       GLY  19  14.623   7.819  -5.547
  847   2HA   GLY  19          2HA       GLY  19  15.108   6.139  -5.724
  848    H    LEU  20           H        LEU  20  12.207   5.468  -6.308
  849    HA   LEU  20           HA       LEU  20  12.343   6.138  -9.158
  850   1HB   LEU  20          2HB       LEU  20  11.318   3.867  -7.586
  851   2HB   LEU  20          3HB       LEU  20  10.351   4.322  -8.987
  852    HG   LEU  20           HG       LEU  20  13.190   4.089  -9.603
  853   1HD1  LEU  20          1HD1      LEU  20  13.180   1.602  -9.505
  854   2HD1  LEU  20          2HD1      LEU  20  11.715   1.693  -8.528
  855   3HD1  LEU  20          3HD1      LEU  20  13.221   2.384  -7.925
  856   1HD2  LEU  20          1HD2      LEU  20  11.588   4.252 -11.353
  857   2HD2  LEU  20          2HD2      LEU  20  10.630   2.930 -10.687
  858   3HD2  LEU  20          3HD2      LEU  20  12.220   2.605 -11.381
  859    H    CYS  21           H        CYS  21  11.083   7.799  -9.914
  860    HA   CYS  21           HA       CYS  21   9.101   8.932  -8.291
  861   1HB   CYS  21          2HB       CYS  21  10.412  10.150 -10.039
  862   2HB   CYS  21          3HB       CYS  21   9.509   9.299 -11.277
  863    H    TYR  22           H        TYR  22   6.833   8.927  -8.655
  864    HA   TYR  22           HA       TYR  22   5.823   6.536 -10.051
  865   1HB   TYR  22          2HB       TYR  22   5.278   6.080  -7.860
  866   2HB   TYR  22          3HB       TYR  22   5.109   7.779  -7.435
  867    HD1  TYR  22           HD1      TYR  22   3.463   5.239  -9.634
  868    HD2  TYR  22           HD2      TYR  22   2.981   8.567  -7.026
  869    HE1  TYR  22           HE1      TYR  22   1.020   5.043  -9.842
  870    HE2  TYR  22           HE2      TYR  22   0.537   8.378  -7.227
  871    HH   TYR  22           HH       TYR  22  -0.951   6.049  -9.424
  872    H    THR  23           H        THR  23   5.588   9.955  -9.667
  873    HA   THR  23           HA       THR  23   3.019  10.370 -10.768
  874    HB   THR  23           HB       THR  23   5.350  12.283 -10.953
  875    HG1  THR  23           HG1      THR  23   5.132  12.639  -8.871
  876   1HG2  THR  23          1HG2      THR  23   2.479  12.432 -11.498
  877   2HG2  THR  23          2HG2      THR  23   3.790  13.487 -12.029
  878   3HG2  THR  23          3HG2      THR  23   3.066  13.713 -10.437
  879    H    CYS  24           H        CYS  24   6.317  10.282 -12.273
  880    HA   CYS  24           HA       CYS  24   4.937  10.304 -14.855
  881   1HB   CYS  24          2HB       CYS  24   6.998  11.132 -15.842
  882   2HB   CYS  24          3HB       CYS  24   6.489  12.190 -14.541
  883    H    GLY  25           H        GLY  25   7.328   8.794 -12.761
  884   1HA   GLY  25          1HA       GLY  25   7.594   6.416 -12.668
  885   2HA   GLY  25          2HA       GLY  25   7.150   6.336 -14.366
  886    H    SER  26           H        SER  26   9.465   8.597 -12.987
  887    HA   SER  26           HA       SER  26  11.520   7.439 -14.723
  888   1HB   SER  26          2HB       SER  26  10.886   9.939 -14.752
  889   2HB   SER  26          3HB       SER  26  11.765  10.042 -13.226
  890    HG   SER  26           HG       SER  26  12.981  10.467 -15.238
  891    HA   PRO  27           HA       PRO  27  13.286   5.605 -11.058
  892   1HB   PRO  27          2HB       PRO  27  15.368   4.420 -12.336
  893   2HB   PRO  27          3HB       PRO  27  13.724   3.771 -12.370
  894   1HG   PRO  27          2HG       PRO  27  15.153   5.416 -14.422
  895   2HG   PRO  27          3HG       PRO  27  14.119   3.994 -14.650
  896   1HD   PRO  27          2HD       PRO  27  13.232   6.520 -15.051
  897   2HD   PRO  27          3HD       PRO  27  12.177   5.220 -14.462
  898    H    GLY  28           H        GLY  28  13.911   7.630 -10.117
  899   1HA   GLY  28          1HA       GLY  28  16.611   7.966  -9.652
  900   2HA   GLY  28          2HA       GLY  28  16.229   9.047 -10.985
  901    H    HIS  29           H        HIS  29  14.070  10.318 -10.515
  902    HA   HIS  29           HA       HIS  29  14.499  11.627  -7.931
  903   1HB   HIS  29          2HB       HIS  29  13.344  13.530  -8.859
  904   2HB   HIS  29          3HB       HIS  29  14.551  12.991 -10.023
  905    HD1  HIS  29           HD1      HIS  29  13.736  12.646 -12.339
  906    HD2  HIS  29           HD2      HIS  29  10.639  12.567  -9.571
  907    HE1  HIS  29           HE1      HIS  29  11.624  12.482 -13.696
  908    H    TYR  30           H        TYR  30  12.180  12.800  -7.354
  909    HA   TYR  30           HA       TYR  30  10.179  10.646  -7.232
  910   1HB   TYR  30          2HB       TYR  30  11.704  11.594  -5.066
  911   2HB   TYR  30          3HB       TYR  30  10.100  12.288  -4.860
  912    HD1  TYR  30           HD1      TYR  30  11.702   9.009  -5.671
  913    HD2  TYR  30           HD2      TYR  30   8.519  11.050  -3.721
  914    HE1  TYR  30           HE1      TYR  30  10.903   6.872  -4.752
  915    HE2  TYR  30           HE2      TYR  30   7.712   8.920  -2.796
  916    HH   TYR  30           HH       TYR  30   7.930   6.694  -2.836
  917    H    GLN  31           H        GLN  31   8.055  11.630  -6.245
  918    HA   GLN  31           HA       GLN  31   6.960  13.366  -8.083
  919   1HB   GLN  31          2HB       GLN  31   5.524  12.046  -6.701
  920   2HB   GLN  31          3HB       GLN  31   6.149  12.787  -5.235
  921   1HG   GLN  31          2HG       GLN  31   4.652  14.414  -5.332
  922   2HG   GLN  31          3HG       GLN  31   5.076  14.786  -7.002
  923   1HE2  GLN  31          1HE2      GLN  31   3.477  12.124  -5.275
  924   2HE2  GLN  31          2HE2      GLN  31   2.116  12.029  -6.336
  925    H    ALA  32           H        ALA  32   8.387  14.119  -4.932
  926    HA   ALA  32           HA       ALA  32   7.762  16.841  -4.839
  927   1HB   ALA  32          1HB       ALA  32   9.770  15.093  -3.542
  928   2HB   ALA  32          2HB       ALA  32  10.061  16.832  -3.490
  929   3HB   ALA  32          3HB       ALA  32   8.567  16.169  -2.827
  930    H    GLN  33           H        GLN  33  10.108  15.123  -6.712
  931    HA   GLN  33           HA       GLN  33  11.164  17.689  -7.703
  932   1HB   GLN  33          2HB       GLN  33  12.575  15.070  -7.241
  933   2HB   GLN  33          3HB       GLN  33  13.225  16.293  -8.323
  934   1HG   GLN  33          2HG       GLN  33  13.936  17.579  -6.642
  935   2HG   GLN  33          3HG       GLN  33  12.472  17.319  -5.695
  936   1HE2  GLN  33          1HE2      GLN  33  13.574  17.012  -3.784
  937   2HE2  GLN  33          2HE2      GLN  33  14.518  15.602  -3.465
  938    H    CYS  34           H        CYS  34   8.805  15.997  -8.643
  939    HA   CYS  34           HA       CYS  34   9.758  14.852 -11.087
  940   1HB   CYS  34          2HB       CYS  34   7.821  13.933  -9.781
  941   2HB   CYS  34          3HB       CYS  34   6.895  15.356 -10.215
  942    HA   PRO  35           HA       PRO  35   9.685  18.791 -13.185
  943   1HB   PRO  35          2HB       PRO  35  10.165  17.800 -15.668
  944   2HB   PRO  35          3HB       PRO  35  11.422  17.954 -14.435
  945   1HG   PRO  35          2HG       PRO  35   9.850  15.539 -15.244
  946   2HG   PRO  35          3HG       PRO  35  11.582  15.680 -14.896
  947   1HD   PRO  35          2HD       PRO  35   9.810  14.695 -13.101
  948   2HD   PRO  35          3HD       PRO  35  11.257  15.602 -12.615
  949    H    LYS  36           H        LYS  36   7.511  16.193 -13.593
  950    HA   LYS  36           HA       LYS  36   5.872  17.656 -15.529
  951   1HB   LYS  36          2HB       LYS  36   6.350  14.892 -15.008
  952   2HB   LYS  36          3HB       LYS  36   4.642  15.213 -14.740
  953   1HG   LYS  36          2HG       LYS  36   4.392  14.960 -16.930
  954   2HG   LYS  36          3HG       LYS  36   5.169  16.536 -17.097
  955   1HD   LYS  36          2HD       LYS  36   7.352  15.001 -16.891
  956   2HD   LYS  36          3HD       LYS  36   6.243  13.820 -17.593
  957   1HE   LYS  36          2HE       LYS  36   5.762  16.026 -19.125
  958   2HE   LYS  36          3HE       LYS  36   7.483  16.192 -18.788
  959   1HZ   LYS  36          1HZ       LYS  36   6.781  13.518 -19.501
  960   2HZ   LYS  36          2HZ       LYS  36   7.959  14.534 -20.167
  961   3HZ   LYS  36          3HZ       LYS  36   6.360  14.618 -20.715
  962    H    LYS  37           H        LYS  37   6.268  17.624 -12.295
  963    HA   LYS  37           HA       LYS  37   3.746  17.313 -11.173
  964   1HB   LYS  37          2HB       LYS  37   6.204  18.818 -10.441
  965   2HB   LYS  37          3HB       LYS  37   4.720  19.246  -9.599
  966   1HG   LYS  37          2HG       LYS  37   5.022  16.393  -9.676
  967   2HG   LYS  37          3HG       LYS  37   6.475  17.150  -9.017
  968   1HD   LYS  37          2HD       LYS  37   5.245  16.984  -7.103
  969   2HD   LYS  37          3HD       LYS  37   4.674  18.557  -7.668
  970   1HE   LYS  37          2HE       LYS  37   3.155  16.380  -8.826
  971   2HE   LYS  37          3HE       LYS  37   3.122  16.330  -7.064
  972   1HZ   LYS  37          1HZ       LYS  37   1.861  18.155  -6.964
  973   2HZ   LYS  37          2HZ       LYS  37   1.512  17.853  -8.591
  974   3HZ   LYS  37          3HZ       LYS  37   2.723  18.959  -8.177
  975    H    ARG  38           H        ARG  38   1.897  18.329 -11.539
  976    HA   ARG  38           HA       ARG  38   1.988  21.089 -12.564
  977   1HB   ARG  38          2HB       ARG  38  -0.166  20.649 -13.625
  978   2HB   ARG  38          3HB       ARG  38   1.038  19.482 -14.155
  979   1HG   ARG  38          2HG       ARG  38   0.017  17.736 -13.099
  980   2HG   ARG  38          3HG       ARG  38  -0.695  18.763 -11.853
  981   1HD   ARG  38          2HD       ARG  38  -2.263  19.664 -13.519
  982   2HD   ARG  38          3HD       ARG  38  -1.564  18.598 -14.737
  983    HE   ARG  38           HE       ARG  38  -2.417  17.074 -12.529
  984   1HH1  ARG  38          2HH1      ARG  38  -3.689  18.919 -15.192
  985   2HH1  ARG  38          1HH1      ARG  38  -5.153  17.999 -15.301
  986   1HH2  ARG  38          2HH2      ARG  38  -4.340  15.854 -12.662
  987   2HH2  ARG  38          1HH2      ARG  38  -5.523  16.257 -13.861
  988    H    LYS  39           H        LYS  39   0.234  22.511 -11.906
  989    HA   LYS  39           HA       LYS  39  -0.965  21.783  -9.320
  990   1HB   LYS  39          2HB       LYS  39   0.509  24.310 -10.045
  991   2HB   LYS  39          3HB       LYS  39  -0.613  24.239  -8.694
  992   1HG   LYS  39          2HG       LYS  39   1.014  23.479  -7.407
  993   2HG   LYS  39          3HG       LYS  39   1.135  22.042  -8.426
  994   1HD   LYS  39          2HD       LYS  39   2.926  22.854  -9.593
  995   2HD   LYS  39          3HD       LYS  39   2.442  24.537  -9.377
  996   1HE   LYS  39          2HE       LYS  39   3.008  24.168  -6.898
  997   2HE   LYS  39          3HE       LYS  39   3.852  22.720  -7.448
  998   1HZ   LYS  39          1HZ       LYS  39   4.916  25.205  -7.328
  999   2HZ   LYS  39          2HZ       LYS  39   4.509  25.071  -8.965
 1000   3HZ   LYS  39          3HZ       LYS  39   5.528  23.925  -8.251
 1001    H    SER  40           H        SER  40  -2.783  23.276  -8.717
 1002    HA   SER  40           HA       SER  40  -4.073  24.853 -10.685
 1003   1HB   SER  40          2HB       SER  40  -4.459  22.085 -11.007
 1004   2HB   SER  40          3HB       SER  40  -5.946  22.693 -10.281
 1005    HG   SER  40           HG       SER  40  -6.409  23.655 -12.089
 1006    H    GLY  41           H        GLY  41  -6.305  25.490  -9.987
 1007   1HA   GLY  41          1HA       GLY  41  -6.266  26.126  -7.203
 1008   2HA   GLY  41          2HA       GLY  41  -7.550  26.513  -8.340
 1009    H    ASN  42           H        ASN  42  -8.358  25.866  -5.900
 1010    HA   ASN  42           HA       ASN  42  -9.753  23.364  -6.338
 1011   1HB   ASN  42          2HB       ASN  42  -7.604  22.794  -5.123
 1012   2HB   ASN  42          3HB       ASN  42  -8.214  23.737  -3.767
 1013   1HD2  ASN  42          1HD2      ASN  42  -9.477  22.763  -2.336
 1014   2HD2  ASN  42          2HD2      ASN  42 -10.188  21.200  -2.527
 1015    H    SER  43           H        SER  43  -9.097  25.908  -3.935
 1016    HA   SER  43           HA       SER  43 -11.901  26.590  -3.838
 1017   1HB   SER  43          2HB       SER  43 -10.507  25.476  -1.392
 1018   2HB   SER  43          3HB       SER  43 -12.076  26.280  -1.373
 1019    HG   SER  43           HG       SER  43 -12.818  24.628  -2.808
 1020    H    ARG  44           H        ARG  44 -12.252  28.399  -2.182
 1021    HA   ARG  44           HA       ARG  44 -10.094  30.321  -2.547
 1022   1HB   ARG  44          2HB       ARG  44 -12.415  30.947  -3.127
 1023   2HB   ARG  44          3HB       ARG  44 -12.883  30.717  -1.447
 1024   1HG   ARG  44          2HG       ARG  44 -10.674  32.482  -1.479
 1025   2HG   ARG  44          3HG       ARG  44 -11.822  33.032  -2.702
 1026   1HD   ARG  44          2HD       ARG  44 -13.563  32.581  -0.776
 1027   2HD   ARG  44          3HD       ARG  44 -12.144  32.801   0.249
 1028    HE   ARG  44           HE       ARG  44 -12.193  35.038  -0.225
 1029   1HH1  ARG  44          2HH1      ARG  44 -14.184  33.342  -2.523
 1030   2HH1  ARG  44          1HH1      ARG  44 -14.830  34.788  -3.227
 1031   1HH2  ARG  44          2HH2      ARG  44 -13.036  36.949  -1.143
 1032   2HH2  ARG  44          1HH2      ARG  44 -14.175  36.839  -2.442
 1033    H    GLU  45           H        GLU  45  -8.786  29.044  -0.950
 1034    HA   GLU  45           HA       GLU  45  -9.080  30.268   1.672
 1035   1HB   GLU  45          2HB       GLU  45  -9.442  27.382   1.128
 1036   2HB   GLU  45          3HB       GLU  45  -8.424  27.783   2.503
 1037   1HG   GLU  45          2HG       GLU  45 -10.596  29.430   2.843
 1038   2HG   GLU  45          3HG       GLU  45 -11.308  27.951   2.200
 1039    H    ARG  46           H        ARG  46  -7.194  28.106  -0.407
 1040    HA   ARG  46           HA       ARG  46  -4.742  28.967   0.953
 1041   1HB   ARG  46          2HB       ARG  46  -5.410  26.480   0.408
 1042   2HB   ARG  46          3HB       ARG  46  -4.779  26.876  -1.184
 1043   1HG   ARG  46          2HG       ARG  46  -2.619  27.185  -0.392
 1044   2HG   ARG  46          3HG       ARG  46  -3.160  27.405   1.273
 1045   1HD   ARG  46          2HD       ARG  46  -2.741  25.254   1.637
 1046   2HD   ARG  46          3HD       ARG  46  -4.038  24.856   0.512
 1047    HE   ARG  46           HE       ARG  46  -2.464  24.297  -1.065
 1048   1HH1  ARG  46          2HH1      ARG  46  -0.934  25.994   1.561
 1049   2HH1  ARG  46          1HH1      ARG  46   0.675  25.659   1.014
 1050   1HH2  ARG  46          2HH2      ARG  46  -0.351  23.848  -1.797
 1051   2HH2  ARG  46          1HH2      ARG  46   1.006  24.439  -0.897
 1052    H    CYS  47           H        CYS  47  -2.725  29.114  -0.666
 1053    HA   CYS  47           HA       CYS  47  -3.663  30.630  -2.991
 1054   1HB   CYS  47          2HB       CYS  47  -2.830  32.160  -1.238
 1055   2HB   CYS  47          3HB       CYS  47  -1.294  31.318  -1.222
 1056    H    GLN  48           H        GLN  48  -3.028  29.607  -4.765
 1057    HA   GLN  48           HA       GLN  48  -0.825  27.691  -4.668
 1058   1HB   GLN  48          2HB       GLN  48  -3.314  27.649  -5.900
 1059   2HB   GLN  48          3HB       GLN  48  -2.194  27.936  -7.225
 1060   1HG   GLN  48          2HG       GLN  48  -2.456  25.606  -7.082
 1061   2HG   GLN  48          3HG       GLN  48  -0.876  25.962  -6.386
 1062   1HE2  GLN  48          1HE2      GLN  48  -0.561  24.473  -4.881
 1063   2HE2  GLN  48          2HE2      GLN  48  -1.664  24.075  -3.612
 1064    H    LEU  49           H        LEU  49  -0.377  30.599  -4.666
 1065    HA   LEU  49           HA       LEU  49   1.227  30.772  -7.130
 1066   1HB   LEU  49          2HB       LEU  49  -0.850  32.491  -6.261
 1067   2HB   LEU  49          3HB       LEU  49   0.667  33.373  -6.108
 1068    HG   LEU  49           HG       LEU  49   0.203  31.970  -8.673
 1069   1HD1  LEU  49          1HD1      LEU  49  -1.765  32.895  -9.104
 1070   2HD1  LEU  49          2HD1      LEU  49  -0.997  34.478  -8.993
 1071   3HD1  LEU  49          3HD1      LEU  49  -1.750  33.762  -7.569
 1072   1HD2  LEU  49          1HD2      LEU  49   1.374  34.596  -7.786
 1073   2HD2  LEU  49          2HD2      LEU  49   1.143  34.172  -9.484
 1074   3HD2  LEU  49          3HD2      LEU  49   2.211  33.201  -8.469
 1075    H    CYS  50           H        CYS  50   0.947  31.568  -3.637
 1076    HA   CYS  50           HA       CYS  50   3.857  31.872  -3.668
 1077   1HB   CYS  50          2HB       CYS  50   3.821  33.718  -2.216
 1078   2HB   CYS  50          3HB       CYS  50   2.601  34.086  -3.419
 1079    H    ASN  51           H        ASN  51   1.630  29.819  -3.073
 1080    HA   ASN  51           HA       ASN  51   1.248  28.100  -1.635
 1081   1HB   ASN  51          2HB       ASN  51   3.970  28.418  -1.717
 1082   2HB   ASN  51          3HB       ASN  51   3.647  28.513   0.011
 1083   1HD2  ASN  51          1HD2      ASN  51   3.603  26.513  -2.809
 1084   2HD2  ASN  51          2HD2      ASN  51   3.316  25.015  -1.998
 1085    H    GLY  52           H        GLY  52   0.623  30.984  -0.901
 1086   1HA   GLY  52          1HA       GLY  52   0.839  31.264   1.906
 1087   2HA   GLY  52          2HA       GLY  52  -0.281  32.135   0.869
 1088    H    MET  53           H        MET  53  -0.862  31.203   3.488
 1089    HA   MET  53           HA       MET  53  -2.960  29.231   2.868
 1090   1HB   MET  53          2HB       MET  53  -0.995  28.443   4.339
 1091   2HB   MET  53          3HB       MET  53  -1.688  29.475   5.583
 1092   1HG   MET  53          2HG       MET  53  -3.573  27.632   4.289
 1093   2HG   MET  53          3HG       MET  53  -2.300  26.872   5.240
 1094   1HE   MET  53          1HE       MET  53  -4.351  25.853   6.323
 1095   2HE   MET  53          2HE       MET  53  -5.157  26.562   7.722
 1096   3HE   MET  53          3HE       MET  53  -5.747  26.908   6.095
 1097    H    GLY  54           H        GLY  54  -4.657  30.623   2.631
 1098   1HA   GLY  54          1HA       GLY  54  -6.319  31.389   4.529
 1099   2HA   GLY  54          2HA       GLY  54  -5.117  32.663   4.675
 1100    H    HIS  55           H        HIS  55  -4.490  33.442   2.255
 1101    HA   HIS  55           HA       HIS  55  -6.976  34.557   1.247
 1102   1HB   HIS  55          2HB       HIS  55  -5.501  36.000  -0.118
 1103   2HB   HIS  55          3HB       HIS  55  -5.110  36.079   1.598
 1104    HD1  HIS  55           HD1      HIS  55  -2.968  34.587   2.325
 1105    HD2  HIS  55           HD2      HIS  55  -3.398  35.382  -1.731
 1106    HE1  HIS  55           HE1      HIS  55  -0.714  34.131   1.308
 1107    H    ASN  56           H        ASN  56  -6.601  34.983  -1.361
 1108    HA   ASN  56           HA       ASN  56  -6.348  32.278  -2.506
 1109   1HB   ASN  56          2HB       ASN  56  -8.672  33.494  -2.389
 1110   2HB   ASN  56          3HB       ASN  56  -8.056  34.387  -3.776
 1111   1HD2  ASN  56          1HD2      ASN  56  -9.338  33.570  -5.332
 1112   2HD2  ASN  56          2HD2      ASN  56  -9.362  31.907  -5.800
 1113    H    ALA  57           H        ALA  57  -5.499  32.098  -4.624
 1114    HA   ALA  57           HA       ALA  57  -3.276  33.689  -5.173
 1115   1HB   ALA  57          1HB       ALA  57  -2.842  32.042  -6.594
 1116   2HB   ALA  57          2HB       ALA  57  -4.426  31.357  -6.227
 1117   3HB   ALA  57          3HB       ALA  57  -4.239  32.469  -7.583
 1118    H    LYS  58           H        LYS  58  -6.584  33.883  -6.364
 1119    HA   LYS  58           HA       LYS  58  -6.159  35.755  -8.417
 1120   1HB   LYS  58          2HB       LYS  58  -8.316  34.355  -7.472
 1121   2HB   LYS  58          3HB       LYS  58  -8.712  35.998  -6.984
 1122   1HG   LYS  58          2HG       LYS  58  -9.679  35.890  -9.059
 1123   2HG   LYS  58          3HG       LYS  58  -8.103  36.584  -9.447
 1124   1HD   LYS  58          2HD       LYS  58  -7.762  33.799  -9.508
 1125   2HD   LYS  58          3HD       LYS  58  -9.281  34.121 -10.345
 1126   1HE   LYS  58          2HE       LYS  58  -7.640  36.074 -11.336
 1127   2HE   LYS  58          3HE       LYS  58  -6.529  34.722 -11.134
 1128   1HZ   LYS  58          1HZ       LYS  58  -7.337  33.854 -12.985
 1129   2HZ   LYS  58          2HZ       LYS  58  -8.445  35.120 -13.145
 1130   3HZ   LYS  58          3HZ       LYS  58  -8.869  33.731 -12.280
 1131    H    GLN  59           H        GLN  59  -6.182  36.086  -4.998
 1132    HA   GLN  59           HA       GLN  59  -6.215  39.020  -5.269
 1133   1HB   GLN  59          2HB       GLN  59  -7.980  37.679  -3.813
 1134   2HB   GLN  59          3HB       GLN  59  -6.679  37.712  -2.630
 1135   1HG   GLN  59          2HG       GLN  59  -6.811  40.317  -3.543
 1136   2HG   GLN  59          3HG       GLN  59  -8.496  39.807  -3.450
 1137   1HE2  GLN  59          1HE2      GLN  59  -9.408  39.376  -1.474
 1138   2HE2  GLN  59          2HE2      GLN  59  -8.636  39.757   0.023
 1139    H    CYS  60           H        CYS  60  -3.962  36.786  -5.341
 1140    HA   CYS  60           HA       CYS  60  -2.411  37.671  -3.069
 1141   1HB   CYS  60          2HB       CYS  60  -2.422  35.277  -3.689
 1142   2HB   CYS  60          3HB       CYS  60  -1.733  35.672  -5.251
 1143    H    ARG  61           H        ARG  61  -0.588  38.929  -3.277
 1144    HA   ARG  61           HA       ARG  61   0.791  40.539  -4.103
 1145   1HB   ARG  61          2HB       ARG  61   0.429  39.230  -6.797
 1146   2HB   ARG  61          3HB       ARG  61   1.798  40.181  -6.237
 1147   1HG   ARG  61          2HG       ARG  61   1.590  38.085  -4.415
 1148   2HG   ARG  61          3HG       ARG  61   1.302  37.357  -5.997
 1149   1HD   ARG  61          2HD       ARG  61   3.373  38.533  -6.798
 1150   2HD   ARG  61          3HD       ARG  61   3.684  38.977  -5.121
 1151    HE   ARG  61           HE       ARG  61   4.108  36.421  -6.334
 1152   1HH1  ARG  61          2HH1      ARG  61   3.378  38.045  -3.344
 1153   2HH1  ARG  61          1HH1      ARG  61   4.020  36.781  -2.348
 1154   1HH2  ARG  61          2HH2      ARG  61   4.957  34.749  -5.035
 1155   2HH2  ARG  61          1HH2      ARG  61   4.919  34.906  -3.311
 1156    H    LYS  62           H        LYS  62   0.959  42.186  -6.076
 1157    HA   LYS  62           HA       LYS  62   0.037  43.996  -7.100
 1158   1HB   LYS  62          2HB       LYS  62  -1.064  42.086  -8.398
 1159   2HB   LYS  62          3HB       LYS  62  -2.490  42.383  -7.412
 1160   1HG   LYS  62          2HG       LYS  62  -1.874  44.890  -8.323
 1161   2HG   LYS  62          3HG       LYS  62  -1.444  43.864  -9.694
 1162   1HD   LYS  62          2HD       LYS  62  -3.611  43.894 -10.228
 1163   2HD   LYS  62          3HD       LYS  62  -3.865  42.836  -8.838
 1164   1HE   LYS  62          2HE       LYS  62  -5.236  44.437  -8.088
 1165   2HE   LYS  62          3HE       LYS  62  -3.766  45.323  -7.686
 1166   1HZ   LYS  62          1HZ       LYS  62  -4.090  46.777  -9.343
 1167   2HZ   LYS  62          2HZ       LYS  62  -5.701  46.270  -9.264
 1168   3HZ   LYS  62          3HZ       LYS  62  -4.661  45.608 -10.424
 1169    H    ARG  63           H        ARG  63   0.103  44.772  -4.778
 1170    HA   ARG  63           HA       ARG  63  -2.579  45.712  -4.053
 1171   1HB   ARG  63          2HB       ARG  63  -1.607  43.728  -2.621
 1172   2HB   ARG  63          3HB       ARG  63  -0.660  45.006  -1.872
 1173   1HG   ARG  63          2HG       ARG  63  -3.493  45.652  -2.094
 1174   2HG   ARG  63          3HG       ARG  63  -3.167  44.219  -1.117
 1175   1HD   ARG  63          2HD       ARG  63  -1.801  45.418   0.375
 1176   2HD   ARG  63          3HD       ARG  63  -1.658  46.786  -0.727
 1177    HE   ARG  63           HE       ARG  63  -4.361  46.367   0.028
 1178   1HH1  ARG  63          2HH1      ARG  63  -1.331  47.630   1.189
 1179   2HH1  ARG  63          1HH1      ARG  63  -2.069  48.745   2.291
 1180   1HH2  ARG  63          2HH2      ARG  63  -5.343  47.832   1.474
 1181   2HH2  ARG  63          1HH2      ARG  63  -4.351  48.859   2.452
 1182    H    ASP  64           H        ASP  64  -2.670  47.828  -3.589
 1183    HA   ASP  64           HA       ASP  64  -0.134  49.304  -3.522
 1184   1HB   ASP  64          2HB       ASP  64  -2.124  49.749  -5.194
 1185   2HB   ASP  64          3HB       ASP  64  -2.784  50.654  -3.834
  Start of MODEL    6
    1   1H5*    C 160          1H5*        C 160  15.953  12.774 -13.731
    2   2H5*    C 160          2H5*        C 160  16.092  14.246 -12.770
    3    H4*    C 160           H4*        C 160  16.885  12.479 -11.421
    4    H3*    C 160           H3*        C 160  19.072  14.221 -12.508
    5    H2*    C 160           H2*        C 160  20.699  12.967 -11.327
    6   2HO*    C 160          2HO*        C 160  18.827  11.187 -10.239
    7    H1*    C 160           H1*        C 160  19.540  10.491 -12.119
    8   1H4     C 160          1H4         C 160  24.659  11.412 -15.864
    9   2H4     C 160          2H4         C 160  23.611  12.212 -17.015
   10    H5     C 160           H5         C 160  21.341  12.712 -16.601
   11    H6     C 160           H6         C 160  19.497  12.567 -14.964
   12   1H5*    U 161          1H5*        U 161  19.702  14.493  -7.981
   13   2H5*    U 161          2H5*        U 161  20.020  16.215  -7.770
   14    H4*    U 161           H4*        U 161  21.785  14.872  -6.782
   15    H3*    U 161           H3*        U 161  22.512  16.588  -9.141
   16    H2*    U 161           H2*        U 161  24.799  15.991  -8.861
   17   2HO*    U 161          2HO*        U 161  24.081  14.318  -6.674
   18    H1*    U 161           H1*        U 161  24.228  13.253  -8.678
   19    H3     U 161           H3         U 161  26.373  14.059 -12.668
   20    H5     U 161           H5         U 161  22.304  14.701 -13.426
   21    H6     U 161           H6         U 161  21.930  14.536 -11.008
   22   1H5*    G 162          1H5*        G 162  25.069  17.550  -5.759
   23   2H5*    G 162          2H5*        G 162  25.266  19.295  -5.612
   24    H4*    G 162           H4*        G 162  27.425  18.254  -5.569
   25    H3*    G 162           H3*        G 162  26.801  19.869  -8.021
   26    H2*    G 162           H2*        G 162  29.006  19.492  -8.844
   27   2HO*    G 162          2HO*        G 162  29.968  17.820  -6.952
   28    H1*    G 162           H1*        G 162  28.869  16.735  -8.444
   29    H8     G 162           H8         G 162  25.508  17.811  -9.543
   30    H1     G 162           H1         G 162  29.719  17.355 -14.436
   31   1H2     G 162          1H2         G 162  31.627  17.142 -13.686
   32   2H2     G 162          2H2         G 162  32.027  17.093 -11.984
   33   1H5*    C 163          1H5*        C 163  30.500  21.063  -6.635
   34   2H5*    C 163          2H5*        C 163  30.681  22.813  -6.516
   35    H4*    C 163           H4*        C 163  32.503  22.005  -7.795
   36    H3*    C 163           H3*        C 163  30.418  23.408  -9.450
   37    H2*    C 163           H2*        C 163  31.812  23.200 -11.362
   38   2HO*    C 163          2HO*        C 163  33.977  22.899 -10.991
   39    H1*    C 163           H1*        C 163  32.337  20.481 -10.889
   40   1H4     C 163          1H4         C 163  27.510  20.441 -15.064
   41   2H4     C 163          2H4         C 163  26.387  20.746 -13.759
   42    H5     C 163           H5         C 163  27.043  21.163 -11.528
   43    H6     C 163           H6         C 163  28.959  21.392  -9.988
   44   1H5*    C 164          1H5*        C 164  34.015  25.441 -10.259
   45   2H5*    C 164          2H5*        C 164  33.791  27.189 -10.307
   46    H4*    C 164           H4*        C 164  34.732  26.469 -12.387
   47    H3*    C 164           H3*        C 164  31.863  27.370 -12.542
   48    H2*    C 164           H2*        C 164  31.944  27.158 -14.905
   49   2HO*    C 164          2HO*        C 164  34.099  26.728 -15.819
   50    H1*    C 164           H1*        C 164  33.187  24.626 -14.786
   51   1H4     C 164          1H4         C 164  26.999  23.324 -15.659
   52   2H4     C 164          2H4         C 164  26.714  23.579 -13.952
   53    H5     C 164           H5         C 164  28.361  24.344 -12.442
   54    H6     C 164           H6         C 164  30.712  25.062 -12.198
   55   1H5*    C 165          1H5*        C 165  34.203  29.743 -15.214
   56   2H5*    C 165          2H5*        C 165  33.693  31.431 -15.257
   57    H4*    C 165           H4*        C 165  33.667  30.545 -17.484
   58    H3*    C 165           H3*        C 165  30.970  31.127 -16.290
   59    H2*    C 165           H2*        C 165  29.934  30.568 -18.354
   60   2HO*    C 165          2HO*        C 165  32.505  30.002 -19.449
   61    H1*    C 165           H1*        C 165  31.411  28.187 -18.626
   62   1H4     C 165          1H4         C 165  25.839  26.367 -16.088
   63   2H4     C 165          2H4         C 165  26.438  26.799 -14.503
   64    H5     C 165           H5         C 165  28.517  27.856 -14.124
   65    H6     C 165           H6         C 165  30.552  28.767 -15.185
   66   1H5*    U 166          1H5*        U 166  30.995  33.162 -19.989
   67   2H5*    U 166          2H5*        U 166  30.395  34.808 -19.788
   68    H4*    U 166           H4*        U 166  29.117  33.737 -21.496
   69    H3*    U 166           H3*        U 166  27.634  34.192 -18.919
   70    H2*    U 166           H2*        U 166  25.638  33.406 -19.941
   71   2HO*    U 166          2HO*        U 166  25.554  33.716 -22.096
   72    H1*    U 166           H1*        U 166  26.944  31.155 -21.055
   73    H3     U 166           H3         U 166  23.915  29.649 -17.949
   74    H5     U 166           H5         U 166  27.352  30.634 -15.766
   75    H6     U 166           H6         U 166  28.241  31.648 -17.814
   76   1H5*    C 167          1H5*        C 167  25.171  36.359 -21.911
   77   2H5*    C 167          2H5*        C 167  24.790  37.903 -21.149
   78    H4*    C 167           H4*        C 167  22.759  36.832 -21.861
   79    H3*    C 167           H3*        C 167  23.167  36.995 -18.884
   80    H2*    C 167           H2*        C 167  20.986  36.118 -18.551
   81   2HO*    C 167          2HO*        C 167  19.822  35.745 -20.733
   82    H1*    C 167           H1*        C 167  21.388  34.080 -20.488
   83   1H4     C 167          1H4         C 167  22.205  31.321 -14.765
   84   2H4     C 167          2H4         C 167  23.903  31.734 -14.857
   85    H5     C 167           H5         C 167  24.842  33.071 -16.563
   86    H6     C 167           H6         C 167  24.378  34.354 -18.621
   87   1H5*    A 168          1H5*        A 168  22.115  40.589 -16.691
   88   2H5*    A 168          2H5*        A 168  23.703  39.840 -16.528
   89    H4*    A 168           H4*        A 168  22.682  39.742 -14.401
   90    H3*    A 168           H3*        A 168  22.669  37.078 -15.809
   91    H2*    A 168           H2*        A 168  21.769  36.074 -13.870
   92   2HO*    A 168          2HO*        A 168  23.020  37.141 -12.352
   93    H1*    A 168           H1*        A 168  19.974  38.284 -13.458
   94    H8     A 168           H8         A 168  20.808  35.545 -15.992
   95   1H6     A 168          1H6         A 168  14.709  34.226 -15.856
   96   2H6     A 168          2H6         A 168  16.255  33.723 -16.506
   97    H2     A 168           H2         A 168  15.411  37.821 -13.342
   98   1H5*    U 169          1H5*        U 169  24.418  33.643 -14.018
   99   2H5*    U 169          2H5*        U 169  22.727  34.136 -13.926
  100    H4*    U 169           H4*        U 169  23.062  34.120 -11.370
  101    H3*    U 169           H3*        U 169  25.565  32.665 -12.234
  102    H2*    U 169           H2*        U 169  25.360  31.271 -10.365
  103   2HO*    U 169          2HO*        U 169  24.078  32.070  -8.591
  104    H1*    U 169           H1*        U 169  22.438  31.378 -10.568
  105    H3     U 169           H3         U 169  23.063  26.909 -10.272
  106    H5     U 169           H5         U 169  24.835  27.911 -13.932
  107    H6     U 169           H6         U 169  24.450  30.265 -13.361
  108   1H5*    C 170          1H5*        C 170  26.662  36.462  -7.789
  109   2H5*    C 170          2H5*        C 170  25.641  35.069  -8.148
  110    H4*    C 170           H4*        C 170  25.529  36.845 -10.381
  111    H3*    C 170           H3*        C 170  25.492  38.262  -7.757
  112    H2*    C 170           H2*        C 170  23.555  39.503  -8.341
  113   2HO*    C 170          2HO*        C 170  22.792  38.925 -10.661
  114    H1*    C 170           H1*        C 170  22.082  37.315  -9.145
  115   1H4     C 170          1H4         C 170  20.978  37.910  -2.861
  116   2H4     C 170          2H4         C 170  22.252  36.746  -2.575
  117    H5     C 170           H5         C 170  23.663  35.894  -4.266
  118    H6     C 170           H6         C 170  24.202  35.950  -6.675
  119   1H5*    C 171          1H5*        C 171  26.364  41.501 -10.116
  120   2H5*    C 171          2H5*        C 171  27.900  42.319  -9.833
  121    H4*    C 171           H4*        C 171  26.294  43.881  -9.205
  122    H3*    C 171           H3*        C 171  27.440  42.493  -6.805
  123    H2*    C 171           H2*        C 171  26.107  43.833  -5.363
  124   2HO*    C 171          2HO*        C 171  25.025  45.643  -6.321
  125    H1*    C 171           H1*        C 171  23.748  43.356  -6.749
  126   1H4     C 171          1H4         C 171  24.088  38.813  -2.244
  127   2H4     C 171          2H4         C 171  24.826  37.759  -3.429
  128    H5     C 171           H5         C 171  25.463  38.457  -5.593
  129    H6     C 171           H6         C 171  25.551  40.356  -7.169
  130   1H5*    G 172          1H5*        G 172  27.840  46.608  -5.651
  131   2H5*    G 172          2H5*        G 172  29.561  46.845  -5.344
  132    H4*    G 172           H4*        G 172  28.464  47.653  -3.435
  133    H3*    G 172           H3*        G 172  29.689  44.951  -2.994
  134    H2*    G 172           H2*        G 172  28.991  44.982  -0.716
  135   2HO*    G 172          2HO*        G 172  27.578  47.263  -0.608
  136    H1*    G 172           H1*        G 172  26.358  45.655  -1.353
  137    H8     G 172           H8         G 172  27.648  43.343  -3.965
  138    H1     G 172           H1         G 172  25.701  40.297   1.404
  139   1H2     G 172          1H2         G 172  25.360  41.681   2.895
  140   2H2     G 172          2H2         G 172  25.570  43.407   2.717
  141   1H5*    U 173          1H5*        U 173  30.599  47.326   0.216
  142   2H5*    U 173          2H5*        U 173  32.289  47.254   0.713
  143    H4*    U 173           H4*        U 173  30.912  46.773   2.607
  144    H3*    U 173           H3*        U 173  32.434  44.418   1.517
  145    H2*    U 173           H2*        U 173  31.658  43.088   3.323
  146   2HO*    U 173          2HO*        U 173  30.464  44.273   5.019
  147    H1*    U 173           H1*        U 173  28.993  44.006   3.021
  148    H3     U 173           H3         U 173  29.080  39.513   2.064
  149    H5     U 173           H5         U 173  30.195  41.432  -1.488
  150    H6     U 173           H6         U 173  30.329  43.517  -0.203
  151   1H5*    C 174          1H5*        C 174  33.790  44.565   5.743
  152   2H5*    C 174          2H5*        C 174  35.546  44.610   5.599
  153    H4*    C 174           H4*        C 174  35.044  42.881   7.120
  154    H3*    C 174           H3*        C 174  35.870  41.881   4.415
  155    H2*    C 174           H2*        C 174  35.696  39.634   5.154
  156   2HO*    C 174          2HO*        C 174  36.452  39.742   7.217
  157    H1*    C 174           H1*        C 174  33.185  40.113   6.400
  158   1H4     C 174          1H4         C 174  31.846  37.205   0.862
  159   2H4     C 174          2H4         C 174  31.888  38.762   0.067
  160    H5     C 174           H5         C 174  32.534  40.767   1.135
  161    H6     C 174           H6         C 174  33.306  41.781   3.250
  162   1H5*    U 175          1H5*        U 175  39.329  43.500   7.894
  163   2H5*    U 175          2H5*        U 175  40.117  44.414   6.609
  164    H4*    U 175           H4*        U 175  42.122  43.301   6.846
  165    H3*    U 175           H3*        U 175  40.578  40.981   8.021
  166    H2*    U 175           H2*        U 175  42.537  40.264   9.064
  167   2HO*    U 175          2HO*        U 175  44.282  40.432   7.777
  168    H1*    U 175           H1*        U 175  43.444  43.051   9.335
  169    H3     U 175           H3         U 175  44.214  41.734  13.572
  170    H5     U 175           H5         U 175  40.088  41.165  13.132
  171    H6     U 175           H6         U 175  40.358  41.758  10.768
  172   1H5*    C 176          1H5*        C 176  39.078  38.993   6.369
  173   2H5*    C 176          2H5*        C 176  38.999  39.342   8.097
  174    H4*    C 176           H4*        C 176  39.276  37.003   8.637
  175    H3*    C 176           H3*        C 176  39.920  36.671   5.734
  176    H2*    C 176           H2*        C 176  38.857  34.543   5.682
  177   2HO*    C 176          2HO*        C 176  38.108  33.727   7.788
  178    H1*    C 176           H1*        C 176  36.528  35.480   6.914
  179   1H4     C 176          1H4         C 176  35.395  35.847   0.627
  180   2H4     C 176          2H4         C 176  36.069  37.462   0.634
  181    H5     C 176           H5         C 176  37.101  38.451   2.514
  182    H6     C 176           H6         C 176  37.748  38.130   4.875
  183   1H5*    G 177          1H5*        G 177  41.263  32.915   7.588
  184   2H5*    G 177          2H5*        G 177  42.940  32.714   7.080
  185    H4*    G 177           H4*        G 177  41.790  30.681   6.630
  186    H3*    G 177           H3*        G 177  42.507  32.290   4.205
  187    H2*    G 177           H2*        G 177  41.614  30.598   2.784
  188   2HO*    G 177          2HO*        G 177  41.938  28.675   3.743
  189    H1*    G 177           H1*        G 177  39.197  30.467   4.170
  190    H8     G 177           H8         G 177  40.162  34.023   4.191
  191    H1     G 177           H1         G 177  37.725  32.147  -1.504
  192   1H2     G 177          1H2         G 177  37.600  30.089  -1.555
  193   2H2     G 177          2H2         G 177  38.084  29.029  -0.250
  194   1H5*    C 178          1H5*        C 178  43.916  28.343   3.582
  195   2H5*    C 178          2H5*        C 178  45.513  28.302   2.836
  196    H4*    C 178           H4*        C 178  43.951  27.028   1.514
  197    H3*    C 178           H3*        C 178  44.999  29.557   0.278
  198    H2*    C 178           H2*        C 178  43.846  29.063  -1.736
  199   2HO*    C 178          2HO*        C 178  43.319  26.941  -2.087
  200    H1*    C 178           H1*        C 178  41.450  28.425  -0.386
  201   1H4     C 178          1H4         C 178  40.687  34.465  -2.324
  202   2H4     C 178          2H4         C 178  41.572  35.011  -0.918
  203    H5     C 178           H5         C 178  42.627  33.559   0.616
  204    H6     C 178           H6         C 178  43.099  31.202   1.185
  205   1H5*    U 179          1H5*        U 179  46.013  26.517  -2.543
  206   2H5*    U 179          2H5*        U 179  47.623  26.798  -3.206
  207    H4*    U 179           H4*        U 179  45.988  26.736  -4.980
  208    H3*    U 179           H3*        U 179  47.299  29.393  -4.463
  209    H2*    U 179           H2*        U 179  46.190  30.306  -6.347
  210   2HO*    U 179          2HO*        U 179  44.760  28.094  -7.100
  211    H1*    U 179           H1*        U 179  43.708  29.138  -5.617
  212    H3     U 179           H3         U 179  43.369  33.737  -5.439
  213    H5     U 179           H5         U 179  44.831  32.546  -1.699
  214    H6     U 179           H6         U 179  45.137  30.303  -2.643
  215   1H5*    U 180          1H5*        U 180  47.657  28.384  -8.307
  216   2H5*    U 180          2H5*        U 180  49.171  28.651  -9.172
  217    H4*    U 180           H4*        U 180  47.469  29.790 -10.364
  218    H3*    U 180           H3*        U 180  49.326  31.590  -8.847
  219    H2*    U 180           H2*        U 180  48.193  33.508  -9.655
  220   2HO*    U 180          2HO*        U 180  46.374  31.892 -11.109
  221    H1*    U 180           H1*        U 180  45.640  32.393  -9.106
  222    H3     U 180           H3         U 180  45.811  35.923  -6.271
  223    H5     U 180           H5         U 180  48.441  33.142  -4.571
  224    H6     U 180           H6         U 180  48.140  31.776  -6.585
  225   1H5*    A 181          1H5*        A 181  51.774  31.800 -13.079
  226   2H5*    A 181          2H5*        A 181  53.292  32.314 -12.344
  227    H4*    A 181           H4*        A 181  52.115  33.997 -13.821
  228    H3*    A 181           H3*        A 181  53.020  34.627 -11.021
  229    H2*    A 181           H2*        A 181  52.361  36.888 -11.324
  230   2HO*    A 181          2HO*        A 181  51.997  37.593 -13.450
  231    H1*    A 181           H1*        A 181  49.856  36.218 -12.371
  232    H8     A 181           H8         A 181  50.868  33.882  -9.619
  233   1H6     A 181          1H6         A 181  48.266  37.952  -5.668
  234   2H6     A 181          2H6         A 181  48.969  36.355  -5.799
  235    H2     A 181           H2         A 181  48.383  39.811  -9.701
  236   1H5*    U 182          1H5*        U 182  55.650  38.781 -13.221
  237   2H5*    U 182          2H5*        U 182  54.161  37.920 -13.612
  238    H4*    U 182           H4*        U 182  56.545  38.453 -15.373
  239    H3*    U 182           H3*        U 182  53.618  39.169 -15.489
  240    H2*    U 182           H2*        U 182  53.769  39.289 -17.838
  241   2HO*    U 182          2HO*        U 182  56.174  39.003 -18.577
  242    H1*    U 182           H1*        U 182  55.489  36.964 -17.909
  243    H3     U 182           H3         U 182  52.125  35.585 -20.589
  244    H5     U 182           H5         U 182  50.320  35.867 -16.821
  245    H6     U 182           H6         U 182  52.411  36.852 -16.002
  246   1H5*    U 183          1H5*        U 183  51.756  41.708 -14.970
  247   2H5*    U 183          2H5*        U 183  52.419  41.404 -16.575
  248    H4*    U 183           H4*        U 183  52.375  44.205 -16.287
  249    H3*    U 183           H3*        U 183  49.937  42.941 -15.056
  250    H2*    U 183           H2*        U 183  48.565  44.548 -16.082
  251   2HO*    U 183          2HO*        U 183  49.849  46.385 -17.121
  252    H1*    U 183           H1*        U 183  50.218  44.490 -18.480
  253    H3     U 183           H3         U 183  46.017  43.799 -20.085
  254    H5     U 183           H5         U 183  46.988  40.216 -18.146
  255    H6     U 183           H6         U 183  49.004  41.332 -17.306
  256   1H5*    C 184          1H5*        C 184  50.162  43.531 -10.575
  257   2H5*    C 184          2H5*        C 184  49.274  45.049 -10.441
  258    H4*    C 184           H4*        C 184  50.885  44.630  -8.593
  259    H3*    C 184           H3*        C 184  51.216  47.105 -10.298
  260    H2*    C 184           H2*        C 184  52.924  47.804  -8.894
  261   2HO*    C 184          2HO*        C 184  52.631  47.405  -6.729
  262    H1*    C 184           H1*        C 184  53.535  44.981  -8.217
  263   1H4     C 184          1H4         C 184  58.141  47.819 -12.161
  264   2H4     C 184          2H4         C 184  59.018  47.008 -10.882
  265    H5     C 184           H5         C 184  57.980  45.830  -9.118
  266    H6     C 184           H6         C 184  55.825  45.133  -8.135
  267   1H5*    G 185          1H5*        G 185  46.733  49.275  -6.902
  268   2H5*    G 185          2H5*        G 185  47.552  50.062  -8.251
  269    H4*    G 185           H4*        G 185  49.179  50.483  -5.976
  270    H3*    G 185           H3*        G 185  46.259  50.684  -5.312
  271    H2*    G 185           H2*        G 185  46.662  52.675  -4.067
  272   2HO*    G 185          2HO*        G 185  48.646  52.165  -3.186
  273    H1*    G 185           H1*        G 185  48.102  53.879  -6.131
  274    H8     G 185           H8         G 185  45.751  52.577  -8.331
  275    H1     G 185           H1         G 185  42.702  56.497  -4.181
  276   1H2     G 185          1H2         G 185  43.908  56.840  -2.545
  277   2H2     G 185          2H2         G 185  45.508  56.166  -2.329
  278   1H5*    G 186          1H5*        G 186  46.081  48.405  -0.608
  279   2H5*    G 186          2H5*        G 186  47.608  48.556   0.263
  280    H4*    G 186           H4*        G 186  46.892  46.505  -1.840
  281    H3*    G 186           H3*        G 186  47.139  46.408   1.137
  282    H2*    G 186           H2*        G 186  48.118  44.237   1.048
  283   2HO*    G 186          2HO*        G 186  47.574  43.088  -0.719
  284    H1*    G 186           H1*        G 186  50.026  44.988  -0.847
  285    H8     G 186           H8         G 186  50.208  47.983   1.003
  286    H1     G 186           H1         G 186  52.202  43.056   4.696
  287   1H2     G 186          1H2         G 186  51.606  41.274   3.847
  288   2H2     G 186          2H2         G 186  50.700  41.136   2.357
  289   1H5*    G 187          1H5*        G 187  42.083  45.705  -1.492
  290   2H5*    G 187          2H5*        G 187  43.494  44.690  -1.192
  291    H4*    G 187           H4*        G 187  43.471  47.067  -3.064
  292    H3*    G 187           H3*        G 187  42.812  44.192  -3.579
  293    H2*    G 187           H2*        G 187  43.967  44.258  -5.663
  294   2HO*    G 187          2HO*        G 187  44.899  46.864  -5.342
  295    H1*    G 187           H1*        G 187  46.272  45.365  -4.547
  296    H8     G 187           H8         G 187  45.015  43.027  -2.003
  297    H1     G 187           H1         G 187  47.940  39.986  -6.910
  298   1H2     G 187          1H2         G 187  48.234  41.310  -8.465
  299   2H2     G 187          2H2         G 187  47.758  42.994  -8.441
  300   1H5*    G 188          1H5*        G 188  42.546  45.841  -7.418
  301   2H5*    G 188          2H5*        G 188  40.818  45.799  -7.763
  302    H4*    G 188           H4*        G 188  41.756  44.935  -9.691
  303    H3*    G 188           H3*        G 188  40.878  42.678  -7.909
  304    H2*    G 188           H2*        G 188  41.509  41.116  -9.594
  305   2HO*    G 188          2HO*        G 188  42.423  42.294 -11.604
  306    H1*    G 188           H1*        G 188  44.033  42.264  -9.945
  307    H8     G 188           H8         G 188  43.383  42.467  -6.335
  308    H1     G 188           H1         G 188  45.002  36.488  -8.207
  309   1H2     G 188          1H2         G 188  44.936  36.368 -10.265
  310   2H2     G 188          2H2         G 188  44.505  37.692 -11.324
  311   1H5*    A 189          1H5*        A 189  38.795  41.449 -11.788
  312   2H5*    A 189          2H5*        A 189  37.324  40.770 -11.092
  313    H4*    A 189           H4*        A 189  38.754  39.202 -12.462
  314    H3*    A 189           H3*        A 189  37.852  38.548  -9.665
  315    H2*    A 189           H2*        A 189  38.783  36.375  -9.893
  316   2HO*    A 189          2HO*        A 189  39.314  35.680 -12.001
  317    H1*    A 189           H1*        A 189  41.208  37.332 -10.930
  318    H8     A 189           H8         A 189  39.971  39.572  -8.212
  319   1H6     A 189          1H6         A 189  42.855  35.769  -4.190
  320   2H6     A 189          2H6         A 189  42.028  37.304  -4.347
  321    H2     A 189           H2         A 189  42.917  33.857  -8.200
  322   1H5*    G 190          1H5*        G 190  36.889  35.250 -12.161
  323   2H5*    G 190          2H5*        G 190  35.150  34.975 -12.051
  324    H4*    G 190           H4*        G 190  36.075  32.855 -11.816
  325    H3*    G 190           H3*        G 190  35.340  33.996  -9.140
  326    H2*    G 190           H2*        G 190  36.012  31.970  -8.080
  327   2HO*    G 190          2HO*        G 190  36.552  30.189  -9.504
  328    H1*    G 190           H1*        G 190  38.482  31.911  -9.376
  329    H8     G 190           H8         G 190  37.592  35.443  -8.582
  330    H1     G 190           H1         G 190  40.167  32.253  -3.575
  331   1H2     G 190          1H2         G 190  40.283  30.244  -4.023
  332   2H2     G 190          2H2         G 190  39.760  29.530  -5.533
  333   1H5*    C 191          1H5*        C 191  33.801  29.991  -9.407
  334   2H5*    C 191          2H5*        C 191  32.281  29.853  -8.523
  335    H4*    C 191           H4*        C 191  33.992  28.299  -7.701
  336    H3*    C 191           H3*        C 191  32.946  30.409  -5.826
  337    H2*    C 191           H2*        C 191  34.183  29.425  -4.054
  338   2HO*    C 191          2HO*        C 191  35.088  27.326  -4.450
  339    H1*    C 191           H1*        C 191  36.529  29.216  -5.601
  340   1H4     C 191          1H4         C 191  37.211  34.579  -2.184
  341   2H4     C 191          2H4         C 191  36.358  35.453  -3.436
  342    H5     C 191           H5         C 191  35.342  34.420  -5.301
  343    H6     C 191           H6         C 191  34.890  32.273  -6.434
  344   1H5*    G 192          1H5*        G 192  32.313  26.498  -3.728
  345   2H5*    G 192          2H5*        G 192  30.627  26.595  -3.221
  346    H4*    G 192           H4*        G 192  31.953  25.952  -1.341
  347    H3*    G 192           H3*        G 192  30.840  28.739  -1.222
  348    H2*    G 192           H2*        G 192  31.718  28.998   0.978
  349   2HO*    G 192          2HO*        G 192  33.003  26.837   1.554
  350    H1*    G 192           H1*        G 192  34.264  28.121   0.252
  351    H8     G 192           H8         G 192  32.909  30.088  -2.584
  352    H1     G 192           H1         G 192  35.230  33.795   2.187
  353   1H2     G 192          1H2         G 192  35.598  32.629   3.847
  354   2H2     G 192          2H2         G 192  35.319  30.904   3.935
  355   1H5*    G 193          1H5*        G 193  29.642  26.817   2.381
  356   2H5*    G 193          2H5*        G 193  27.905  27.004   2.624
  357    H4*    G 193           H4*        G 193  28.969  27.670   4.632
  358    H3*    G 193           H3*        G 193  27.877  29.954   3.020
  359    H2*    G 193           H2*        G 193  28.514  31.482   4.734
  360   2HO*    G 193          2HO*        G 193  29.271  30.545   6.732
  361    H1*    G 193           H1*        G 193  31.119  30.493   4.885
  362    H8     G 193           H8         G 193  29.933  30.437   1.342
  363    H1     G 193           H1         G 193  32.178  36.206   3.229
  364   1H2     G 193          1H2         G 193  32.471  36.198   5.270
  365   2H2     G 193          2H2         G 193  32.156  34.830   6.315
  366   1H5*    A 194          1H5*        A 194  26.282  30.453   7.061
  367   2H5*    A 194          2H5*        A 194  24.547  30.716   6.888
  368    H4*    A 194           H4*        A 194  25.463  32.436   8.280
  369    H3*    A 194           H3*        A 194  24.515  33.302   5.572
  370    H2*    A 194           H2*        A 194  25.049  35.566   6.069
  371   2HO*    A 194          2HO*        A 194  26.021  35.725   8.398
  372    H1*    A 194           H1*        A 194  27.618  34.919   7.004
  373    H8     A 194           H8         A 194  26.772  32.854   4.015
  374   1H6     A 194          1H6         A 194  28.870  37.586   0.529
  375   2H6     A 194          2H6         A 194  28.338  35.920   0.485
  376    H2     A 194           H2         A 194  28.627  38.968   4.745
  377   1H5*    C 195          1H5*        C 195  22.808  35.698   8.546
  378   2H5*    C 195          2H5*        C 195  21.112  36.127   8.321
  379    H4*    C 195           H4*        C 195  22.384  38.133   8.603
  380    H3*    C 195           H3*        C 195  21.306  37.671   5.837
  381    H2*    C 195           H2*        C 195  22.155  39.773   5.137
  382   2HO*    C 195          2HO*        C 195  23.184  40.226   7.751
  383    H1*    C 195           H1*        C 195  24.669  39.313   6.369
  384   1H4     C 195          1H4         C 195  25.555  38.031   0.169
  385   2H4     C 195          2H4         C 195  24.950  36.412   0.442
  386    H5     C 195           H5         C 195  24.044  35.675   2.494
  387    H6     C 195           H6         C 195  23.490  36.316   4.814
  388   1H5*    G 196          1H5*        G 196  19.193  41.864   6.776
  389   2H5*    G 196          2H5*        G 196  17.586  41.213   6.455
  390    H4*    G 196           H4*        G 196  17.787  43.182   5.170
  391    H3*    G 196           H3*        G 196  18.000  40.671   3.540
  392    H2*    G 196           H2*        G 196  18.141  41.965   1.544
  393   2HO*    G 196          2HO*        G 196  17.994  44.305   3.183
  394    H1*    G 196           H1*        G 196  20.154  43.615   2.553
  395    H8     G 196           H8         G 196  20.527  40.061   3.714
  396    H1     G 196           H1         G 196  23.176  41.224  -2.074
  397   1H2     G 196          1H2         G 196  22.628  43.105  -2.717
  398   2H2     G 196          2H2         G 196  21.603  44.203  -1.821
  399   1H5*    A 197          1H5*        A 197  15.284  38.602   1.488
  400   2H5*    A 197          2H5*        A 197  15.832  39.413   0.020
  401    H4*    A 197           H4*        A 197  13.094  39.265   1.211
  402    H3*    A 197           H3*        A 197  14.319  38.761  -1.482
  403    H2*    A 197           H2*        A 197  12.276  39.299  -2.548
  404   2HO*    A 197          2HO*        A 197  10.935  38.262  -1.055
  405    H1*    A 197           H1*        A 197  11.890  41.576  -0.849
  406    H8     A 197           H8         A 197  14.041  40.062  -3.570
  407   1H6     A 197          1H6         A 197  14.247  45.793  -6.032
  408   2H6     A 197          2H6         A 197  14.677  44.119  -6.300
  409    H2     A 197           H2         A 197  12.238  46.051  -2.077
  410   1H5*    U 198          1H5*        U 198  13.042  35.555   2.222
  411   2H5*    U 198          2H5*        U 198  14.727  35.191   1.853
  412    H4*    U 198           H4*        U 198  13.421  32.887   1.071
  413    H3*    U 198           H3*        U 198  11.921  34.081   3.387
  414    H2*    U 198           H2*        U 198  11.822  32.008   4.447
  415   2HO*    U 198          2HO*        U 198  11.087  30.843   2.683
  416    H1*    U 198           H1*        U 198  14.434  31.268   3.309
  417    H3     U 198           H3         U 198  16.391  30.766   7.293
  418    H5     U 198           H5         U 198  13.329  33.492   8.144
  419    H6     U 198           H6         U 198  12.767  33.456   5.758
  420   1H5*    G 199          1H5*        G 199   8.498  32.224   1.617
  421   2H5*    G 199          2H5*        G 199   8.448  31.832  -0.101
  422    H4*    G 199           H4*        G 199   6.844  34.152   0.305
  423    H3*    G 199           H3*        G 199   6.497  32.097   2.454
  424    H2*    G 199           H2*        G 199   4.128  32.272   2.296
  425   2HO*    G 199          2HO*        G 199   3.561  34.283   1.715
  426    H1*    G 199           H1*        G 199   4.113  31.958  -0.476
  427    H8     G 199           H8         G 199   6.709  29.902   1.357
  428    H1     G 199           H1         G 199   0.971  26.989   0.673
  429   1H2     G 199          1H2         G 199  -0.394  28.329  -0.101
  430   2H2     G 199          2H2         G 199  -0.036  29.992  -0.505
  431   1H5*    A 200          1H5*        A 200   6.145  36.034   6.035
  432   2H5*    A 200          2H5*        A 200   7.780  36.649   5.789
  433    H4*    A 200           H4*        A 200   7.261  35.562   8.029
  434    H3*    A 200           H3*        A 200   9.647  34.838   6.344
  435    H2*    A 200           H2*        A 200  10.426  33.421   8.084
  436   2HO*    A 200          2HO*        A 200   8.154  34.131   9.648
  437    H1*    A 200           H1*        A 200   7.929  32.199   8.450
  438    H8     A 200           H8         A 200   8.657  32.864   4.830
  439   1H6     A 200          1H6         A 200  11.461  27.290   4.723
  440   2H6     A 200          2H6         A 200  10.910  28.619   3.728
  441    H2     A 200           H2         A 200  10.482  28.272   8.944
  442   1H5*    C 201          1H5*        C 201  12.902  36.673  10.897
  443   2H5*    C 201          2H5*        C 201  13.014  35.487   9.597
  444    H4*    C 201           H4*        C 201  10.504  35.680  11.231
  445    H3*    C 201           H3*        C 201  13.090  34.393  12.123
  446    H2*    C 201           H2*        C 201  11.828  32.740  13.218
  447   2HO*    C 201          2HO*        C 201   9.883  33.390  14.012
  448    H1*    C 201           H1*        C 201   9.868  32.758  11.063
  449   1H4     C 201          1H4         C 201  12.647  27.009  10.769
  450   2H4     C 201          2H4         C 201  14.016  27.736   9.959
  451    H5     C 201           H5         C 201  14.267  30.061   9.628
  452    H6     C 201           H6         C 201  13.255  32.283   9.997
  453   1H5*    C 202          1H5*        C 202  11.093  35.436  15.993
  454   2H5*    C 202          2H5*        C 202  12.349  35.470  17.230
  455    H4*    C 202           H4*        C 202  10.646  33.696  17.559
  456    H3*    C 202           H3*        C 202  13.543  32.901  17.222
  457    H2*    C 202           H2*        C 202  12.948  30.698  17.821
  458   2HO*    C 202          2HO*        C 202  11.005  30.412  18.965
  459    H1*    C 202           H1*        C 202  10.517  30.862  16.273
  460   1H4     C 202          1H4         C 202  14.393  26.897  13.077
  461   2H4     C 202          2H4         C 202  15.136  28.289  12.322
  462    H5     C 202           H5         C 202  14.642  30.523  12.906
  463    H6     C 202           H6         C 202  13.301  31.986  14.375
  464   1H5*    C 203          1H5*        C 203  12.916  31.988  21.759
  465   2H5*    C 203          2H5*        C 203  14.579  32.054  22.340
  466    H4*    C 203           H4*        C 203  13.452  29.854  22.654
  467    H3*    C 203           H3*        C 203  16.008  30.038  21.065
  468    H2*    C 203           H2*        C 203  16.085  27.664  20.993
  469   2HO*    C 203          2HO*        C 203  13.849  26.963  22.274
  470    H1*    C 203           H1*        C 203  13.347  27.481  20.284
  471   1H4     C 203          1H4         C 203  16.554  26.792  14.799
  472   2H4     C 203          2H4         C 203  16.652  28.534  14.663
  473    H5     C 203           H5         C 203  15.921  30.027  16.340
  474    H6     C 203           H6         C 203  14.903  30.219  18.581
  475   1H5*    U 204          1H5*        U 204  16.049  27.615  24.313
  476   2H5*    U 204          2H5*        U 204  17.456  27.369  25.348
  477    H4*    U 204           H4*        U 204  16.636  25.245  24.564
  478    H3*    U 204           H3*        U 204  19.311  26.110  23.499
  479    H2*    U 204           H2*        U 204  19.549  24.008  22.404
  480   2HO*    U 204          2HO*        U 204  18.526  22.896  24.170
  481    H1*    U 204           H1*        U 204  17.012  24.128  21.243
  482    H3     U 204           H3         U 204  20.251  24.764  18.017
  483    H5     U 204           H5         U 204  19.342  28.572  19.506
  484    H6     U 204           H6         U 204  18.054  27.465  21.274
  485   1H5*    A 205          1H5*        A 205  20.918  23.513  27.156
  486   2H5*    A 205          2H5*        A 205  22.573  24.113  27.243
  487    H4*    A 205           H4*        A 205  22.203  21.785  26.271
  488    H3*    A 205           H3*        A 205  23.877  23.908  24.949
  489    H2*    A 205           H2*        A 205  24.522  22.343  23.283
  490   2HO*    A 205          2HO*        A 205  23.227  20.132  23.915
  491    H1*    A 205           H1*        A 205  21.902  21.458  22.837
  492    H8     A 205           H8         A 205  21.670  25.095  23.360
  493   1H6     A 205          1H6         A 205  23.344  25.846  17.394
  494   2H6     A 205          2H6         A 205  22.715  26.669  18.805
  495    H2     A 205           H2         A 205  23.993  21.590  18.496
  496   1H5*    G 206          1H5*        G 206  26.399  22.819  22.786
  497   2H5*    G 206          2H5*        G 206  27.873  22.812  23.756
  498    H4*    G 206           H4*        G 206  26.523  25.216  22.511
  499    H3*    G 206           H3*        G 206  28.898  23.581  21.749
  500    H2*    G 206           H2*        G 206  30.143  25.516  21.129
  501   2HO*    G 206          2HO*        G 206  28.438  27.473  21.882
  502    H1*    G 206           H1*        G 206  29.642  26.825  23.541
  503    H8     G 206           H8         G 206  30.153  23.053  23.629
  504    H1     G 206           H1         G 206  35.500  26.557  24.631
  505   1H2     G 206          1H2         G 206  35.080  28.555  24.338
  506   2H2     G 206          2H2         G 206  33.512  29.186  23.889
  507   1H5*    U 207          1H5*        U 207  26.388  24.608  17.236
  508   2H5*    U 207          2H5*        U 207  27.776  24.820  16.169
  509    H4*    U 207           H4*        U 207  25.900  26.536  16.021
  510    H3*    U 207           H3*        U 207  28.809  27.256  16.286
  511    H2*    U 207           H2*        U 207  28.253  29.552  16.046
  512   2HO*    U 207          2HO*        U 207  25.498  28.953  15.837
  513    H1*    U 207           H1*        U 207  26.172  29.439  17.913
  514    H3     U 207           H3         U 207  29.153  31.705  20.397
  515    H5     U 207           H5         U 207  30.962  27.953  19.956
  516    H6     U 207           H6         U 207  29.117  27.350  18.458
  517   1H5*    A 208          1H5*        A 208  29.520  28.905  11.229
  518   2H5*    A 208          2H5*        A 208  28.038  28.589  10.325
  519    H4*    A 208           H4*        A 208  29.848  27.521   9.197
  520    H3*    A 208           H3*        A 208  27.880  25.715  10.529
  521    H2*    A 208           H2*        A 208  29.080  23.776   9.853
  522   2HO*    A 208          2HO*        A 208  30.260  24.041   8.043
  523    H1*    A 208           H1*        A 208  31.533  24.754  10.777
  524    H8     A 208           H8         A 208  28.220  25.286  12.632
  525   1H6     A 208          1H6         A 208  30.145  20.673  16.369
  526   2H6     A 208          2H6         A 208  28.872  21.844  16.101
  527    H2     A 208           H2         A 208  33.156  21.197  13.143
  528   1H5*    G 209          1H5*        G 209  27.089  24.413   7.124
  529   2H5*    G 209          2H5*        G 209  25.422  23.931   6.809
  530    H4*    G 209           H4*        G 209  26.791  22.192   7.932
  531    H3*    G 209           H3*        G 209  24.266  23.212   9.197
  532    H2*    G 209           H2*        G 209  24.489  21.606  10.942
  533   2HO*    G 209          2HO*        G 209  26.855  20.482  10.323
  534    H1*    G 209           H1*        G 209  27.154  22.283  11.448
  535    H8     G 209           H8         G 209  25.286  25.389  10.621
  536    H1     G 209           H1         G 209  24.456  23.475  16.747
  537   1H2     G 209          1H2         G 209  25.221  21.575  16.984
  538   2H2     G 209          2H2         G 209  25.975  20.639  15.712
  539   1H5*    A 210          1H5*        A 210  24.321  18.981   9.959
  540   2H5*    A 210          2H5*        A 210  22.792  18.428   9.275
  541    H4*    A 210           H4*        A 210  22.949  17.617  11.512
  542    H3*    A 210           H3*        A 210  20.945  19.834  11.141
  543    H2*    A 210           H2*        A 210  20.234  19.539  13.387
  544   2HO*    A 210          2HO*        A 210  21.222  17.652  14.511
  545    H1*    A 210           H1*        A 210  22.856  19.489  14.393
  546    H8     A 210           H8         A 210  22.411  22.014  11.651
  547   1H6     A 210          1H6         A 210  20.738  26.046  16.112
  548   2H6     A 210          2H6         A 210  21.130  25.893  14.414
  549    H2     A 210           H2         A 210  21.061  22.008  17.938
  550   1H5*    G 211          1H5*        G 211  18.827  16.257  12.620
  551   2H5*    G 211          2H5*        G 211  17.162  16.248  12.037
  552    H4*    G 211           H4*        G 211  17.384  16.182  14.512
  553    H3*    G 211           H3*        G 211  15.837  18.377  13.164
  554    H2*    G 211           H2*        G 211  15.168  19.207  15.295
  555   2HO*    G 211          2HO*        G 211  16.713  17.266  16.642
  556    H1*    G 211           H1*        G 211  17.771  19.206  16.302
  557    H8     G 211           H8         G 211  18.114  20.223  12.787
  558    H1     G 211           H1         G 211  15.859  25.002  16.524
  559   1H2     G 211          1H2         G 211  15.305  24.239  18.358
  560   2H2     G 211          2H2         G 211  15.433  22.555  18.816
  561   1H5*    G 212          1H5*        G 212  12.427  16.519  15.829
  562   2H5*    G 212          2H5*        G 212  11.245  16.385  14.528
  563    H4*    G 212           H4*        G 212  10.319  17.563  16.443
  564    H3*    G 212           H3*        G 212  10.647  19.103  13.882
  565    H2*    G 212           H2*        G 212   9.545  20.970  14.872
  566   2HO*    G 212          2HO*        G 212   8.901  20.450  17.244
  567    H1*    G 212           H1*        G 212  11.149  20.921  17.156
  568    H8     G 212           H8         G 212  13.139  20.024  14.114
  569    H1     G 212           H1         G 212  12.519  26.400  15.031
  570   1H2     G 212          1H2         G 212  11.141  26.751  16.523
  571   2H2     G 212          2H2         G 212  10.282  25.503  17.398
  572   1H5*    G 213          1H5*        G 213   5.842  19.111  14.289
  573   2H5*    G 213          2H5*        G 213   5.530  19.102  12.554
  574    H4*    G 213           H4*        G 213   4.483  20.992  13.803
  575    H3*    G 213           H3*        G 213   6.329  21.482  11.483
  576    H2*    G 213           H2*        G 213   5.875  23.818  11.621
  577   2HO*    G 213          2HO*        G 213   4.061  24.440  12.771
  578    H1*    G 213           H1*        G 213   6.376  23.924  14.366
  579    H8     G 213           H8         G 213   8.806  21.529  12.950
  580    H1     G 213           H1         G 213  10.475  27.694  11.906
  581   1H2     G 213          1H2         G 213   8.888  28.925  12.369
  582   2H2     G 213          2H2         G 213   7.335  28.370  12.953
  583   1H5*    G 214          1H5*        G 214   4.866  24.689   9.869
  584   2H5*    G 214          2H5*        G 214   4.592  24.066   8.243
  585    H4*    G 214           H4*        G 214   6.482  25.698   8.474
  586    H3*    G 214           H3*        G 214   6.871  22.975   7.264
  587    H2*    G 214           H2*        G 214   9.122  23.538   6.729
  588   2HO*    G 214          2HO*        G 214   9.428  25.961   7.752
  589    H1*    G 214           H1*        G 214   9.683  24.471   9.301
  590    H8     G 214           H8         G 214   7.486  21.575   9.818
  591    H1     G 214           H1         G 214  13.519  19.828   8.255
  592   1H2     G 214          1H2         G 214  14.558  21.473   7.576
  593   2H2     G 214          2H2         G 214  13.895  23.087   7.449
  594   1H5*    G 215          1H5*        G 215   8.027  25.677   2.912
  595   2H5*    G 215          2H5*        G 215   6.687  24.676   2.354
  596    H4*    G 215           H4*        G 215   8.759  24.521   0.975
  597    H3*    G 215           H3*        G 215   7.506  22.080   2.197
  598    H2*    G 215           H2*        G 215   9.096  20.703   1.077
  599   2HO*    G 215          2HO*        G 215   9.583  21.633  -0.826
  600    H1*    G 215           H1*        G 215  11.275  22.209   1.943
  601    H8     G 215           H8         G 215   8.943  22.243   4.779
  602    H1     G 215           H1         G 215  12.037  16.587   4.215
  603   1H2     G 215          1H2         G 215  12.988  16.502   2.387
  604   2H2     G 215          2H2         G 215  12.953  17.774   1.186
  605   1H5*    C 216          1H5*        C 216   5.505  21.642  -2.061
  606   2H5*    C 216          2H5*        C 216   4.037  20.773  -1.614
  607    H4*    C 216           H4*        C 216   5.796  19.490  -2.921
  608    H3*    C 216           H3*        C 216   4.583  18.463  -0.361
  609    H2*    C 216           H2*        C 216   5.721  16.404  -0.683
  610   2HO*    C 216          2HO*        C 216   6.743  17.487  -3.129
  611    H1*    C 216           H1*        C 216   8.163  17.666  -1.296
  612   1H4     C 216          1H4         C 216   8.469  16.108   4.909
  613   2H4     C 216          2H4         C 216   7.798  17.678   5.293
  614    H5     C 216           H5         C 216   7.009  19.203   3.672
  615    H6     C 216           H6         C 216   6.667  19.603   1.259
  616   1H5*    U 217          1H5*        U 217   4.191  15.776  -3.192
  617   2H5*    U 217          2H5*        U 217   2.673  14.917  -3.451
  618    H4*    U 217           H4*        U 217   4.317  13.263  -3.130
  619    H3*    U 217           H3*        U 217   2.587  13.645  -0.700
  620    H2*    U 217           H2*        U 217   3.676  11.799   0.343
  621   2HO*    U 217          2HO*        U 217   5.299  10.691  -1.071
  622    H1*    U 217           H1*        U 217   6.232  12.784  -0.237
  623    H3     U 217           H3         U 217   5.965  13.435   4.232
  624    H5     U 217           H5         U 217   3.454  16.390   2.649
  625    H6     U 217           H6         U 217   3.790  15.357   0.450
  626   1H5*    G 218          1H5*        G 218   0.076   9.413  -2.294
  627   2H5*    G 218          2H5*        G 218  -0.230   8.874  -0.644
  628    H4*    G 218           H4*        G 218   1.215   7.234  -1.021
  629    H3*    G 218           H3*        G 218   3.139   9.541  -0.885
  630    H2*    G 218           H2*        G 218   4.915   8.126  -1.512
  631   2HO*    G 218          2HO*        G 218   4.619   6.224  -0.502
  632    H1*    G 218           H1*        G 218   3.283   6.782  -3.466
  633    H8     G 218           H8         G 218   3.164  10.488  -3.777
  634    H1     G 218           H1         G 218   8.289   7.841  -6.712
  635   1H2     G 218          1H2         G 218   8.447   5.858  -6.168
  636   2H2     G 218          2H2         G 218   7.353   5.036  -5.079
  637   1H5*    C 219          1H5*        C 219   4.282   6.767   2.034
  638   2H5*    C 219          2H5*        C 219   3.755   5.404   3.022
  639    H4*    C 219           H4*        C 219   4.827   6.606   4.617
  640    H3*    C 219           H3*        C 219   1.991   7.556   4.606
  641    H2*    C 219           H2*        C 219   2.455   9.235   6.189
  642   2HO*    C 219          2HO*        C 219   4.301   8.974   7.476
  643    H1*    C 219           H1*        C 219   4.848  10.074   4.989
  644   1H4     C 219          1H4         C 219   0.036  13.855   2.950
  645   2H4     C 219          2H4         C 219   0.227  13.068   1.399
  646    H5     C 219           H5         C 219   1.621  11.196   1.037
  647    H6     C 219           H6         C 219   3.191   9.603   2.083
  648   1H5*    G 220          1H5*        G 220   4.885   3.577   6.561
  649   2H5*    G 220          2H5*        G 220   4.989   5.310   6.251
  650    H4*    G 220           H4*        G 220   6.522   3.128   5.125
  651    H3*    G 220           H3*        G 220   6.790   6.140   5.177
  652    H2*    G 220           H2*        G 220   8.522   5.965   3.622
  653   2HO*    G 220          2HO*        G 220   8.478   3.156   4.252
  654    H1*    G 220           H1*        G 220   7.219   3.612   2.425
  655    H8     G 220           H8         G 220   6.871   4.223   0.006
  656    H1     G 220           H1         G 220   6.792  10.566   1.290
  657   1H2     G 220          1H2         G 220   6.893  10.858   3.329
  658   2H2     G 220          2H2         G 220   6.984   9.574   4.514
  659   1H5*    G 221          1H5*        G 221  10.281   5.018   6.238
  660   2H5*    G 221          2H5*        G 221  11.385   6.165   6.997
  661    H4*    G 221           H4*        G 221  11.113   5.838   4.328
  662    H3*    G 221           H3*        G 221  12.025   8.220   5.929
  663    H2*    G 221           H2*        G 221  12.372   9.418   3.910
  664   2HO*    G 221          2HO*        G 221  13.185   7.852   2.584
  665    H1*    G 221           H1*        G 221   9.892   8.711   2.831
  666    H8     G 221           H8         G 221   9.882   9.375   6.555
  667    H1     G 221           H1         G 221   8.857  14.614   2.897
  668   1H2     G 221          1H2         G 221   9.159  14.140   0.914
  669   2H2     G 221          2H2         G 221   9.622  12.557   0.328
  670   1H5*    C 222          1H5*        C 222  15.672   8.201   3.342
  671   2H5*    C 222          2H5*        C 222  16.725   9.126   4.413
  672    H4*    C 222           H4*        C 222  15.710  10.158   2.201
  673    H3*    C 222           H3*        C 222  16.149  11.578   4.833
  674    H2*    C 222           H2*        C 222  15.543  13.595   3.771
  675   2HO*    C 222          2HO*        C 222  15.153  12.805   1.230
  676    H1*    C 222           H1*        C 222  13.437  12.311   2.298
  677   1H4     C 222          1H4         C 222  10.607  15.801   6.865
  678   2H4     C 222          2H4         C 222  10.747  14.426   7.940
  679    H5     C 222           H5         C 222  11.914  12.446   7.398
  680    H6     C 222           H6         C 222  13.245  11.283   5.674
  681   1H5*    U 223          1H5*        U 223  17.060  14.629   2.521
  682   2H5*    U 223          2H5*        U 223  18.743  14.999   2.897
  683    H4*    U 223           H4*        U 223  17.482  16.972   3.268
  684    H3*    U 223           H3*        U 223  18.372  15.612   5.797
  685    H2*    U 223           H2*        U 223  17.373  17.276   7.096
  686   2HO*    U 223          2HO*        U 223  16.646  18.990   5.059
  687    H1*    U 223           H1*        U 223  15.200  17.566   5.157
  688    H3     U 223           H3         U 223  13.049  17.184   9.160
  689    H5     U 223           H5         U 223  14.465  13.326   8.350
  690    H6     U 223           H6         U 223  15.702  14.283   6.461
  691   1H5*    U 224          1H5*        U 224  20.730  18.344   2.068
  692   2H5*    U 224          2H5*        U 224  19.166  18.021   2.814
  693    H4*    U 224           H4*        U 224  20.026  16.426   0.424
  694    H3*    U 224           H3*        U 224  19.371  19.316   0.377
  695    H2*    U 224           H2*        U 224  17.738  19.099  -1.318
  696   2HO*    U 224          2HO*        U 224  17.973  16.331  -1.559
  697    H1*    U 224           H1*        U 224  16.374  17.011  -0.151
  698    H3     U 224           H3         U 224  13.506  20.143   1.243
  699    H5     U 224           H5         U 224  17.082  21.325   3.074
  700    H6     U 224           H6         U 224  18.179  19.471   1.903
  701   1H5*    A 225          1H5*        A 225  20.197  18.459  -4.039
  702   2H5*    A 225          2H5*        A 225  20.521  20.069  -4.680
  703    H4*    A 225           H4*        A 225  18.429  18.914  -5.507
  704    H3*    A 225           H3*        A 225  18.367  21.695  -4.336
  705    H2*    A 225           H2*        A 225  16.098  21.872  -4.998
  706   2HO*    A 225          2HO*        A 225  15.471  19.673  -6.206
  707    H1*    A 225           H1*        A 225  15.482  19.264  -4.059
  708    H8     A 225           H8         A 225  17.603  21.233  -1.681
  709   1H6     A 225          1H6         A 225  12.279  23.421   0.732
  710   2H6     A 225          2H6         A 225  14.013  23.353   0.953
  711    H2     A 225           H2         A 225  11.304  21.167  -2.971
  712   1H5*    G 226          1H5*        G 226  17.217  21.235  -8.258
  713   2H5*    G 226          2H5*        G 226  17.302  22.495  -9.488
  714    H4*    G 226           H4*        G 226  15.037  21.698  -9.277
  715    H3*    G 226           H3*        G 226  15.543  24.519  -8.365
  716    H2*    G 226           H2*        G 226  13.204  24.813  -8.024
  717   2HO*    G 226          2HO*        G 226  12.487  23.615  -9.785
  718    H1*    G 226           H1*        G 226  12.961  22.438  -6.558
  719    H8     G 226           H8         G 226  16.170  23.870  -5.508
  720    H1     G 226           H1         G 226  11.134  26.971  -2.881
  721   1H2     G 226          1H2         G 226   9.398  26.399  -3.836
  722   2H2     G 226          2H2         G 226   9.319  25.250  -5.153
  723   1H5*    G 227          1H5*        G 227  13.429  26.078 -11.589
  724   2H5*    G 227          2H5*        G 227  13.806  24.576 -12.432
  725    H4*    G 227           H4*        G 227  12.966  26.087 -14.048
  726    H3*    G 227           H3*        G 227  15.926  25.637 -14.217
  727    H2*    G 227           H2*        G 227  16.056  27.047 -16.134
  728   2HO*    G 227          2HO*        G 227  14.076  27.662 -17.116
  729    H1*    G 227           H1*        G 227  14.645  29.123 -14.915
  730    H8     G 227           H8         G 227  16.778  27.546 -12.323
  731    H1     G 227           H1         G 227  20.040  31.623 -16.147
  732   1H2     G 227          1H2         G 227  18.867  32.140 -17.763
  733   2H2     G 227          2H2         G 227  17.242  31.556 -18.040
  734   1H5*    A 228          1H5*        A 228  14.293  24.777 -18.237
  735   2H5*    A 228          2H5*        A 228  15.106  23.332 -18.838
  736    H4*    A 228           H4*        A 228  15.279  25.157 -20.430
  737    H3*    A 228           H3*        A 228  17.803  24.149 -19.164
  738    H2*    A 228           H2*        A 228  19.099  25.654 -20.468
  739   2HO*    A 228          2HO*        A 228  17.070  26.962 -21.749
  740    H1*    A 228           H1*        A 228  17.467  27.854 -19.857
  741    H8     A 228           H8         A 228  17.739  25.917 -16.745
  742   1H6     A 228          1H6         A 228  23.287  28.612 -15.788
  743   2H6     A 228          2H6         A 228  22.038  27.636 -15.047
  744    H2     A 228           H2         A 228  22.005  29.509 -19.946
  745   1H5*    G 229          1H5*        G 229  18.408  24.047 -23.580
  746   2H5*    G 229          2H5*        G 229  19.087  22.457 -23.927
  747    H4*    G 229           H4*        G 229  20.425  24.145 -24.988
  748    H3*    G 229           H3*        G 229  21.712  22.700 -22.691
  749    H2*    G 229           H2*        G 229  23.754  23.858 -23.104
  750   2HO*    G 229          2HO*        G 229  24.012  24.701 -25.126
  751    H1*    G 229           H1*        G 229  22.520  26.360 -23.176
  752    H8     G 229           H8         G 229  20.754  24.447 -20.568
  753    H1     G 229           H1         G 229  26.498  26.655 -18.566
  754   1H2     G 229          1H2         G 229  27.573  27.345 -20.185
  755   2H2     G 229          2H2         G 229  27.002  27.327 -21.839
  756   1H5*    G 230          1H5*        G 230  24.446  22.365 -26.186
  757   2H5*    G 230          2H5*        G 230  25.073  20.717 -26.165
  758    H4*    G 230           H4*        G 230  26.872  22.352 -26.268
  759    H3*    G 230           H3*        G 230  26.679  20.622 -23.820
  760    H2*    G 230           H2*        G 230  28.708  21.559 -22.992
  761   2HO*    G 230          2HO*        G 230  29.247  23.422 -24.849
  762    H1*    G 230           H1*        G 230  27.859  24.187 -23.394
  763    H8     G 230           H8         G 230  24.866  22.340 -22.301
  764    H1     G 230           H1         G 230  28.873  23.686 -17.400
  765   1H2     G 230          1H2         G 230  30.679  24.340 -18.147
  766   2H2     G 230          2H2         G 230  31.054  24.499 -19.848
  767   1H5*    G 231          1H5*        G 231  30.973  20.208 -25.340
  768   2H5*    G 231          2H5*        G 231  31.185  18.459 -25.267
  769    H4*    G 231           H4*        G 231  33.017  19.593 -24.159
  770    H3*    G 231           H3*        G 231  31.193  17.924 -22.454
  771    H2*    G 231           H2*        G 231  32.580  18.331 -20.561
  772   2HO*    G 231          2HO*        G 231  34.414  20.009 -21.481
  773    H1*    G 231           H1*        G 231  32.614  21.092 -20.964
  774    H8     G 231           H8         G 231  29.228  19.914 -21.880
  775    H1     G 231           H1         G 231  30.063  20.423 -15.483
  776   1H2     G 231          1H2         G 231  32.064  20.699 -15.070
  777   2H2     G 231          2H2         G 231  33.329  20.781 -16.276
  778   1H5*    C 232          1H5*        C 232  35.146  16.706 -21.554
  779   2H5*    C 232          2H5*        C 232  35.252  14.948 -21.483
  780    H4*    C 232           H4*        C 232  36.094  15.878 -19.438
  781    H3*    C 232           H3*        C 232  33.495  14.388 -19.226
  782    H2*    C 232           H2*        C 232  33.511  14.675 -16.867
  783   2HO*    C 232          2HO*        C 232  35.679  16.097 -16.384
  784    H1*    C 232           H1*        C 232  34.139  17.424 -17.069
  785   1H4     C 232          1H4         C 232  27.816  17.262 -16.183
  786   2H4     C 232          2H4         C 232  27.599  16.935 -17.887
  787    H5     C 232           H5         C 232  29.379  16.555 -19.392
  788    H6     C 232           H6         C 232  31.832  16.393 -19.633
  789   1H5*    A 233          1H5*        A 233  36.397  12.404 -16.515
  790   2H5*    A 233          2H5*        A 233  36.035  10.681 -16.446
  791    H4*    A 233           H4*        A 233  36.007  11.729 -14.233
  792    H3*    A 233           H3*        A 233  33.476  10.503 -15.287
  793    H2*    A 233           H2*        A 233  32.389  10.951 -13.221
  794   2HO*    A 233          2HO*        A 233  34.193  12.203 -11.769
  795    H1*    A 233           H1*        A 233  33.290  13.611 -13.137
  796    H8     A 233           H8         A 233  32.396  12.865 -16.642
  797   1H6     A 233          1H6         A 233  26.461  14.075 -15.139
  798   2H6     A 233          2H6         A 233  27.556  13.792 -16.474
  799    H2     A 233           H2         A 233  28.825  13.840 -11.385
  800   1H5*    G 234          1H5*        G 234  34.010   8.963 -11.235
  801   2H5*    G 234          2H5*        G 234  33.965   7.210 -11.415
  802    H4*    G 234           H4*        G 234  32.504   7.774  -9.637
  803    H3*    G 234           H3*        G 234  31.086   6.966 -12.158
  804    H2*    G 234           H2*        G 234  28.993   7.113 -11.028
  805   2HO*    G 234          2HO*        G 234  29.680   6.323  -9.036
  806    H1*    G 234           H1*        G 234  29.526   9.655 -10.009
  807    H8     G 234           H8         G 234  30.973   9.457 -13.424
  808    H1     G 234           H1         G 234  24.599  10.576 -13.426
  809   1H2     G 234          1H2         G 234  23.850  10.294 -11.525
  810   2H2     G 234          2H2         G 234  24.806   9.825 -10.138
  811   1H    GLY  15          1H        GLY  15   2.702  -1.694  -1.918
  812   1HA   GLY  15          1HA       GLY  15   5.129  -2.157  -1.695
  813   2HA   GLY  15          2HA       GLY  15   4.751  -1.471  -3.267
  814    H    ARG  16           H        ARG  16   7.206  -1.372  -1.565
  815    HA   ARG  16           HA       ARG  16   7.608   1.127  -0.423
  816   1HB   ARG  16          2HB       ARG  16   9.362  -0.967  -1.582
  817   2HB   ARG  16          3HB       ARG  16  10.069   0.630  -1.377
  818   1HG   ARG  16          2HG       ARG  16  10.222   0.401   0.836
  819   2HG   ARG  16          3HG       ARG  16   8.604  -0.293   0.968
  820   1HD   ARG  16          2HD       ARG  16   9.825  -2.358  -0.175
  821   2HD   ARG  16          3HD       ARG  16  11.230  -1.628   0.601
  822    HE   ARG  16           HE       ARG  16   8.961  -1.963   2.344
  823   1HH1  ARG  16          2HH1      ARG  16  11.831  -3.439   1.038
  824   2HH1  ARG  16          1HH1      ARG  16  12.012  -4.555   2.351
  825   1HH2  ARG  16          2HH2      ARG  16   9.190  -3.427   4.079
  826   2HH2  ARG  16          1HH2      ARG  16  10.508  -4.547   4.079
  827    H    ALA  17           H        ALA  17   8.791   0.171  -3.650
  828    HA   ALA  17           HA       ALA  17   9.045   1.340  -5.587
  829   1HB   ALA  17          1HB       ALA  17   7.460   3.070  -6.126
  830   2HB   ALA  17          2HB       ALA  17   6.624   1.765  -5.283
  831   3HB   ALA  17          3HB       ALA  17   7.025   3.254  -4.427
  832    H    ARG  18           H        ARG  18  10.358   2.139  -2.875
  833    HA   ARG  18           HA       ARG  18  11.005   4.881  -3.052
  834   1HB   ARG  18          2HB       ARG  18  11.303   3.207  -1.083
  835   2HB   ARG  18          3HB       ARG  18  12.851   2.849  -1.838
  836   1HG   ARG  18          2HG       ARG  18  13.772   4.700  -1.029
  837   2HG   ARG  18          3HG       ARG  18  12.422   5.698  -1.572
  838   1HD   ARG  18          2HD       ARG  18  12.245   5.971   0.695
  839   2HD   ARG  18          3HD       ARG  18  11.200   4.571   0.465
  840    HE   ARG  18           HE       ARG  18  12.642   3.375   1.757
  841   1HH1  ARG  18          2HH1      ARG  18  14.357   6.096   0.422
  842   2HH1  ARG  18          1HH1      ARG  18  15.823   5.761   1.283
  843   1HH2  ARG  18          2HH2      ARG  18  14.566   2.924   2.896
  844   2HH2  ARG  18          1HH2      ARG  18  15.941   3.956   2.689
  845    H    GLY  19           H        GLY  19  11.584   5.333  -5.195
  846   1HA   GLY  19          1HA       GLY  19  14.050   5.743  -5.983
  847   2HA   GLY  19          2HA       GLY  19  13.975   4.007  -6.252
  848    H    LEU  20           H        LEU  20  10.942   4.811  -6.832
  849    HA   LEU  20           HA       LEU  20  11.449   5.443  -9.665
  850   1HB   LEU  20          2HB       LEU  20   9.790   3.405  -8.361
  851   2HB   LEU  20          3HB       LEU  20   8.987   4.283  -9.660
  852    HG   LEU  20           HG       LEU  20  11.665   3.269 -10.326
  853   1HD1  LEU  20          1HD1      LEU  20   9.485   1.236 -10.260
  854   2HD1  LEU  20          2HD1      LEU  20  10.459   1.514  -8.816
  855   3HD1  LEU  20          3HD1      LEU  20  11.234   1.012 -10.319
  856   1HD2  LEU  20          1HD2      LEU  20  10.167   4.342 -11.944
  857   2HD2  LEU  20          2HD2      LEU  20   8.974   3.070 -11.676
  858   3HD2  LEU  20          3HD2      LEU  20  10.536   2.677 -12.396
  859    H    CYS  21           H        CYS  21  10.711   7.429 -10.319
  860    HA   CYS  21           HA       CYS  21   9.188   9.020  -8.624
  861   1HB   CYS  21          2HB       CYS  21  10.652   9.973 -10.319
  862   2HB   CYS  21          3HB       CYS  21   9.700   9.260 -11.606
  863    H    TYR  22           H        TYR  22   7.009   9.490  -8.628
  864    HA   TYR  22           HA       TYR  22   5.273   7.618 -10.092
  865   1HB   TYR  22          2HB       TYR  22   5.263   7.532  -7.571
  866   2HB   TYR  22          3HB       TYR  22   4.583   9.156  -7.584
  867    HD1  TYR  22           HD1      TYR  22   3.793   6.315  -9.850
  868    HD2  TYR  22           HD2      TYR  22   2.434   8.847  -6.712
  869    HE1  TYR  22           HE1      TYR  22   1.536   5.362 -10.066
  870    HE2  TYR  22           HE2      TYR  22   0.174   7.899  -6.920
  871    HH   TYR  22           HH       TYR  22  -0.743   5.891  -9.553
  872    H    THR  23           H        THR  23   6.223   9.928 -11.374
  873    HA   THR  23           HA       THR  23   3.686  11.321 -11.826
  874    HB   THR  23           HB       THR  23   6.333  12.710 -11.382
  875    HG1  THR  23           HG1      THR  23   3.837  12.739 -10.013
  876   1HG2  THR  23          1HG2      THR  23   3.703  13.776 -12.406
  877   2HG2  THR  23          2HG2      THR  23   5.264  13.799 -13.227
  878   3HG2  THR  23          3HG2      THR  23   5.004  14.795 -11.796
  879    H    CYS  24           H        CYS  24   7.108  10.900 -12.981
  880    HA   CYS  24           HA       CYS  24   6.025  11.185 -15.686
  881   1HB   CYS  24          2HB       CYS  24   8.298  11.771 -16.394
  882   2HB   CYS  24          3HB       CYS  24   7.715  12.866 -15.158
  883    H    GLY  25           H        GLY  25   7.975   9.308 -13.442
  884   1HA   GLY  25          1HA       GLY  25   7.889   6.893 -13.503
  885   2HA   GLY  25          2HA       GLY  25   7.777   6.990 -15.254
  886    H    SER  26           H        SER  26  10.017   8.930 -13.398
  887    HA   SER  26           HA       SER  26  12.226   7.533 -14.726
  888   1HB   SER  26          2HB       SER  26  11.823  10.117 -14.805
  889   2HB   SER  26          3HB       SER  26  12.552  10.097 -13.200
  890    HG   SER  26           HG       SER  26  14.093  10.415 -14.883
  891    HA   PRO  27           HA       PRO  27  13.083   5.606 -10.794
  892   1HB   PRO  27          2HB       PRO  27  15.241   4.202 -11.655
  893   2HB   PRO  27          3HB       PRO  27  13.578   3.715 -12.002
  894   1HG   PRO  27          2HG       PRO  27  15.525   5.176 -13.743
  895   2HG   PRO  27          3HG       PRO  27  14.417   3.858 -14.166
  896   1HD   PRO  27          2HD       PRO  27  13.876   6.451 -14.726
  897   2HD   PRO  27          3HD       PRO  27  12.605   5.272 -14.349
  898    H    GLY  28           H        GLY  28  13.770   7.350  -9.551
  899   1HA   GLY  28          1HA       GLY  28  16.334   7.497  -8.662
  900   2HA   GLY  28          2HA       GLY  28  16.320   8.609 -10.023
  901    H    HIS  29           H        HIS  29  14.400  10.192  -9.963
  902    HA   HIS  29           HA       HIS  29  14.430  11.431  -7.324
  903   1HB   HIS  29          2HB       HIS  29  13.664  13.432  -8.420
  904   2HB   HIS  29          3HB       HIS  29  14.976  12.751  -9.379
  905    HD1  HIS  29           HD1      HIS  29  14.501  12.400 -11.795
  906    HD2  HIS  29           HD2      HIS  29  11.023  12.830  -9.563
  907    HE1  HIS  29           HE1      HIS  29  12.629  12.468 -13.473
  908    H    TYR  30           H        TYR  30  12.322  12.617  -6.728
  909    HA   TYR  30           HA       TYR  30  10.088  10.726  -7.072
  910   1HB   TYR  30          2HB       TYR  30  11.269  11.931  -4.711
  911   2HB   TYR  30          3HB       TYR  30   9.546  12.279  -4.813
  912    HD1  TYR  30           HD1      TYR  30  11.762   9.325  -5.439
  913    HD2  TYR  30           HD2      TYR  30   8.208  10.823  -3.641
  914    HE1  TYR  30           HE1      TYR  30  11.264   7.079  -4.567
  915    HE2  TYR  30           HE2      TYR  30   7.701   8.582  -2.764
  916    HH   TYR  30           HH       TYR  30   8.248   6.233  -3.290
  917    H    GLN  31           H        GLN  31   7.913  11.870  -6.522
  918    HA   GLN  31           HA       GLN  31   7.297  13.643  -8.543
  919   1HB   GLN  31          2HB       GLN  31   5.534  12.451  -7.473
  920   2HB   GLN  31          3HB       GLN  31   5.935  13.132  -5.902
  921   1HG   GLN  31          2HG       GLN  31   5.167  15.301  -6.586
  922   2HG   GLN  31          3HG       GLN  31   4.909  14.732  -8.234
  923   1HE2  GLN  31          1HE2      GLN  31   3.580  12.477  -8.040
  924   2HE2  GLN  31          2HE2      GLN  31   2.084  12.673  -7.198
  925    H    ALA  32           H        ALA  32   8.212  14.337  -5.201
  926    HA   ALA  32           HA       ALA  32   7.744  17.102  -5.231
  927   1HB   ALA  32          1HB       ALA  32   9.029  17.216  -3.249
  928   2HB   ALA  32          2HB       ALA  32   8.218  15.649  -3.222
  929   3HB   ALA  32          3HB       ALA  32   9.924  15.752  -3.658
  930    H    GLN  33           H        GLN  33  10.248  15.202  -6.651
  931    HA   GLN  33           HA       GLN  33  11.707  17.663  -7.355
  932   1HB   GLN  33          2HB       GLN  33  12.671  14.940  -6.608
  933   2HB   GLN  33          3HB       GLN  33  13.605  15.864  -7.777
  934   1HG   GLN  33          2HG       GLN  33  14.544  17.031  -6.156
  935   2HG   GLN  33          3HG       GLN  33  12.963  17.551  -5.575
  936   1HE2  GLN  33          1HE2      GLN  33  15.058  14.687  -5.531
  937   2HE2  GLN  33          2HE2      GLN  33  14.738  14.268  -3.886
  938    H    CYS  34           H        CYS  34   9.384  16.035  -8.697
  939    HA   CYS  34           HA       CYS  34  10.587  14.958 -11.022
  940   1HB   CYS  34          2HB       CYS  34   8.368  14.245 -10.102
  941   2HB   CYS  34          3HB       CYS  34   7.697  15.785 -10.602
  942    HA   PRO  35           HA       PRO  35  11.331  18.920 -12.938
  943   1HB   PRO  35          2HB       PRO  35  12.105  17.931 -15.345
  944   2HB   PRO  35          3HB       PRO  35  13.145  17.904 -13.915
  945   1HG   PRO  35          2HG       PRO  35  11.461  15.718 -15.074
  946   2HG   PRO  35          3HG       PRO  35  13.115  15.639 -14.437
  947   1HD   PRO  35          2HD       PRO  35  10.961  14.839 -13.004
  948   2HD   PRO  35          3HD       PRO  35  12.401  15.551 -12.247
  949    H    LYS  36           H        LYS  36   8.991  16.593 -13.844
  950    HA   LYS  36           HA       LYS  36   7.875  18.301 -15.943
  951   1HB   LYS  36          2HB       LYS  36   7.918  15.475 -15.448
  952   2HB   LYS  36          3HB       LYS  36   6.249  16.021 -15.536
  953   1HG   LYS  36          2HG       LYS  36   6.361  16.410 -17.739
  954   2HG   LYS  36          3HG       LYS  36   7.990  17.083 -17.640
  955   1HD   LYS  36          2HD       LYS  36   8.492  14.483 -17.093
  956   2HD   LYS  36          3HD       LYS  36   7.104  14.323 -18.172
  957   1HE   LYS  36          2HE       LYS  36   8.470  14.616 -19.899
  958   2HE   LYS  36          3HE       LYS  36   8.785  16.254 -19.330
  959   1HZ   LYS  36          1HZ       LYS  36  10.295  13.832 -18.505
  960   2HZ   LYS  36          2HZ       LYS  36  10.609  15.416 -18.002
  961   3HZ   LYS  36          3HZ       LYS  36  10.828  14.984 -19.623
  962    H    LYS  37           H        LYS  37   7.703  18.127 -12.695
  963    HA   LYS  37           HA       LYS  37   4.832  18.441 -12.414
  964   1HB   LYS  37          2HB       LYS  37   7.028  17.792 -10.680
  965   2HB   LYS  37          3HB       LYS  37   6.140  19.155 -10.013
  966   1HG   LYS  37          2HG       LYS  37   4.714  16.693 -10.942
  967   2HG   LYS  37          3HG       LYS  37   5.442  16.780  -9.337
  968   1HD   LYS  37          2HD       LYS  37   4.120  19.051  -9.218
  969   2HD   LYS  37          3HD       LYS  37   3.130  18.290 -10.465
  970   1HE   LYS  37          2HE       LYS  37   2.687  16.408  -9.007
  971   2HE   LYS  37          3HE       LYS  37   3.763  17.072  -7.779
  972   1HZ   LYS  37          1HZ       LYS  37   1.503  17.559  -7.203
  973   2HZ   LYS  37          2HZ       LYS  37   1.205  18.253  -8.716
  974   3HZ   LYS  37          3HZ       LYS  37   2.266  19.006  -7.634
  975    H    ARG  38           H        ARG  38   4.184  20.326 -13.338
  976    HA   ARG  38           HA       ARG  38   4.741  22.753 -11.936
  977   1HB   ARG  38          2HB       ARG  38   6.551  22.195 -13.924
  978   2HB   ARG  38          3HB       ARG  38   5.369  23.186 -14.768
  979   1HG   ARG  38          2HG       ARG  38   5.643  24.943 -13.091
  980   2HG   ARG  38          3HG       ARG  38   6.833  23.947 -12.250
  981   1HD   ARG  38          2HD       ARG  38   7.576  24.109 -14.989
  982   2HD   ARG  38          3HD       ARG  38   7.232  25.740 -14.413
  983    HE   ARG  38           HE       ARG  38   9.456  24.092 -13.691
  984   1HH1  ARG  38          2HH1      ARG  38   7.347  26.634 -12.589
  985   2HH1  ARG  38          1HH1      ARG  38   8.500  27.284 -11.471
  986   1HH2  ARG  38          2HH2      ARG  38  10.983  24.939 -12.223
  987   2HH2  ARG  38          1HH2      ARG  38  10.568  26.320 -11.265
  988    H    LYS  39           H        LYS  39   3.314  24.447 -12.495
  989    HA   LYS  39           HA       LYS  39   1.402  24.062 -14.628
  990   1HB   LYS  39          2HB       LYS  39   0.594  22.710 -12.607
  991   2HB   LYS  39          3HB       LYS  39   0.328  24.260 -11.819
  992   1HG   LYS  39          2HG       LYS  39  -0.850  24.104 -14.480
  993   2HG   LYS  39          3HG       LYS  39  -1.490  22.905 -13.352
  994   1HD   LYS  39          2HD       LYS  39  -2.016  24.664 -11.755
  995   2HD   LYS  39          3HD       LYS  39  -1.321  25.875 -12.834
  996   1HE   LYS  39          2HE       LYS  39  -3.099  25.827 -14.256
  997   2HE   LYS  39          3HE       LYS  39  -3.441  24.125 -13.942
  998   1HZ   LYS  39          1HZ       LYS  39  -3.858  25.731 -11.624
  999   2HZ   LYS  39          2HZ       LYS  39  -4.923  24.671 -12.402
 1000   3HZ   LYS  39          3HZ       LYS  39  -4.796  26.276 -12.923
 1001    H    SER  40           H        SER  40   2.338  26.047 -15.308
 1002    HA   SER  40           HA       SER  40   0.944  28.346 -14.359
 1003   1HB   SER  40          2HB       SER  40   2.798  28.110 -12.661
 1004   2HB   SER  40          3HB       SER  40   3.942  28.397 -13.971
 1005    HG   SER  40           HG       SER  40   3.561  30.438 -13.743
 1006    H    GLY  41           H        GLY  41   0.607  29.622 -16.058
 1007   1HA   GLY  41          1HA       GLY  41   2.668  29.823 -18.135
 1008   2HA   GLY  41          2HA       GLY  41   1.065  29.280 -18.610
 1009    H    ASN  42           H        ASN  42   2.186  31.831 -16.391
 1010    HA   ASN  42           HA       ASN  42   1.336  33.936 -18.132
 1011   1HB   ASN  42          2HB       ASN  42  -0.786  32.886 -16.964
 1012   2HB   ASN  42          3HB       ASN  42  -0.243  33.850 -15.593
 1013   1HD2  ASN  42          1HD2      ASN  42  -1.918  35.279 -15.616
 1014   2HD2  ASN  42          2HD2      ASN  42  -2.175  36.425 -16.884
 1015    H    SER  43           H        SER  43   2.625  35.604 -17.736
 1016    HA   SER  43           HA       SER  43   3.403  36.238 -14.998
 1017   1HB   SER  43          2HB       SER  43   5.301  35.406 -17.171
 1018   2HB   SER  43          3HB       SER  43   5.823  36.550 -15.934
 1019    HG   SER  43           HG       SER  43   5.355  33.847 -15.752
 1020    H    ARG  44           H        ARG  44   3.561  38.379 -14.645
 1021    HA   ARG  44           HA       ARG  44   3.983  40.210 -16.867
 1022   1HB   ARG  44          2HB       ARG  44   1.383  39.705 -15.699
 1023   2HB   ARG  44          3HB       ARG  44   1.859  41.382 -15.468
 1024   1HG   ARG  44          2HG       ARG  44   2.452  41.259 -18.008
 1025   2HG   ARG  44          3HG       ARG  44   1.338  39.891 -17.991
 1026   1HD   ARG  44          2HD       ARG  44  -0.141  41.569 -18.433
 1027   2HD   ARG  44          3HD       ARG  44  -0.177  41.611 -16.671
 1028    HE   ARG  44           HE       ARG  44   0.822  43.673 -16.733
 1029   1HH1  ARG  44          2HH1      ARG  44   1.120  42.158 -19.853
 1030   2HH1  ARG  44          1HH1      ARG  44   1.744  43.576 -20.628
 1031   1HH2  ARG  44          2HH2      ARG  44   1.643  45.547 -17.741
 1032   2HH2  ARG  44          1HH2      ARG  44   2.043  45.503 -19.425
 1033    H    GLU  45           H        GLU  45   3.045  40.094 -13.426
 1034    HA   GLU  45           HA       GLU  45   5.218  41.999 -12.871
 1035   1HB   GLU  45          2HB       GLU  45   2.407  42.044 -11.767
 1036   2HB   GLU  45          3HB       GLU  45   3.733  42.972 -11.081
 1037   1HG   GLU  45          2HG       GLU  45   4.004  44.151 -13.208
 1038   2HG   GLU  45          3HG       GLU  45   2.659  43.232 -13.881
 1039    H    ARG  46           H        ARG  46   5.032  39.062 -12.660
 1040    HA   ARG  46           HA       ARG  46   5.167  38.685  -9.753
 1041   1HB   ARG  46          2HB       ARG  46   3.819  37.177 -11.434
 1042   2HB   ARG  46          3HB       ARG  46   5.389  36.433 -11.709
 1043   1HG   ARG  46          2HG       ARG  46   5.533  35.632  -9.535
 1044   2HG   ARG  46          3HG       ARG  46   4.325  36.770  -8.934
 1045   1HD   ARG  46          2HD       ARG  46   3.125  35.185 -10.965
 1046   2HD   ARG  46          3HD       ARG  46   3.958  34.105  -9.849
 1047    HE   ARG  46           HE       ARG  46   2.569  35.835  -8.247
 1048   1HH1  ARG  46          2HH1      ARG  46   1.755  33.638 -10.821
 1049   2HH1  ARG  46          1HH1      ARG  46   0.167  33.305 -10.211
 1050   1HH2  ARG  46          2HH2      ARG  46   0.482  35.404  -7.433
 1051   2HH2  ARG  46          1HH2      ARG  46  -0.555  34.311  -8.284
 1052    H    CYS  47           H        CYS  47   6.932  36.913  -9.080
 1053    HA   CYS  47           HA       CYS  47   9.374  37.606 -10.543
 1054   1HB   CYS  47          2HB       CYS  47   9.267  38.839  -8.404
 1055   2HB   CYS  47          3HB       CYS  47   9.088  37.329  -7.533
 1056    H    GLN  48           H        GLN  48  10.178  35.816 -11.405
 1057    HA   GLN  48           HA       GLN  48   9.414  33.194 -10.371
 1058   1HB   GLN  48          2HB       GLN  48   9.695  34.199 -12.944
 1059   2HB   GLN  48          3HB       GLN  48  11.120  33.192 -12.730
 1060   1HG   GLN  48          2HG       GLN  48   9.663  31.654 -13.552
 1061   2HG   GLN  48          3HG       GLN  48   9.365  31.464 -11.825
 1062   1HE2  GLN  48          1HE2      GLN  48   7.320  31.410 -11.266
 1063   2HE2  GLN  48          2HE2      GLN  48   6.007  32.142 -12.117
 1064    H    LEU  49           H        LEU  49  11.366  34.911  -8.996
 1065    HA   LEU  49           HA       LEU  49  13.665  33.072  -9.086
 1066   1HB   LEU  49          2HB       LEU  49  13.628  35.867  -9.558
 1067   2HB   LEU  49          3HB       LEU  49  14.447  35.595  -8.022
 1068    HG   LEU  49           HG       LEU  49  15.307  33.908 -10.297
 1069   1HD1  LEU  49          1HD1      LEU  49  16.895  36.103 -10.635
 1070   2HD1  LEU  49          2HD1      LEU  49  15.304  36.828 -10.403
 1071   3HD1  LEU  49          3HD1      LEU  49  15.554  35.643 -11.685
 1072   1HD2  LEU  49          1HD2      LEU  49  17.543  34.641  -9.251
 1073   2HD2  LEU  49          2HD2      LEU  49  16.502  33.551  -8.333
 1074   3HD2  LEU  49          3HD2      LEU  49  16.550  35.270  -7.935
 1075    H    CYS  50           H        CYS  50  11.544  35.176  -7.087
 1076    HA   CYS  50           HA       CYS  50  12.450  33.593  -4.800
 1077   1HB   CYS  50          2HB       CYS  50  12.552  35.456  -3.371
 1078   2HB   CYS  50          3HB       CYS  50  13.383  35.973  -4.826
 1079    H    ASN  51           H        ASN  51  10.178  33.788  -6.880
 1080    HA   ASN  51           HA       ASN  51   7.937  33.420  -6.984
 1081   1HB   ASN  51          2HB       ASN  51   8.858  31.981  -4.802
 1082   2HB   ASN  51          3HB       ASN  51   7.486  32.875  -4.152
 1083   1HD2  ASN  51          1HD2      ASN  51   5.511  32.819  -5.612
 1084   2HD2  ASN  51          2HD2      ASN  51   5.112  31.281  -6.292
 1085    H    GLY  52           H        GLY  52   9.087  36.064  -6.028
 1086   1HA   GLY  52          1HA       GLY  52   7.264  37.234  -4.209
 1087   2HA   GLY  52          2HA       GLY  52   8.311  38.106  -5.317
 1088    H    MET  53           H        MET  53   5.648  38.842  -4.625
 1089    HA   MET  53           HA       MET  53   4.344  38.539  -7.250
 1090   1HB   MET  53          2HB       MET  53   2.175  38.898  -5.963
 1091   2HB   MET  53          3HB       MET  53   2.962  37.339  -5.761
 1092   1HG   MET  53          2HG       MET  53   3.162  37.631  -3.575
 1093   2HG   MET  53          3HG       MET  53   3.878  39.227  -3.786
 1094   1HE   MET  53          1HE       MET  53   1.077  39.071  -1.126
 1095   2HE   MET  53          2HE       MET  53   2.802  38.963  -1.477
 1096   3HE   MET  53          3HE       MET  53   2.006  40.537  -1.439
 1097    H    GLY  54           H        GLY  54   5.007  40.432  -8.173
 1098   1HA   GLY  54          1HA       GLY  54   3.712  42.729  -8.109
 1099   2HA   GLY  54          2HA       GLY  54   4.707  42.924  -6.673
 1100    H    HIS  55           H        HIS  55   7.125  42.143  -7.244
 1101    HA   HIS  55           HA       HIS  55   7.981  44.010  -9.293
 1102   1HB   HIS  55          2HB       HIS  55  10.252  43.555  -8.429
 1103   2HB   HIS  55          3HB       HIS  55   9.140  44.043  -7.154
 1104    HD1  HIS  55           HD1      HIS  55   8.176  41.994  -5.666
 1105    HD2  HIS  55           HD2      HIS  55  11.542  41.203  -7.968
 1106    HE1  HIS  55           HE1      HIS  55   9.171  39.897  -4.701
 1107    H    ASN  56           H        ASN  56  10.250  43.034 -10.305
 1108    HA   ASN  56           HA       ASN  56   9.422  40.572 -11.699
 1109   1HB   ASN  56          2HB       ASN  56  11.062  42.861 -12.809
 1110   2HB   ASN  56          3HB       ASN  56  10.592  41.407 -13.684
 1111   1HD2  ASN  56          1HD2      ASN  56   9.663  44.520 -12.640
 1112   2HD2  ASN  56          2HD2      ASN  56   8.083  44.534 -13.339
 1113    H    ALA  57           H        ALA  57  11.062  39.093 -12.301
 1114    HA   ALA  57           HA       ALA  57  13.023  38.616 -10.375
 1115   1HB   ALA  57          1HB       ALA  57  13.438  37.534 -13.107
 1116   2HB   ALA  57          2HB       ALA  57  13.512  36.723 -11.542
 1117   3HB   ALA  57          3HB       ALA  57  11.950  37.102 -12.266
 1118    H    LYS  58           H        LYS  58  13.192  40.316 -13.448
 1119    HA   LYS  58           HA       LYS  58  15.988  40.518 -13.647
 1120   1HB   LYS  58          2HB       LYS  58  13.682  42.051 -14.775
 1121   2HB   LYS  58          3HB       LYS  58  15.306  42.700 -14.957
 1122   1HG   LYS  58          2HG       LYS  58  14.766  39.872 -15.727
 1123   2HG   LYS  58          3HG       LYS  58  14.273  41.182 -16.804
 1124   1HD   LYS  58          2HD       LYS  58  16.455  41.862 -17.183
 1125   2HD   LYS  58          3HD       LYS  58  17.051  41.122 -15.695
 1126   1HE   LYS  58          2HE       LYS  58  17.852  39.629 -17.232
 1127   2HE   LYS  58          3HE       LYS  58  16.282  38.905 -16.891
 1128   1HZ   LYS  58          1HZ       LYS  58  15.700  39.163 -18.997
 1129   2HZ   LYS  58          2HZ       LYS  58  17.261  39.709 -19.349
 1130   3HZ   LYS  58          3HZ       LYS  58  16.045  40.818 -18.959
 1131    H    GLN  59           H        GLN  59  13.720  42.115 -11.612
 1132    HA   GLN  59           HA       GLN  59  15.808  44.011 -10.756
 1133   1HB   GLN  59          2HB       GLN  59  13.466  44.783 -11.717
 1134   2HB   GLN  59          3HB       GLN  59  12.934  44.448 -10.075
 1135   1HG   GLN  59          2HG       GLN  59  13.459  46.739 -10.149
 1136   2HG   GLN  59          3HG       GLN  59  14.782  45.958  -9.286
 1137   1HE2  GLN  59          1HE2      GLN  59  16.736  46.550  -9.866
 1138   2HE2  GLN  59          2HE2      GLN  59  17.192  47.209 -11.397
 1139    H    CYS  60           H        CYS  60  14.968  41.071  -9.904
 1140    HA   CYS  60           HA       CYS  60  14.295  41.614  -7.143
 1141   1HB   CYS  60          2HB       CYS  60  13.159  39.771  -8.349
 1142   2HB   CYS  60          3HB       CYS  60  14.699  38.966  -8.572
 1143    H    ARG  61           H        ARG  61  15.740  41.379  -5.504
 1144    HA   ARG  61           HA       ARG  61  17.751  41.396  -4.437
 1145   1HB   ARG  61          2HB       ARG  61  18.406  39.181  -6.387
 1146   2HB   ARG  61          3HB       ARG  61  19.217  39.496  -4.859
 1147   1HG   ARG  61          2HG       ARG  61  16.561  39.241  -4.146
 1148   2HG   ARG  61          3HG       ARG  61  16.783  38.023  -5.403
 1149   1HD   ARG  61          2HD       ARG  61  17.320  36.923  -3.405
 1150   2HD   ARG  61          3HD       ARG  61  18.876  37.329  -4.126
 1151    HE   ARG  61           HE       ARG  61  18.364  39.428  -2.485
 1152   1HH1  ARG  61          2HH1      ARG  61  18.449  35.976  -2.038
 1153   2HH1  ARG  61          1HH1      ARG  61  18.947  36.072  -0.381
 1154   1HH2  ARG  61          2HH2      ARG  61  19.020  39.567  -0.304
 1155   2HH2  ARG  61          1HH2      ARG  61  19.271  38.115   0.603
 1156    H    LYS  62           H        LYS  62  17.414  43.099  -6.811
 1157    HA   LYS  62           HA       LYS  62  20.263  43.461  -7.466
 1158   1HB   LYS  62          2HB       LYS  62  17.861  43.533  -9.253
 1159   2HB   LYS  62          3HB       LYS  62  19.251  44.542  -9.633
 1160   1HG   LYS  62          2HG       LYS  62  19.690  41.652  -9.079
 1161   2HG   LYS  62          3HG       LYS  62  19.008  42.133 -10.634
 1162   1HD   LYS  62          2HD       LYS  62  21.068  43.891 -10.390
 1163   2HD   LYS  62          3HD       LYS  62  21.728  42.470  -9.575
 1164   1HE   LYS  62          2HE       LYS  62  21.380  41.114 -11.510
 1165   2HE   LYS  62          3HE       LYS  62  20.467  42.392 -12.310
 1166   1HZ   LYS  62          1HZ       LYS  62  23.138  43.144 -11.507
 1167   2HZ   LYS  62          2HZ       LYS  62  22.330  43.416 -12.967
 1168   3HZ   LYS  62          3HZ       LYS  62  23.083  41.929 -12.683
 1169    H    ARG  63           H        ARG  63  20.549  45.001  -5.850
 1170    HA   ARG  63           HA       ARG  63  19.451  47.629  -6.498
 1171   1HB   ARG  63          2HB       ARG  63  18.987  48.079  -4.094
 1172   2HB   ARG  63          3HB       ARG  63  17.936  46.857  -4.795
 1173   1HG   ARG  63          2HG       ARG  63  18.499  45.455  -3.184
 1174   2HG   ARG  63          3HG       ARG  63  20.182  45.523  -3.713
 1175   1HD   ARG  63          2HD       ARG  63  20.088  46.128  -1.395
 1176   2HD   ARG  63          3HD       ARG  63  20.470  47.570  -2.335
 1177    HE   ARG  63           HE       ARG  63  18.490  48.497  -1.653
 1178   1HH1  ARG  63          2HH1      ARG  63  18.437  45.077  -1.003
 1179   2HH1  ARG  63          1HH1      ARG  63  16.961  45.141  -0.099
 1180   1HH2  ARG  63          2HH2      ARG  63  16.546  48.593  -0.465
 1181   2HH2  ARG  63          1HH2      ARG  63  15.885  47.141   0.206
 1182    H    ASP  64           H        ASP  64  20.648  49.392  -5.490
 1183    HA   ASP  64           HA       ASP  64  23.477  48.736  -5.304
 1184   1HB   ASP  64          2HB       ASP  64  21.890  51.142  -5.943
 1185   2HB   ASP  64          3HB       ASP  64  23.383  51.440  -5.059
  Start of MODEL    7
    1   1H5*    C 160          1H5*        C 160  -0.800  26.103  -8.332
    2   2H5*    C 160          2H5*        C 160   0.898  25.788  -8.696
    3    H4*    C 160           H4*        C 160  -0.382  24.218  -9.920
    4    H3*    C 160           H3*        C 160   0.808  26.399 -11.598
    5    H2*    C 160           H2*        C 160  -0.075  25.408 -13.569
    6   2HO*    C 160          2HO*        C 160  -0.404  23.253 -13.446
    7    H1*    C 160           H1*        C 160  -2.635  25.086 -12.419
    8   1H4     C 160          1H4         C 160  -2.902  30.423 -15.954
    9   2H4     C 160          2H4         C 160  -2.431  31.332 -14.535
   10    H5     C 160           H5         C 160  -1.788  30.341 -12.490
   11    H6     C 160           H6         C 160  -1.436  28.211 -11.291
   12   1H5*    U 161          1H5*        U 161   2.170  22.517 -13.268
   13   2H5*    U 161          2H5*        U 161   3.801  22.712 -13.911
   14    H4*    U 161           H4*        U 161   2.228  21.866 -15.588
   15    H3*    U 161           H3*        U 161   3.551  24.523 -16.051
   16    H2*    U 161           H2*        U 161   2.549  24.656 -18.200
   17   2HO*    U 161          2HO*        U 161   1.361  22.105 -17.668
   18    H1*    U 161           H1*        U 161   0.003  23.944 -17.226
   19    H3     U 161           H3         U 161  -0.137  28.330 -18.596
   20    H5     U 161           H5         U 161   1.286  28.431 -14.658
   21    H6     U 161           H6         U 161   1.479  25.989 -14.770
   22   1H5*    G 162          1H5*        G 162   4.528  22.095 -19.627
   23   2H5*    G 162          2H5*        G 162   6.283  22.196 -19.769
   24    H4*    G 162           H4*        G 162   5.401  22.691 -21.903
   25    H3*    G 162           H3*        G 162   6.434  25.099 -20.444
   26    H2*    G 162           H2*        G 162   5.944  26.476 -22.325
   27   2HO*    G 162          2HO*        G 162   4.765  24.837 -24.031
   28    H1*    G 162           H1*        G 162   3.331  25.527 -22.558
   29    H8     G 162           H8         G 162   4.172  25.738 -18.944
   30    H1     G 162           H1         G 162   2.513  31.443 -21.510
   31   1H2     G 162          1H2         G 162   2.434  31.278 -23.564
   32   2H2     G 162          2H2         G 162   2.767  29.812 -24.458
   33   1H5*    C 163          1H5*        C 163   8.011  25.030 -24.252
   34   2H5*    C 163          2H5*        C 163   9.736  25.376 -24.377
   35    H4*    C 163           H4*        C 163   8.613  26.869 -25.834
   36    H3*    C 163           H3*        C 163   9.655  28.165 -23.335
   37    H2*    C 163           H2*        C 163   8.923  30.287 -24.108
   38   2HO*    C 163          2HO*        C 163   8.005  30.252 -26.356
   39    H1*    C 163           H1*        C 163   6.376  29.317 -24.828
   40   1H4     C 163          1H4         C 163   5.549  31.910 -19.049
   41   2H4     C 163          2H4         C 163   6.155  30.440 -18.318
   42    H5     C 163           H5         C 163   7.035  28.626 -19.547
   43    H6     C 163           H6         C 163   7.556  27.765 -21.803
   44   1H5*    C 164          1H5*        C 164  11.517  30.405 -26.572
   45   2H5*    C 164          2H5*        C 164  13.181  30.782 -26.128
   46    H4*    C 164           H4*        C 164  11.944  32.806 -26.618
   47    H3*    C 164           H3*        C 164  12.836  32.420 -23.769
   48    H2*    C 164           H2*        C 164  12.061  34.602 -23.247
   49   2HO*    C 164          2HO*        C 164  11.081  35.168 -25.786
   50    H1*    C 164           H1*        C 164   9.603  34.217 -24.572
   51   1H4     C 164          1H4         C 164   8.316  33.054 -18.426
   52   2H4     C 164          2H4         C 164   8.957  31.437 -18.610
   53    H5     C 164           H5         C 164   9.999  30.650 -20.578
   54    H6     C 164           H6         C 164  10.687  31.227 -22.878
   55   1H5*    C 165          1H5*        C 165  14.094  36.125 -24.990
   56   2H5*    C 165          2H5*        C 165  15.831  36.368 -24.800
   57    H4*    C 165           H4*        C 165  14.909  38.261 -23.830
   58    H3*    C 165           H3*        C 165  15.636  36.250 -21.729
   59    H2*    C 165           H2*        C 165  14.888  37.710 -20.015
   60   2HO*    C 165          2HO*        C 165  14.477  39.897 -20.605
   61    H1*    C 165           H1*        C 165  12.465  38.279 -21.332
   62   1H4     C 165          1H4         C 165  10.914  33.673 -17.200
   63   2H4     C 165          2H4         C 165  11.636  32.482 -18.259
   64    H5     C 165           H5         C 165  12.802  33.016 -20.242
   65    H6     C 165           H6         C 165  13.570  34.846 -21.712
   66   1H5*    U 166          1H5*        U 166  17.117  39.870 -20.446
   67   2H5*    U 166          2H5*        U 166  18.865  39.840 -20.211
   68    H4*    U 166           H4*        U 166  18.088  40.798 -18.253
   69    H3*    U 166           H3*        U 166  18.550  37.860 -17.815
   70    H2*    U 166           H2*        U 166  17.968  38.110 -15.524
   71   2HO*    U 166          2HO*        U 166  18.337  40.098 -14.703
   72    H1*    U 166           H1*        U 166  15.639  39.548 -16.071
   73    H3     U 166           H3         U 166  14.086  35.502 -14.729
   74    H5     U 166           H5         U 166  15.399  34.834 -18.649
   75    H6     U 166           H6         U 166  16.325  37.105 -18.620
   76   1H5*    C 167          1H5*        C 167  21.414  39.907 -14.963
   77   2H5*    C 167          2H5*        C 167  22.615  38.708 -14.481
   78    H4*    C 167           H4*        C 167  21.109  39.550 -12.654
   79    H3*    C 167           H3*        C 167  21.401  36.612 -13.243
   80    H2*    C 167           H2*        C 167  20.088  36.121 -11.322
   81   2HO*    C 167          2HO*        C 167  19.995  37.684  -9.764
   82    H1*    C 167           H1*        C 167  18.109  37.997 -12.005
   83   1H4     C 167          1H4         C 167  15.918  32.423 -14.231
   84   2H4     C 167          2H4         C 167  16.876  32.644 -15.677
   85    H5     C 167           H5         C 167  18.406  34.417 -15.984
   86    H6     C 167           H6         C 167  19.402  36.435 -14.967
   87   1H5*    A 168          1H5*        A 168  21.990  35.381 -11.154
   88   2H5*    A 168          2H5*        A 168  22.948  35.808  -9.737
   89    H4*    A 168           H4*        A 168  24.158  33.490 -10.710
   90    H3*    A 168           H3*        A 168  21.230  33.389 -11.272
   91    H2*    A 168           H2*        A 168  21.028  31.220 -10.327
   92   2HO*    A 168          2HO*        A 168  22.926  30.279 -10.948
   93    H1*    A 168           H1*        A 168  22.373  31.886  -7.982
   94    H8     A 168           H8         A 168  19.559  33.069 -10.222
   95   1H6     A 168          1H6         A 168  16.288  33.922  -4.977
   96   2H6     A 168          2H6         A 168  16.196  33.938  -6.723
   97    H2     A 168           H2         A 168  20.458  32.869  -3.859
   98   1H5*    U 169          1H5*        U 169  19.461  32.783 -13.478
   99   2H5*    U 169          2H5*        U 169  19.986  31.250 -12.781
  100    H4*    U 169           H4*        U 169  18.188  30.662 -14.127
  101    H3*    U 169           H3*        U 169  20.794  30.080 -15.462
  102    H2*    U 169           H2*        U 169  19.701  29.290 -17.423
  103   2HO*    U 169          2HO*        U 169  17.702  28.508 -17.065
  104    H1*    U 169           H1*        U 169  18.060  31.551 -17.618
  105    H3     U 169           H3         U 169  21.222  31.546 -20.991
  106    H5     U 169           H5         U 169  22.943  33.615 -17.783
  107    H6     U 169           H6         U 169  21.059  32.852 -16.410
  108   1H5*    C 170          1H5*        C 170  21.369  25.142 -12.659
  109   2H5*    C 170          2H5*        C 170  20.323  26.167 -11.676
  110    H4*    C 170           H4*        C 170  22.765  27.575 -12.132
  111    H3*    C 170           H3*        C 170  23.165  24.670 -11.538
  112    H2*    C 170           H2*        C 170  24.822  25.171  -9.907
  113   2HO*    C 170          2HO*        C 170  25.835  26.901 -10.847
  114    H1*    C 170           H1*        C 170  23.280  27.001  -8.545
  115   1H4     C 170          1H4         C 170  21.827  21.356  -5.906
  116   2H4     C 170          2H4         C 170  20.523  21.189  -7.060
  117    H5     C 170           H5         C 170  20.146  22.687  -8.845
  118    H6     C 170           H6         C 170  20.933  24.737  -9.974
  119   1H5*    C 171          1H5*        C 171  27.198  26.207 -12.675
  120   2H5*    C 171          2H5*        C 171  28.151  24.866 -13.310
  121    H4*    C 171           H4*        C 171  29.084  25.894 -11.252
  122    H3*    C 171           H3*        C 171  28.351  22.966 -11.241
  123    H2*    C 171           H2*        C 171  29.400  22.766  -9.125
  124   2HO*    C 171          2HO*        C 171  30.994  24.217  -8.697
  125    H1*    C 171           H1*        C 171  28.206  25.195  -8.204
  126   1H4     C 171          1H4         C 171  24.953  20.392  -5.479
  127   2H4     C 171          2H4         C 171  23.875  20.405  -6.857
  128    H5     C 171           H5         C 171  24.222  21.720  -8.787
  129    H6     C 171           H6         C 171  25.704  23.364  -9.882
  130   1H5*    G 172          1H5*        G 172  32.869  23.424 -10.785
  131   2H5*    G 172          2H5*        G 172  33.607  21.995 -11.511
  132    H4*    G 172           H4*        G 172  34.391  22.379  -9.226
  133    H3*    G 172           H3*        G 172  32.890  19.855  -9.842
  134    H2*    G 172           H2*        G 172  33.241  19.083  -7.616
  135   2HO*    G 172          2HO*        G 172  34.603  20.547  -6.265
  136    H1*    G 172           H1*        G 172  32.338  21.465  -6.471
  137    H8     G 172           H8         G 172  30.163  20.929  -9.380
  138    H1     G 172           H1         G 172  28.634  17.057  -4.425
  139   1H2     G 172          1H2         G 172  30.138  17.116  -3.016
  140   2H2     G 172          2H2         G 172  31.595  18.074  -3.155
  141   1H5*    U 173          1H5*        U 173  36.262  18.627  -7.764
  142   2H5*    U 173          2H5*        U 173  37.255  17.597  -8.795
  143    H4*    U 173           H4*        U 173  37.143  16.411  -6.811
  144    H3*    U 173           H3*        U 173  35.098  15.353  -8.740
  145    H2*    U 173           H2*        U 173  34.477  13.677  -7.173
  146   2HO*    U 173          2HO*        U 173  35.871  13.808  -5.107
  147    H1*    U 173           H1*        U 173  34.243  15.467  -5.048
  148    H3     U 173           H3         U 173  29.973  14.290  -6.143
  149    H5     U 173           H5         U 173  30.998  17.253  -8.918
  150    H6     U 173           H6         U 173  33.290  17.130  -8.054
  151   1H5*    C 174          1H5*        C 174  37.132  12.202  -7.432
  152   2H5*    C 174          2H5*        C 174  37.685  11.005  -8.604
  153    H4*    C 174           H4*        C 174  36.335   9.849  -7.056
  154    H3*    C 174           H3*        C 174  34.960  10.324  -9.683
  155    H2*    C 174           H2*        C 174  33.065   9.121  -8.936
  156   2HO*    C 174          2HO*        C 174  33.550   8.263  -6.558
  157    H1*    C 174           H1*        C 174  33.159  10.411  -6.372
  158   1H4     C 174          1H4         C 174  28.228  13.113  -9.402
  159   2H4     C 174          2H4         C 174  29.347  14.116 -10.299
  160    H5     C 174           H5         C 174  31.696  13.902 -10.175
  161    H6     C 174           H6         C 174  33.568  12.661  -9.150
  162   1H5*    U 175          1H5*        U 175  37.234   7.812 -13.180
  163   2H5*    U 175          2H5*        U 175  36.014   9.078 -13.038
  164    H4*    U 175           H4*        U 175  34.238   7.397 -13.304
  165    H3*    U 175           H3*        U 175  36.530   5.441 -13.416
  166    H2*    U 175           H2*        U 175  35.266   4.091 -14.894
  167   2HO*    U 175          2HO*        U 175  33.330   4.485 -13.662
  168    H1*    U 175           H1*        U 175  34.393   6.383 -16.378
  169    H3     U 175           H3         U 175  36.642   3.993 -19.504
  170    H5     U 175           H5         U 175  39.659   5.466 -16.999
  171    H6     U 175           H6         U 175  37.889   6.287 -15.514
  172   1H5*    C 176          1H5*        C 176  33.705   5.444  -9.931
  173   2H5*    C 176          2H5*        C 176  34.394   4.429  -8.663
  174    H4*    C 176           H4*        C 176  32.436   3.050  -8.594
  175    H3*    C 176           H3*        C 176  31.659   4.418 -11.146
  176    H2*    C 176           H2*        C 176  29.358   4.243 -10.574
  177   2HO*    C 176          2HO*        C 176  28.849   2.925  -8.706
  178    H1*    C 176           H1*        C 176  29.731   5.258  -7.997
  179   1H4     C 176          1H4         C 176  28.142  10.283 -11.633
  180   2H4     C 176          2H4         C 176  29.844  10.552 -11.936
  181    H5     C 176           H5         C 176  31.555   9.086 -11.229
  182    H6     C 176           H6         C 176  32.058   6.979 -10.044
  183   1H5*    G 177          1H5*        G 177  29.141   0.818 -11.062
  184   2H5*    G 177          2H5*        G 177  29.434   0.018 -12.605
  185    H4*    G 177           H4*        G 177  27.080   0.197 -12.310
  186    H3*    G 177           H3*        G 177  28.232   2.011 -14.399
  187    H2*    G 177           H2*        G 177  26.054   2.810 -14.947
  188   2HO*    G 177          2HO*        G 177  24.283   1.642 -14.134
  189    H1*    G 177           H1*        G 177  25.400   3.357 -12.290
  190    H8     G 177           H8         G 177  28.973   4.202 -12.654
  191    H1     G 177           H1         G 177  25.077   8.733 -15.138
  192   1H2     G 177          1H2         G 177  23.153   8.001 -15.253
  193   2H2     G 177          2H2         G 177  22.668   6.396 -14.750
  194   1H5*    C 178          1H5*        C 178  25.069   0.070 -16.058
  195   2H5*    C 178          2H5*        C 178  25.309  -0.611 -17.667
  196    H4*    C 178           H4*        C 178  23.421   0.826 -17.766
  197    H3*    C 178           H3*        C 178  25.872   1.914 -19.117
  198    H2*    C 178           H2*        C 178  24.662   3.821 -19.832
  199   2HO*    C 178          2HO*        C 178  22.276   3.012 -18.600
  200    H1*    C 178           H1*        C 178  23.470   4.180 -17.275
  201   1H4     C 178          1H4         C 178  28.197   8.473 -17.530
  202   2H4     C 178          2H4         C 178  29.333   7.222 -17.078
  203    H5     C 178           H5         C 178  28.760   4.942 -16.854
  204    H6     C 178           H6         C 178  26.936   3.283 -17.010
  205   1H5*    U 179          1H5*        U 179  22.805   1.685 -22.494
  206   2H5*    U 179          2H5*        U 179  23.777   1.304 -23.916
  207    H4*    U 179           H4*        U 179  22.460   3.381 -24.148
  208    H3*    U 179           H3*        U 179  25.460   3.486 -24.352
  209    H2*    U 179           H2*        U 179  25.334   5.785 -24.933
  210   2HO*    U 179          2HO*        U 179  22.855   6.464 -24.957
  211    H1*    U 179           H1*        U 179  23.543   6.387 -22.851
  212    H3     U 179           H3         U 179  27.592   8.372 -21.939
  213    H5     U 179           H5         U 179  27.878   4.481 -20.417
  214    H6     U 179           H6         U 179  25.762   3.986 -21.554
  215   1H5*    U 180          1H5*        U 180  23.995   5.213 -27.583
  216   2H5*    U 180          2H5*        U 180  24.675   4.837 -29.167
  217    H4*    U 180           H4*        U 180  24.867   7.179 -28.850
  218    H3*    U 180           H3*        U 180  27.460   5.688 -28.643
  219    H2*    U 180           H2*        U 180  28.645   7.712 -28.301
  220   2HO*    U 180          2HO*        U 180  26.852   9.613 -28.334
  221    H1*    U 180           H1*        U 180  26.746   8.651 -26.406
  222    H3     U 180           H3         U 180  30.429   8.173 -23.829
  223    H5     U 180           H5         U 180  29.312   4.230 -24.691
  224    H6     U 180           H6         U 180  27.621   5.146 -26.212
  225   1H5*    A 181          1H5*        A 181  27.882   6.845 -33.346
  226   2H5*    A 181          2H5*        A 181  29.051   5.585 -33.743
  227    H4*    A 181           H4*        A 181  29.896   7.963 -33.800
  228    H3*    A 181           H3*        A 181  31.263   5.799 -32.216
  229    H2*    A 181           H2*        A 181  33.018   7.312 -31.693
  230   2HO*    A 181          2HO*        A 181  33.292   9.017 -33.071
  231    H1*    A 181           H1*        A 181  31.261   9.373 -30.960
  232    H8     A 181           H8         A 181  30.052   5.999 -29.843
  233   1H6     A 181          1H6         A 181  33.380   6.915 -24.643
  234   2H6     A 181          2H6         A 181  32.205   5.869 -25.408
  235    H2     A 181           H2         A 181  34.368  10.159 -27.515
  236   1H5*    U 182          1H5*        U 182  32.247   2.458 -33.295
  237   2H5*    U 182          2H5*        U 182  33.146   2.398 -34.811
  238    H4*    U 182           H4*        U 182  30.369   1.505 -34.196
  239    H3*    U 182           H3*        U 182  32.738   0.385 -35.676
  240    H2*    U 182           H2*        U 182  31.275  -1.035 -36.903
  241   2HO*    U 182          2HO*        U 182  28.896  -0.693 -36.164
  242    H1*    U 182           H1*        U 182  29.498   1.065 -37.496
  243    H3     U 182           H3         U 182  31.587  -0.283 -41.373
  244    H5     U 182           H5         U 182  34.126   2.567 -39.649
  245    H6     U 182           H6         U 182  32.710   2.473 -37.648
  246   1H5*    U 183          1H5*        U 183  34.244  -1.627 -31.132
  247   2H5*    U 183          2H5*        U 183  34.318  -3.321 -31.618
  248    H4*    U 183           H4*        U 183  31.960  -1.985 -30.267
  249    H3*    U 183           H3*        U 183  34.261  -3.557 -29.153
  250    H2*    U 183           H2*        U 183  32.823  -4.594 -27.574
  251   2HO*    U 183          2HO*        U 183  31.313  -3.153 -26.975
  252    H1*    U 183           H1*        U 183  30.864  -5.180 -29.522
  253    H3     U 183           H3         U 183  32.319  -9.335 -28.542
  254    H5     U 183           H5         U 183  35.572  -7.617 -30.543
  255    H6     U 183           H6         U 183  34.335  -5.500 -30.532
  256   1H5*    C 184          1H5*        C 184  37.407  -1.808 -27.062
  257   2H5*    C 184          2H5*        C 184  36.433  -3.278 -27.123
  258    H4*    C 184           H4*        C 184  35.891  -2.378 -24.599
  259    H3*    C 184           H3*        C 184  38.702  -1.490 -25.265
  260    H2*    C 184           H2*        C 184  39.364  -2.076 -23.108
  261   2HO*    C 184          2HO*        C 184  37.439  -2.420 -21.576
  262    H1*    C 184           H1*        C 184  37.378  -4.249 -23.063
  263   1H4     C 184          1H4         C 184  43.200  -6.872 -22.295
  264   2H4     C 184          2H4         C 184  43.219  -7.127 -24.026
  265    H5     C 184           H5         C 184  41.583  -6.275 -25.500
  266    H6     C 184           H6         C 184  39.504  -4.955 -25.678
  267   1H5*    G 185          1H5*        G 185  39.688   2.258 -22.096
  268   2H5*    G 185          2H5*        G 185  40.766   2.095 -23.482
  269    H4*    G 185           H4*        G 185  40.881   0.749 -20.809
  270    H3*    G 185           H3*        G 185  42.751   2.377 -22.494
  271    H2*    G 185           H2*        G 185  44.627   1.254 -21.547
  272   2HO*    G 185          2HO*        G 185  43.411  -0.582 -19.997
  273    H1*    G 185           H1*        G 185  43.566  -1.283 -22.022
  274    H8     G 185           H8         G 185  43.334   1.778 -24.336
  275    H1     G 185           H1         G 185  47.456  -2.847 -26.207
  276   1H2     G 185          1H2         G 185  47.469  -4.364 -24.810
  277   2H2     G 185          2H2         G 185  46.506  -4.381 -23.350
  278   1H5*    G 186          1H5*        G 186  40.763   6.413 -18.712
  279   2H5*    G 186          2H5*        G 186  41.947   6.702 -19.986
  280    H4*    G 186           H4*        G 186  42.697   5.960 -17.153
  281    H3*    G 186           H3*        G 186  42.131   8.665 -18.324
  282    H2*    G 186           H2*        G 186  43.907   9.600 -17.041
  283   2HO*    G 186          2HO*        G 186  44.564   8.446 -15.270
  284    H1*    G 186           H1*        G 186  45.740   7.654 -17.842
  285    H8     G 186           H8         G 186  44.430   7.883 -21.035
  286    H1     G 186           H1         G 186  46.666  13.723 -19.368
  287   1H2     G 186          1H2         G 186  46.923  13.804 -17.323
  288   2H2     G 186          2H2         G 186  46.585  12.485 -16.225
  289   1H5*    G 187          1H5*        G 187  39.480  11.573 -16.379
  290   2H5*    G 187          2H5*        G 187  38.031  10.768 -16.982
  291    H4*    G 187           H4*        G 187  40.159  12.197 -18.434
  292    H3*    G 187           H3*        G 187  37.202  11.772 -18.732
  293    H2*    G 187           H2*        G 187  37.344  12.360 -21.037
  294   2HO*    G 187          2HO*        G 187  40.058  12.647 -21.220
  295    H1*    G 187           H1*        G 187  39.457  10.607 -21.532
  296    H8     G 187           H8         G 187  37.313   8.851 -19.117
  297    H1     G 187           H1         G 187  34.854   8.774 -25.103
  298   1H2     G 187          1H2         G 187  35.882  10.113 -26.286
  299   2H2     G 187          2H2         G 187  37.212  11.109 -25.739
  300   1H5*    G 188          1H5*        G 188  37.928  15.022 -21.213
  301   2H5*    G 188          2H5*        G 188  37.157  16.381 -20.396
  302    H4*    G 188           H4*        G 188  36.448  16.614 -22.586
  303    H3*    G 188           H3*        G 188  34.329  15.193 -20.994
  304    H2*    G 188           H2*        G 188  32.903  15.201 -22.904
  305   2HO*    G 188          2HO*        G 188  34.907  16.418 -24.484
  306    H1*    G 188           H1*        G 188  34.884  14.180 -24.591
  307    H8     G 188           H8         G 188  35.367  12.443 -21.390
  308    H1     G 188           H1         G 188  30.299  10.144 -24.692
  309   1H2     G 188          1H2         G 188  29.848  11.426 -26.243
  310   2H2     G 188          2H2         G 188  30.714  12.904 -26.596
  311   1H5*    A 189          1H5*        A 189  31.618  18.570 -22.707
  312   2H5*    A 189          2H5*        A 189  30.721  18.819 -21.209
  313    H4*    A 189           H4*        A 189  29.363  18.158 -23.229
  314    H3*    A 189           H3*        A 189  29.209  16.649 -20.627
  315    H2*    A 189           H2*        A 189  27.433  15.345 -21.514
  316   2HO*    A 189          2HO*        A 189  26.281  16.251 -23.162
  317    H1*    A 189           H1*        A 189  28.777  14.859 -23.935
  318    H8     A 189           H8         A 189  31.099  14.716 -21.001
  319   1H6     A 189          1H6         A 189  29.544   8.695 -20.483
  320   2H6     A 189          2H6         A 189  30.634   9.933 -19.900
  321    H2     A 189           H2         A 189  26.854  10.572 -23.481
  322   1H5*    G 190          1H5*        G 190  24.864  18.080 -21.578
  323   2H5*    G 190          2H5*        G 190  24.299  18.439 -19.947
  324    H4*    G 190           H4*        G 190  22.805  16.913 -21.173
  325    H3*    G 190           H3*        G 190  24.101  15.984 -18.625
  326    H2*    G 190           H2*        G 190  22.845  13.962 -18.728
  327   2HO*    G 190          2HO*        G 190  21.025  13.982 -19.989
  328    H1*    G 190           H1*        G 190  23.548  13.460 -21.382
  329    H8     G 190           H8         G 190  26.527  14.942 -19.777
  330    H1     G 190           H1         G 190  25.731   8.695 -18.286
  331   1H2     G 190          1H2         G 190  23.859   8.075 -18.891
  332   2H2     G 190          2H2         G 190  22.682   9.097 -19.684
  333   1H5*    C 191          1H5*        C 191  19.798  15.599 -17.970
  334   2H5*    C 191          2H5*        C 191  19.440  15.812 -16.256
  335    H4*    C 191           H4*        C 191  18.787  13.597 -17.123
  336    H3*    C 191           H3*        C 191  20.813  13.776 -14.905
  337    H2*    C 191           H2*        C 191  20.782  11.407 -14.706
  338   2HO*    C 191          2HO*        C 191  18.894  11.270 -16.832
  339    H1*    C 191           H1*        C 191  21.042  11.024 -17.484
  340   1H4     C 191          1H4         C 191  26.952  10.506 -15.076
  341   2H4     C 191          2H4         C 191  27.152  12.230 -15.296
  342    H5     C 191           H5         C 191  25.418  13.679 -15.987
  343    H6     C 191           H6         C 191  23.043  13.831 -16.642
  344   1H5*    G 192          1H5*        G 192  17.455  11.247 -13.198
  345   2H5*    G 192          2H5*        G 192  17.246  11.925 -11.584
  346    H4*    G 192           H4*        G 192  17.515   9.525 -11.465
  347    H3*    G 192           H3*        G 192  19.703  11.206 -10.279
  348    H2*    G 192           H2*        G 192  20.793   9.240  -9.490
  349   2HO*    G 192          2HO*        G 192  19.608   7.248  -9.669
  350    H1*    G 192           H1*        G 192  20.665   7.966 -11.970
  351    H8     G 192           H8         G 192  21.289  11.503 -12.750
  352    H1     G 192           H1         G 192  26.600   8.476 -10.624
  353   1H2     G 192          1H2         G 192  26.077   6.649  -9.823
  354   2H2     G 192          2H2         G 192  24.443   6.029  -9.741
  355   1H5*    G 193          1H5*        G 193  18.827   8.118  -7.318
  356   2H5*    G 193          2H5*        G 193  18.651   8.997  -5.800
  357    H4*    G 193           H4*        G 193  20.244   7.187  -5.564
  358    H3*    G 193           H3*        G 193  21.296   9.989  -5.319
  359    H2*    G 193           H2*        G 193  23.447   9.135  -4.753
  360   2HO*    G 193          2HO*        G 193  22.504   6.479  -5.096
  361    H1*    G 193           H1*        G 193  23.514   7.384  -6.924
  362    H8     G 193           H8         G 193  21.830  10.469  -8.084
  363    H1     G 193           H1         G 193  28.269  11.064  -7.834
  364   1H2     G 193          1H2         G 193  29.071   9.458  -6.819
  365   2H2     G 193          2H2         G 193  28.138   8.145  -6.137
  366   1H5*    A 194          1H5*        A 194  22.541   7.955  -1.853
  367   2H5*    A 194          2H5*        A 194  22.124   8.852  -0.393
  368    H4*    A 194           H4*        A 194  24.420   8.328  -0.234
  369    H3*    A 194           H3*        A 194  23.883  11.204  -0.883
  370    H2*    A 194           H2*        A 194  26.204  11.686  -0.880
  371   2HO*    A 194          2HO*        A 194  27.357  10.409   0.451
  372    H1*    A 194           H1*        A 194  26.817   9.411  -2.457
  373    H8     A 194           H8         A 194  23.796  11.250  -3.678
  374   1H6     A 194          1H6         A 194  27.701  14.768  -7.043
  375   2H6     A 194          2H6         A 194  26.016  14.391  -6.763
  376    H2     A 194           H2         A 194  30.118  12.242  -4.300
  377   1H5*    C 195          1H5*        C 195  26.321  11.737   2.802
  378   2H5*    C 195          2H5*        C 195  25.688  13.220   3.515
  379    H4*    C 195           H4*        C 195  28.080  13.312   2.767
  380    H3*    C 195           H3*        C 195  26.060  15.297   1.718
  381    H2*    C 195           H2*        C 195  27.838  16.502   0.723
  382   2HO*    C 195          2HO*        C 195  29.801  14.737   1.693
  383    H1*    C 195           H1*        C 195  29.086  14.106  -0.206
  384   1H4     C 195          1H4         C 195  26.277  16.659  -5.350
  385   2H4     C 195          2H4         C 195  24.762  15.937  -4.855
  386    H5     C 195           H5         C 195  24.457  14.789  -2.812
  387    H6     C 195           H6         C 195  25.541  14.045  -0.723
  388   1H5*    G 196          1H5*        G 196  28.868  18.035   4.582
  389   2H5*    G 196          2H5*        G 196  27.642  19.251   4.942
  390    H4*    G 196           H4*        G 196  29.777  20.140   3.989
  391    H3*    G 196           H3*        G 196  27.120  20.714   2.706
  392    H2*    G 196           H2*        G 196  28.193  22.171   1.155
  393   2HO*    G 196          2HO*        G 196  30.684  21.519   2.395
  394    H1*    G 196           H1*        G 196  30.148  20.291   0.487
  395    H8     G 196           H8         G 196  27.067  18.340   0.930
  396    H1     G 196           H1         G 196  27.148  21.564  -4.680
  397   1H2     G 196          1H2         G 196  28.683  22.940  -4.661
  398   2H2     G 196          2H2         G 196  29.785  23.184  -3.326
  399   1H5*    A 197          1H5*        A 197  29.619  24.145   5.606
  400   2H5*    A 197          2H5*        A 197  27.981  24.578   6.093
  401    H4*    A 197           H4*        A 197  29.757  26.369   6.324
  402    H3*    A 197           H3*        A 197  27.111  26.775   4.991
  403    H2*    A 197           H2*        A 197  27.633  29.030   4.481
  404   2HO*    A 197          2HO*        A 197  29.095  29.987   5.805
  405    H1*    A 197           H1*        A 197  30.094  28.497   3.371
  406    H8     A 197           H8         A 197  27.150  29.288   2.457
  407   1H6     A 197          1H6         A 197  26.545  25.054  -2.088
  408   2H6     A 197          2H6         A 197  25.916  26.562  -1.463
  409    H2     A 197           H2         A 197  29.835  23.750   0.598
  410   1H5*    U 198          1H5*        U 198  24.554  27.783   9.266
  411   2H5*    U 198          2H5*        U 198  24.168  26.071   9.094
  412    H4*    U 198           H4*        U 198  23.164  28.066   7.083
  413    H3*    U 198           H3*        U 198  22.061  27.621   9.850
  414    H2*    U 198           H2*        U 198  19.872  27.822   9.009
  415   2HO*    U 198          2HO*        U 198  19.685  28.705   6.811
  416    H1*    U 198           H1*        U 198  20.600  26.343   6.621
  417    H3     U 198           H3         U 198  18.166  22.749   7.695
  418    H5     U 198           H5         U 198  19.002  24.420  11.442
  419    H6     U 198           H6         U 198  20.360  26.099  10.281
  420   1H5*    G 199          1H5*        G 199  20.534  31.348  10.660
  421   2H5*    G 199          2H5*        G 199  20.904  31.649   8.962
  422    H4*    G 199           H4*        G 199  21.943  33.827  10.484
  423    H3*    G 199           H3*        G 199  19.201  32.962  11.359
  424    H2*    G 199           H2*        G 199  18.527  35.243  11.481
  425   2HO*    G 199          2HO*        G 199  20.308  36.311  12.174
  426    H1*    G 199           H1*        G 199  19.504  35.846   8.934
  427    H8     G 199           H8         G 199  18.082  32.414   8.851
  428    H1     G 199           H1         G 199  13.580  37.042   8.418
  429   1H2     G 199          1H2         G 199  14.428  38.871   8.846
  430   2H2     G 199          2H2         G 199  16.110  39.116   9.261
  431   1H5*    A 200          1H5*        A 200  20.269  30.449  12.425
  432   2H5*    A 200          2H5*        A 200  18.766  31.369  12.487
  433    H4*    A 200           H4*        A 200  18.989  29.868  14.908
  434    H3*    A 200           H3*        A 200  19.900  28.356  12.518
  435    H2*    A 200           H2*        A 200  18.436  26.539  12.926
  436   2HO*    A 200          2HO*        A 200  17.268  27.713  15.185
  437    H1*    A 200           H1*        A 200  16.163  28.020  13.191
  438    H8     A 200           H8         A 200  18.341  30.005  10.927
  439   1H6     A 200          1H6         A 200  16.245  26.450   6.245
  440   2H6     A 200          2H6         A 200  17.162  27.889   6.632
  441    H2     A 200           H2         A 200  14.896  24.643  10.074
  442   1H5*    C 201          1H5*        C 201  21.805  24.287  15.998
  443   2H5*    C 201          2H5*        C 201  21.455  24.423  14.276
  444    H4*    C 201           H4*        C 201  19.731  26.022  16.080
  445    H3*    C 201           H3*        C 201  19.734  23.003  16.156
  446    H2*    C 201           H2*        C 201  17.391  23.062  16.464
  447   2HO*    C 201          2HO*        C 201  16.463  25.133  17.037
  448    H1*    C 201           H1*        C 201  17.082  25.131  14.508
  449   1H4     C 201          1H4         C 201  15.085  19.823  11.577
  450   2H4     C 201          2H4         C 201  16.749  19.344  11.329
  451    H5     C 201           H5         C 201  18.601  20.522  12.200
  452    H6     C 201           H6         C 201  19.319  22.470  13.537
  453   1H5*    C 202          1H5*        C 202  17.997  24.554  19.950
  454   2H5*    C 202          2H5*        C 202  18.020  23.325  21.215
  455    H4*    C 202           H4*        C 202  15.749  24.148  20.557
  456    H3*    C 202           H3*        C 202  16.437  21.218  20.456
  457    H2*    C 202           H2*        C 202  14.170  20.726  19.952
  458   2HO*    C 202          2HO*        C 202  12.684  22.616  20.068
  459    H1*    C 202           H1*        C 202  14.006  22.755  17.996
  460   1H4     C 202          1H4         C 202  15.121  17.257  14.886
  461   2H4     C 202          2H4         C 202  16.827  17.643  14.932
  462    H5     C 202           H5         C 202  17.731  19.474  16.119
  463    H6     C 202           H6         C 202  17.216  21.405  17.569
  464   1H5*    C 203          1H5*        C 203  13.158  22.064  22.713
  465   2H5*    C 203          2H5*        C 203  12.953  21.297  24.288
  466    H4*    C 203           H4*        C 203  10.930  20.986  23.105
  467    H3*    C 203           H3*        C 203  12.602  18.493  23.269
  468    H2*    C 203           H2*        C 203  10.861  17.262  22.210
  469   2HO*    C 203          2HO*        C 203   8.854  18.097  22.446
  470    H1*    C 203           H1*        C 203  10.568  19.127  20.146
  471   1H4     C 203          1H4         C 203  14.625  14.731  17.879
  472   2H4     C 203          2H4         C 203  15.950  15.636  18.578
  473    H5     C 203           H5         C 203  15.666  17.530  19.959
  474    H6     C 203           H6         C 203  14.025  19.037  21.022
  475   1H5*    U 204          1H5*        U 204   8.798  18.044  24.638
  476   2H5*    U 204          2H5*        U 204   8.385  16.930  25.942
  477    H4*    U 204           H4*        U 204   7.162  16.396  23.912
  478    H3*    U 204           H3*        U 204   9.160  14.378  24.900
  479    H2*    U 204           H2*        U 204   8.460  12.863  23.202
  480   2HO*    U 204          2HO*        U 204   6.650  13.984  21.797
  481    H1*    U 204           H1*        U 204   8.665  14.772  21.172
  482    H3     U 204           H3         U 204  12.060  11.651  20.820
  483    H5     U 204           H5         U 204  13.556  14.740  23.218
  484    H6     U 204           H6         U 204  11.278  15.643  23.305
  485   1H5*    A 205          1H5*        A 205   5.312  12.569  27.110
  486   2H5*    A 205          2H5*        A 205   6.121  11.449  28.207
  487    H4*    A 205           H4*        A 205   4.932  10.511  26.128
  488    H3*    A 205           H3*        A 205   7.690   9.722  27.039
  489    H2*    A 205           H2*        A 205   7.778   8.089  25.318
  490   2HO*    A 205          2HO*        A 205   5.436   8.450  24.067
  491    H1*    A 205           H1*        A 205   6.886   9.851  23.336
  492    H8     A 205           H8         A 205   9.105  11.837  25.497
  493   1H6     A 205          1H6         A 205  13.951   9.399  22.409
  494   2H6     A 205          2H6         A 205  13.475  10.636  23.552
  495    H2     A 205           H2         A 205  10.301   7.130  21.283
  496   1H5*    G 206          1H5*        G 206   9.322   6.841  28.317
  497   2H5*    G 206          2H5*        G 206   9.093   7.416  26.665
  498    H4*    G 206           H4*        G 206   9.704   4.733  27.665
  499    H3*    G 206           H3*        G 206  10.143   6.276  25.121
  500    H2*    G 206           H2*        G 206  10.629   4.238  23.987
  501   2HO*    G 206          2HO*        G 206  10.941   2.367  25.288
  502    H1*    G 206           H1*        G 206   8.339   2.962  24.974
  503    H8     G 206           H8         G 206   7.277   6.402  24.268
  504    H1     G 206           H1         G 206   7.900   2.879  18.876
  505   1H2     G 206          1H2         G 206   8.894   1.125  19.310
  506   2H2     G 206          2H2         G 206   9.473   0.676  20.898
  507   1H5*    U 207          1H5*        U 207  13.934   5.867  23.293
  508   2H5*    U 207          2H5*        U 207  14.941   4.505  23.786
  509    H4*    U 207           H4*        U 207  15.990   6.841  23.203
  510    H3*    U 207           H3*        U 207  16.843   4.926  25.358
  511    H2*    U 207           H2*        U 207  18.627   6.376  25.944
  512   2HO*    U 207          2HO*        U 207  17.778   8.113  23.835
  513    H1*    U 207           H1*        U 207  17.040   8.662  26.017
  514    H3     U 207           H3         U 207  17.509   8.071  30.444
  515    H5     U 207           H5         U 207  15.237   4.745  29.295
  516    H6     U 207           H6         U 207  15.512   5.483  26.973
  517   1H5*    A 208          1H5*        A 208  21.454   3.446  23.094
  518   2H5*    A 208          2H5*        A 208  21.593   4.399  21.617
  519    H4*    A 208           H4*        A 208  22.025   2.127  21.064
  520    H3*    A 208           H3*        A 208  19.437   3.227  20.057
  521    H2*    A 208           H2*        A 208  18.867   1.153  19.040
  522   2HO*    A 208          2HO*        A 208  20.538  -0.484  19.014
  523    H1*    A 208           H1*        A 208  19.426  -0.323  21.359
  524    H8     A 208           H8         A 208  17.722   3.088  21.577
  525   1H6     A 208          1H6         A 208  12.391  -0.129  22.006
  526   2H6     A 208          2H6         A 208  13.087   1.475  22.058
  527    H2     A 208           H2         A 208  15.700  -3.009  21.298
  528   1H5*    G 209          1H5*        G 209  20.552   2.618  16.689
  529   2H5*    G 209          2H5*        G 209  19.993   3.742  15.451
  530    H4*    G 209           H4*        G 209  18.365   1.949  16.119
  531    H3*    G 209           H3*        G 209  17.651   4.867  16.172
  532    H2*    G 209           H2*        G 209  15.409   4.306  16.747
  533   2HO*    G 209          2HO*        G 209  14.882   2.005  16.707
  534    H1*    G 209           H1*        G 209  16.179   2.616  18.827
  535    H8     G 209           H8         G 209  18.592   5.388  18.916
  536    H1     G 209           H1         G 209  12.843   7.048  21.381
  537   1H2     G 209          1H2         G 209  11.450   5.599  20.916
  538   2H2     G 209          2H2         G 209  11.790   4.152  19.995
  539   1H5*    A 210          1H5*        A 210  14.078   2.993  14.846
  540   2H5*    A 210          2H5*        A 210  13.876   3.669  13.229
  541    H4*    A 210           H4*        A 210  11.816   3.953  14.353
  542    H3*    A 210           H3*        A 210  13.380   6.517  14.127
  543    H2*    A 210           H2*        A 210  11.530   7.696  15.038
  544   2HO*    A 210          2HO*        A 210   9.658   6.010  15.516
  545    H1*    A 210           H1*        A 210  11.177   5.850  17.130
  546    H8     A 210           H8         A 210  14.801   6.507  16.470
  547   1H6     A 210          1H6         A 210  14.309  11.328  20.403
  548   2H6     A 210          2H6         A 210  15.439  10.353  19.488
  549    H2     A 210           H2         A 210  10.228   9.757  19.612
  550   1H5*    G 211          1H5*        G 211   9.457   6.717  12.549
  551   2H5*    G 211          2H5*        G 211   9.214   7.807  11.184
  552    H4*    G 211           H4*        G 211   7.679   8.308  13.004
  553    H3*    G 211           H3*        G 211   9.722  10.393  12.285
  554    H2*    G 211           H2*        G 211   8.714  11.901  13.830
  555   2HO*    G 211          2HO*        G 211   6.766  10.723  14.977
  556    H1*    G 211           H1*        G 211   8.698  10.024  15.903
  557    H8     G 211           H8         G 211  11.858   9.445  14.126
  558    H1     G 211           H1         G 211  12.073  14.731  17.854
  559   1H2     G 211          1H2         G 211  10.166  15.217  18.470
  560   2H2     G 211          2H2         G 211   8.724  14.325  18.041
  561   1H5*    G 212          1H5*        G 212   5.783  12.102  12.480
  562   2H5*    G 212          2H5*        G 212   5.532  13.207  11.128
  563    H4*    G 212           H4*        G 212   4.974  14.281  13.224
  564    H3*    G 212           H3*        G 212   7.353  15.357  11.734
  565    H2*    G 212           H2*        G 212   7.537  17.123  13.323
  566   2HO*    G 212          2HO*        G 212   5.525  16.292  15.009
  567    H1*    G 212           H1*        G 212   7.409  15.386  15.510
  568    H8     G 212           H8         G 212   9.388  13.592  12.993
  569    H1     G 212           H1         G 212  12.783  18.270  15.904
  570   1H2     G 212          1H2         G 212  11.505  19.484  16.975
  571   2H2     G 212          2H2         G 212   9.772  19.267  17.069
  572   1H5*    G 213          1H5*        G 213   4.597  18.196  12.727
  573   2H5*    G 213          2H5*        G 213   4.054  19.324  11.485
  574    H4*    G 213           H4*        G 213   4.580  20.607  13.399
  575    H3*    G 213           H3*        G 213   6.570  20.842  11.176
  576    H2*    G 213           H2*        G 213   7.869  22.391  12.436
  577   2HO*    G 213          2HO*        G 213   6.930  23.114  14.466
  578    H1*    G 213           H1*        G 213   7.936  20.755  14.698
  579    H8     G 213           H8         G 213   8.166  18.446  11.848
  580    H1     G 213           H1         G 213  13.745  21.526  12.975
  581   1H2     G 213          1H2         G 213  13.419  23.081  14.290
  582   2H2     G 213          2H2         G 213  11.867  23.490  14.984
  583   1H5*    G 214          1H5*        G 214   5.390  24.945   9.731
  584   2H5*    G 214          2H5*        G 214   4.905  24.349   8.144
  585    H4*    G 214           H4*        G 214   6.886  25.835   8.097
  586    H3*    G 214           H3*        G 214   7.051  23.033   7.035
  587    H2*    G 214           H2*        G 214   9.289  23.424   6.318
  588   2HO*    G 214          2HO*        G 214  10.032  25.598   6.351
  589    H1*    G 214           H1*        G 214  10.082  24.456   8.789
  590    H8     G 214           H8         G 214   7.772  21.736   9.634
  591    H1     G 214           H1         G 214  13.547  19.529   7.725
  592   1H2     G 214          1H2         G 214  14.625  21.066   6.871
  593   2H2     G 214          2H2         G 214  14.049  22.709   6.699
  594   1H5*    G 215          1H5*        G 215   8.642  25.060   3.050
  595   2H5*    G 215          2H5*        G 215   7.092  24.718   2.282
  596    H4*    G 215           H4*        G 215   8.786  23.952   0.815
  597    H3*    G 215           H3*        G 215   7.298  21.766   2.224
  598    H2*    G 215           H2*        G 215   8.547  20.114   1.047
  599   2HO*    G 215          2HO*        G 215   9.559  20.764  -0.815
  600    H1*    G 215           H1*        G 215  11.005  21.305   1.663
  601    H8     G 215           H8         G 215   8.585  21.517   4.522
  602    H1     G 215           H1         G 215  11.870  15.947   4.278
  603   1H2     G 215          1H2         G 215  12.910  15.838   2.500
  604   2H2     G 215          2H2         G 215  12.894  17.072   1.261
  605   1H5*    C 216          1H5*        C 216   4.976  21.714  -1.885
  606   2H5*    C 216          2H5*        C 216   3.557  20.748  -1.482
  607    H4*    C 216           H4*        C 216   5.431  19.609  -2.777
  608    H3*    C 216           H3*        C 216   4.189  18.450  -0.289
  609    H2*    C 216           H2*        C 216   5.461  16.470  -0.606
  610   2HO*    C 216          2HO*        C 216   6.758  16.477  -2.679
  611    H1*    C 216           H1*        C 216   7.849  17.875  -1.072
  612   1H4     C 216          1H4         C 216   8.023  16.344   5.129
  613   2H4     C 216          2H4         C 216   7.075  17.769   5.487
  614    H5     C 216           H5         C 216   6.154  19.186   3.838
  615    H6     C 216           H6         C 216   5.913  19.586   1.413
  616   1H5*    U 217          1H5*        U 217   2.340  15.101  -2.985
  617   2H5*    U 217          2H5*        U 217   1.362  14.413  -1.688
  618    H4*    U 217           H4*        U 217   3.716  13.386  -2.632
  619    H3*    U 217           H3*        U 217   2.217  12.965  -0.059
  620    H2*    U 217           H2*        U 217   3.934  11.515   0.701
  621   2HO*    U 217          2HO*        U 217   5.488  10.817  -0.875
  622    H1*    U 217           H1*        U 217   6.005  13.245   0.024
  623    H3     U 217           H3         U 217   5.407  13.133   4.610
  624    H5     U 217           H5         U 217   3.025  16.274   3.195
  625    H6     U 217           H6         U 217   3.471  15.460   0.925
  626   1H5*    G 218          1H5*        G 218  -0.320   8.562  -0.964
  627   2H5*    G 218          2H5*        G 218   0.814   9.639  -0.148
  628    H4*    G 218           H4*        G 218   1.484   7.259  -1.227
  629    H3*    G 218           H3*        G 218   3.190   9.726  -0.840
  630    H2*    G 218           H2*        G 218   5.026   8.513  -1.650
  631   2HO*    G 218          2HO*        G 218   4.936   6.232  -1.479
  632    H1*    G 218           H1*        G 218   3.372   7.083  -3.553
  633    H8     G 218           H8         G 218   3.271  10.842  -3.615
  634    H1     G 218           H1         G 218   7.867   8.261  -7.371
  635   1H2     G 218          1H2         G 218   8.001   6.236  -7.003
  636   2H2     G 218          2H2         G 218   7.014   5.367  -5.848
  637   1H5*    C 219          1H5*        C 219   4.540   7.164   1.960
  638   2H5*    C 219          2H5*        C 219   4.315   5.626   2.791
  639    H4*    C 219           H4*        C 219   4.961   6.765   4.605
  640    H3*    C 219           H3*        C 219   2.064   7.438   4.359
  641    H2*    C 219           H2*        C 219   2.192   9.076   6.053
  642   2HO*    C 219          2HO*        C 219   3.629   8.552   7.592
  643    H1*    C 219           H1*        C 219   4.542  10.250   5.078
  644   1H4     C 219          1H4         C 219  -0.536  13.497   2.782
  645   2H4     C 219          2H4         C 219  -0.128  12.809   1.226
  646    H5     C 219           H5         C 219   1.515  11.141   0.915
  647    H6     C 219           H6         C 219   3.188   9.709   2.031
  648   1H5*    G 220          1H5*        G 220   5.075   3.566   6.282
  649   2H5*    G 220          2H5*        G 220   5.252   5.308   6.080
  650    H4*    G 220           H4*        G 220   6.854   3.183   5.020
  651    H3*    G 220           H3*        G 220   7.051   6.201   5.003
  652    H2*    G 220           H2*        G 220   8.920   6.009   3.599
  653   2HO*    G 220          2HO*        G 220   9.565   3.517   3.440
  654    H1*    G 220           H1*        G 220   7.739   3.710   2.252
  655    H8     G 220           H8         G 220   7.508   4.462  -0.136
  656    H1     G 220           H1         G 220   6.822  10.675   1.540
  657   1H2     G 220          1H2         G 220   6.779  10.833   3.596
  658   2H2     G 220          2H2         G 220   6.910   9.483   4.701
  659   1H5*    G 221          1H5*        G 221  10.426   5.319   6.297
  660   2H5*    G 221          2H5*        G 221  11.436   6.558   7.042
  661    H4*    G 221           H4*        G 221  11.134   6.214   4.373
  662    H3*    G 221           H3*        G 221  11.894   8.649   5.974
  663    H2*    G 221           H2*        G 221  12.093   9.889   3.959
  664   2HO*    G 221          2HO*        G 221  11.437   8.159   2.066
  665    H1*    G 221           H1*        G 221   9.647   8.999   2.940
  666    H8     G 221           H8         G 221   9.340   9.526   6.616
  667    H1     G 221           H1         G 221   8.763  14.983   3.184
  668   1H2     G 221          1H2         G 221   9.301  14.625   1.226
  669   2H2     G 221          2H2         G 221   9.831  13.077   0.606
  670   1H5*    C 222          1H5*        C 222  15.930   7.727   4.201
  671   2H5*    C 222          2H5*        C 222  17.042   8.834   5.006
  672    H4*    C 222           H4*        C 222  15.950   9.463   2.715
  673    H3*    C 222           H3*        C 222  16.360  11.323   5.059
  674    H2*    C 222           H2*        C 222  15.624  13.115   3.703
  675   2HO*    C 222          2HO*        C 222  15.412  11.304   1.505
  676    H1*    C 222           H1*        C 222  13.480  11.597   2.612
  677   1H4     C 222          1H4         C 222  10.955  15.428   7.090
  678   2H4     C 222          2H4         C 222  11.175  14.135   8.246
  679    H5     C 222           H5         C 222  12.316  12.124   7.769
  680    H6     C 222           H6         C 222  13.539  10.845   6.045
  681   1H5*    U 223          1H5*        U 223  17.095  13.940   2.215
  682   2H5*    U 223          2H5*        U 223  18.722  14.548   2.523
  683    H4*    U 223           H4*        U 223  17.185  16.386   2.520
  684    H3*    U 223           H3*        U 223  18.342  15.684   5.203
  685    H2*    U 223           H2*        U 223  17.189  17.456   6.206
  686   2HO*    U 223          2HO*        U 223  17.852  18.854   4.459
  687    H1*    U 223           H1*        U 223  14.899  17.053   4.444
  688    H3     U 223           H3         U 223  13.128  17.165   8.653
  689    H5     U 223           H5         U 223  14.958  13.410   8.365
  690    H6     U 223           H6         U 223  15.920  14.152   6.235
  691   1H5*    U 224          1H5*        U 224  21.572  17.149   0.773
  692   2H5*    U 224          2H5*        U 224  20.407  18.164   1.623
  693    H4*    U 224           H4*        U 224  20.033  16.408  -0.760
  694    H3*    U 224           H3*        U 224  19.375  19.231  -0.009
  695    H2*    U 224           H2*        U 224  17.481  19.226  -1.449
  696   2HO*    U 224          2HO*        U 224  17.822  17.935  -3.158
  697    H1*    U 224           H1*        U 224  16.564  16.751  -0.433
  698    H3     U 224           H3         U 224  13.314  19.023   1.609
  699    H5     U 224           H5         U 224  16.739  21.099   2.832
  700    H6     U 224           H6         U 224  18.047  19.563   1.437
  701   1H5*    A 225          1H5*        A 225  20.852  20.450  -4.383
  702   2H5*    A 225          2H5*        A 225  20.318  22.125  -4.257
  703    H4*    A 225           H4*        A 225  18.898  20.153  -5.437
  704    H3*    A 225           H3*        A 225  17.993  22.717  -4.145
  705    H2*    A 225           H2*        A 225  15.745  22.175  -4.675
  706   2HO*    A 225          2HO*        A 225  15.557  20.104  -6.000
  707    H1*    A 225           H1*        A 225  15.930  19.558  -3.725
  708    H8     A 225           H8         A 225  17.940  21.799  -1.528
  709   1H6     A 225          1H6         A 225  12.661  22.987   1.584
  710   2H6     A 225          2H6         A 225  14.399  23.201   1.604
  711    H2     A 225           H2         A 225  11.625  20.733  -2.102
  712   1H5*    G 226          1H5*        G 226  16.229  22.212  -8.185
  713   2H5*    G 226          2H5*        G 226  15.616  23.755  -8.781
  714    H4*    G 226           H4*        G 226  13.907  21.938  -8.459
  715    H3*    G 226           H3*        G 226  13.612  24.658  -7.206
  716    H2*    G 226           H2*        G 226  11.439  24.050  -6.443
  717   2HO*    G 226          2HO*        G 226  10.447  22.446  -7.564
  718    H1*    G 226           H1*        G 226  12.325  21.623  -5.362
  719    H8     G 226           H8         G 226  15.001  24.028  -4.636
  720    H1     G 226           H1         G 226   9.892  24.797  -0.739
  721   1H2     G 226          1H2         G 226   8.296  23.717  -1.474
  722   2H2     G 226          2H2         G 226   8.335  22.749  -2.930
  723   1H5*    G 227          1H5*        G 227  12.360  25.971  -6.204
  724   2H5*    G 227          2H5*        G 227  10.771  26.300  -6.894
  725    H4*    G 227           H4*        G 227  11.725  28.106  -5.432
  726    H3*    G 227           H3*        G 227  10.777  28.635  -8.232
  727    H2*    G 227           H2*        G 227  11.194  30.962  -7.938
  728   2HO*    G 227          2HO*        G 227  12.264  30.605  -5.366
  729    H1*    G 227           H1*        G 227  13.781  30.565  -6.988
  730    H8     G 227           H8         G 227  12.499  28.223  -9.703
  731    H1     G 227           H1         G 227  15.770  33.374 -11.858
  732   1H2     G 227          1H2         G 227  16.202  34.625 -10.278
  733   2H2     G 227          2H2         G 227  15.746  34.325  -8.616
  734   1H5*    A 228          1H5*        A 228   9.156  31.840  -5.560
  735   2H5*    A 228          2H5*        A 228   7.647  32.331  -6.327
  736    H4*    A 228           H4*        A 228   9.351  34.140  -6.096
  737    H3*    A 228           H3*        A 228   8.250  33.416  -8.809
  738    H2*    A 228           H2*        A 228   9.376  35.292  -9.722
  739   2HO*    A 228          2HO*        A 228  10.089  36.893  -8.271
  740    H1*    A 228           H1*        A 228  11.767  34.715  -8.309
  741    H8     A 228           H8         A 228  10.431  31.567  -9.706
  742   1H6     A 228          1H6         A 228  13.214  33.050 -15.091
  743   2H6     A 228          2H6         A 228  12.396  31.770 -14.224
  744    H2     A 228           H2         A 228  13.362  36.602 -12.426
  745   1H5*    G 229          1H5*        G 229   6.847  37.781  -7.905
  746   2H5*    G 229          2H5*        G 229   5.321  37.880  -8.783
  747    H4*    G 229           H4*        G 229   6.904  39.678  -9.368
  748    H3*    G 229           H3*        G 229   5.941  37.785 -11.492
  749    H2*    G 229           H2*        G 229   7.093  39.054 -13.148
  750   2HO*    G 229          2HO*        G 229   8.199  41.033 -12.248
  751    H1*    G 229           H1*        G 229   9.488  39.067 -11.715
  752    H8     G 229           H8         G 229   8.008  35.748 -11.124
  753    H1     G 229           H1         G 229  10.731  36.237 -16.975
  754   1H2     G 229          1H2         G 229  11.157  38.215 -17.373
  755   2H2     G 229          2H2         G 229  10.826  39.544 -16.284
  756   1H5*    G 230          1H5*        G 230   5.274  41.877 -13.077
  757   2H5*    G 230          2H5*        G 230   3.599  41.849 -13.628
  758    H4*    G 230           H4*        G 230   4.972  42.720 -15.381
  759    H3*    G 230           H3*        G 230   3.828  39.989 -15.871
  760    H2*    G 230           H2*        G 230   4.768  39.972 -18.060
  761   2HO*    G 230          2HO*        G 230   5.323  41.937 -18.924
  762    H1*    G 230           H1*        G 230   7.306  40.705 -17.164
  763    H8     G 230           H8         G 230   5.860  38.449 -14.609
  764    H1     G 230           H1         G 230   8.183  35.274 -19.749
  765   1H2     G 230          1H2         G 230   8.601  36.616 -21.257
  766   2H2     G 230          2H2         G 230   8.357  38.345 -21.146
  767   1H5*    G 231          1H5*        G 231   3.174  42.370 -19.469
  768   2H5*    G 231          2H5*        G 231   1.452  42.227 -19.818
  769    H4*    G 231           H4*        G 231   2.640  41.787 -21.828
  770    H3*    G 231           H3*        G 231   1.400  39.358 -20.568
  771    H2*    G 231           H2*        G 231   2.094  38.037 -22.425
  772   2HO*    G 231          2HO*        G 231   3.396  40.264 -23.595
  773    H1*    G 231           H1*        G 231   4.725  38.961 -22.320
  774    H8     G 231           H8         G 231   3.472  38.645 -18.836
  775    H1     G 231           H1         G 231   5.353  33.001 -21.385
  776   1H2     G 231          1H2         G 231   5.668  33.230 -23.410
  777   2H2     G 231          2H2         G 231   5.454  34.729 -24.287
  778   1H5*    C 232          1H5*        C 232   0.089  39.519 -24.572
  779   2H5*    C 232          2H5*        C 232  -1.611  39.090 -24.758
  780    H4*    C 232           H4*        C 232  -0.270  37.666 -26.152
  781    H3*    C 232           H3*        C 232  -1.595  36.341 -23.806
  782    H2*    C 232           H2*        C 232  -0.780  34.227 -24.522
  783   2HO*    C 232          2HO*        C 232   0.666  35.117 -26.691
  784    H1*    C 232           H1*        C 232   1.834  35.221 -24.931
  785   1H4     C 232          1H4         C 232   2.036  32.452 -19.180
  786   2H4     C 232          2H4         C 232   1.330  33.891 -18.476
  787    H5     C 232           H5         C 232   0.571  35.735 -19.739
  788    H6     C 232           H6         C 232   0.298  36.664 -22.011
  789   1H5*    A 233          1H5*        A 233  -3.624  33.749 -27.438
  790   2H5*    A 233          2H5*        A 233  -5.161  33.685 -26.576
  791    H4*    A 233           H4*        A 233  -4.186  31.468 -27.231
  792    H3*    A 233           H3*        A 233  -4.946  32.095 -24.390
  793    H2*    A 233           H2*        A 233  -4.444  29.857 -23.768
  794   2HO*    A 233          2HO*        A 233  -3.650  28.598 -25.852
  795    H1*    A 233           H1*        A 233  -1.971  29.855 -25.080
  796    H8     A 233           H8         A 233  -2.471  33.196 -23.541
  797   1H6     A 233          1H6         A 233  -0.273  30.777 -18.224
  798   2H6     A 233          2H6         A 233  -0.722  32.266 -19.025
  799    H2     A 233           H2         A 233  -0.968  27.448 -21.082
  800   1H5*    G 234          1H5*        G 234  -7.677  28.496 -25.626
  801   2H5*    G 234          2H5*        G 234  -9.135  28.836 -24.695
  802    H4*    G 234           H4*        G 234  -8.226  26.576 -24.301
  803    H3*    G 234           H3*        G 234  -8.480  28.507 -22.014
  804    H2*    G 234           H2*        G 234  -7.786  26.804 -20.498
  805   2HO*    G 234          2HO*        G 234  -8.459  24.873 -21.223
  806    H1*    G 234           H1*        G 234  -5.550  26.120 -22.022
  807    H8     G 234           H8         G 234  -5.875  29.779 -22.315
  808    H1     G 234           H1         G 234  -3.345  27.958 -16.643
  809   1H2     G 234          1H2         G 234  -3.579  25.923 -16.406
  810   2H2     G 234          2H2         G 234  -4.346  24.867 -17.570
  811   1H    GLY  15          1H        GLY  15   4.558  -3.365  -0.902
  812   1HA   GLY  15          1HA       GLY  15   3.796  -1.042  -2.182
  813   2HA   GLY  15          2HA       GLY  15   3.399  -1.419  -0.512
  814    H    ARG  16           H        ARG  16   6.213  -0.314  -2.407
  815    HA   ARG  16           HA       ARG  16   6.587   1.830  -0.440
  816   1HB   ARG  16          2HB       ARG  16   8.594  -0.229  -1.292
  817   2HB   ARG  16          3HB       ARG  16   9.131   1.381  -0.828
  818   1HG   ARG  16          2HG       ARG  16   8.103   1.113   1.360
  819   2HG   ARG  16          3HG       ARG  16   7.514  -0.484   0.896
  820   1HD   ARG  16          2HD       ARG  16   9.625  -1.420   0.941
  821   2HD   ARG  16          3HD       ARG  16  10.429   0.130   0.701
  822    HE   ARG  16           HE       ARG  16  10.473   0.402   2.966
  823   1HH1  ARG  16          2HH1      ARG  16   8.083  -2.002   2.173
  824   2HH1  ARG  16          1HH1      ARG  16   7.764  -2.417   3.824
  825   1HH2  ARG  16          2HH2      ARG  16  10.063  -0.138   5.144
  826   2HH2  ARG  16          1HH2      ARG  16   8.891  -1.356   5.513
  827    H    ALA  17           H        ALA  17   8.104   0.589  -3.424
  828    HA   ALA  17           HA       ALA  17   8.584   1.587  -5.414
  829   1HB   ALA  17          1HB       ALA  17   7.089   3.154  -6.303
  830   2HB   ALA  17          2HB       ALA  17   6.113   2.193  -5.191
  831   3HB   ALA  17          3HB       ALA  17   6.676   3.795  -4.712
  832    H    ARG  18           H        ARG  18   9.693   2.532  -2.665
  833    HA   ARG  18           HA       ARG  18  10.442   5.202  -2.799
  834   1HB   ARG  18          2HB       ARG  18  10.782   3.488  -0.905
  835   2HB   ARG  18          3HB       ARG  18  12.274   3.066  -1.737
  836   1HG   ARG  18          2HG       ARG  18  11.661   5.897  -0.965
  837   2HG   ARG  18          3HG       ARG  18  12.395   4.762   0.170
  838   1HD   ARG  18          2HD       ARG  18  13.819   4.522  -2.248
  839   2HD   ARG  18          3HD       ARG  18  13.617   6.249  -1.952
  840    HE   ARG  18           HE       ARG  18  14.444   5.106   0.437
  841   1HH1  ARG  18          2HH1      ARG  18  15.676   5.544  -2.789
  842   2HH1  ARG  18          1HH1      ARG  18  17.335   5.590  -2.290
  843   1HH2  ARG  18          2HH2      ARG  18  16.623   5.166   1.108
  844   2HH2  ARG  18          1HH2      ARG  18  17.871   5.374  -0.073
  845    H    GLY  19           H        GLY  19  11.948   6.337  -3.891
  846   1HA   GLY  19          1HA       GLY  19  13.991   6.620  -5.060
  847   2HA   GLY  19          2HA       GLY  19  14.008   4.895  -5.396
  848    H    LEU  20           H        LEU  20  11.081   5.139  -6.183
  849    HA   LEU  20           HA       LEU  20  11.615   5.804  -8.963
  850   1HB   LEU  20          2HB       LEU  20   9.451   4.350  -7.508
  851   2HB   LEU  20          3HB       LEU  20   9.142   4.972  -9.129
  852    HG   LEU  20           HG       LEU  20  11.605   3.461  -9.044
  853   1HD1  LEU  20          1HD1      LEU  20  10.700   2.173  -7.280
  854   2HD1  LEU  20          2HD1      LEU  20  10.440   1.245  -8.756
  855   3HD1  LEU  20          3HD1      LEU  20   9.104   2.136  -8.028
  856   1HD2  LEU  20          1HD2      LEU  20   9.032   3.437 -10.577
  857   2HD2  LEU  20          2HD2      LEU  20  10.220   2.149 -10.785
  858   3HD2  LEU  20          3HD2      LEU  20  10.661   3.820 -11.134
  859    H    CYS  21           H        CYS  21  10.500   7.406 -10.203
  860    HA   CYS  21           HA       CYS  21   9.256   9.416  -8.501
  861   1HB   CYS  21          2HB       CYS  21  11.176  10.102  -9.923
  862   2HB   CYS  21          3HB       CYS  21  10.268   9.660 -11.355
  863    H    TYR  22           H        TYR  22   7.263  10.350  -9.211
  864    HA   TYR  22           HA       TYR  22   5.604   8.525 -10.819
  865   1HB   TYR  22          2HB       TYR  22   5.044  10.178  -8.395
  866   2HB   TYR  22          3HB       TYR  22   3.732   9.879  -9.529
  867    HD1  TYR  22           HD1      TYR  22   6.061   7.206  -9.533
  868    HD2  TYR  22           HD2      TYR  22   2.761   8.806  -7.375
  869    HE1  TYR  22           HE1      TYR  22   5.675   5.006  -8.502
  870    HE2  TYR  22           HE2      TYR  22   2.368   6.611  -6.337
  871    HH   TYR  22           HH       TYR  22   3.765   4.540  -5.824
  872    H    THR  23           H        THR  23   6.617  11.829 -10.363
  873    HA   THR  23           HA       THR  23   4.730  13.116 -11.999
  874    HB   THR  23           HB       THR  23   7.591  13.865 -11.377
  875    HG1  THR  23           HG1      THR  23   5.075  14.684 -10.314
  876   1HG2  THR  23          1HG2      THR  23   5.421  15.388 -12.809
  877   2HG2  THR  23          2HG2      THR  23   7.055  15.032 -13.371
  878   3HG2  THR  23          3HG2      THR  23   6.805  16.177 -12.054
  879    H    CYS  24           H        CYS  24   8.012  11.770 -12.790
  880    HA   CYS  24           HA       CYS  24   7.295  12.149 -15.599
  881   1HB   CYS  24          2HB       CYS  24   9.704  11.932 -16.072
  882   2HB   CYS  24          3HB       CYS  24   9.365  13.263 -14.985
  883    H    GLY  25           H        GLY  25   8.445   9.910 -13.128
  884   1HA   GLY  25          1HA       GLY  25   7.750   7.634 -13.020
  885   2HA   GLY  25          2HA       GLY  25   7.510   7.655 -14.762
  886    H    SER  26           H        SER  26  10.358   8.802 -13.024
  887    HA   SER  26           HA       SER  26  11.936   6.775 -14.457
  888   1HB   SER  26          2HB       SER  26  12.258   9.532 -14.332
  889   2HB   SER  26          3HB       SER  26  13.471   8.916 -13.211
  890    HG   SER  26           HG       SER  26  14.518   8.766 -15.073
  891    HA   PRO  27           HA       PRO  27  12.528   4.886 -10.467
  892   1HB   PRO  27          2HB       PRO  27  14.167   2.906 -11.341
  893   2HB   PRO  27          3HB       PRO  27  12.415   2.877 -11.576
  894   1HG   PRO  27          2HG       PRO  27  14.570   3.667 -13.497
  895   2HG   PRO  27          3HG       PRO  27  13.123   2.683 -13.782
  896   1HD   PRO  27          2HD       PRO  27  13.268   5.296 -14.478
  897   2HD   PRO  27          3HD       PRO  27  11.752   4.528 -13.966
  898    H    GLY  28           H        GLY  28  13.742   6.783  -9.729
  899   1HA   GLY  28          1HA       GLY  28  16.386   6.115  -8.973
  900   2HA   GLY  28          2HA       GLY  28  16.426   7.288 -10.281
  901    H    HIS  29           H        HIS  29  13.991   8.638  -9.459
  902    HA   HIS  29           HA       HIS  29  14.760   9.770  -6.865
  903   1HB   HIS  29          2HB       HIS  29  14.536  12.044  -7.704
  904   2HB   HIS  29          3HB       HIS  29  15.758  11.181  -8.633
  905    HD1  HIS  29           HD1      HIS  29  15.257  10.721 -11.113
  906    HD2  HIS  29           HD2      HIS  29  12.212  12.731  -9.126
  907    HE1  HIS  29           HE1      HIS  29  13.712  11.551 -12.915
  908    H    TYR  30           H        TYR  30  12.976  11.618  -6.397
  909    HA   TYR  30           HA       TYR  30  10.367  10.324  -6.849
  910   1HB   TYR  30          2HB       TYR  30  11.700  11.057  -4.410
  911   2HB   TYR  30          3HB       TYR  30  10.202  11.968  -4.559
  912    HD1  TYR  30           HD1      TYR  30  11.380   8.459  -5.122
  913    HD2  TYR  30           HD2      TYR  30   8.344  11.018  -3.592
  914    HE1  TYR  30           HE1      TYR  30  10.115   6.493  -4.357
  915    HE2  TYR  30           HE2      TYR  30   7.072   9.059  -2.821
  916    HH   TYR  30           HH       TYR  30   7.845   6.510  -2.156
  917    H    GLN  31           H        GLN  31   8.493  11.838  -6.638
  918    HA   GLN  31           HA       GLN  31   8.583  13.851  -8.519
  919   1HB   GLN  31          2HB       GLN  31   6.460  13.005  -7.907
  920   2HB   GLN  31          3HB       GLN  31   6.713  13.379  -6.207
  921   1HG   GLN  31          2HG       GLN  31   6.318  15.643  -6.515
  922   2HG   GLN  31          3HG       GLN  31   6.620  15.559  -8.249
  923   1HE2  GLN  31          1HE2      GLN  31   4.308  16.475  -6.521
  924   2HE2  GLN  31          2HE2      GLN  31   2.932  15.696  -7.216
  925    H    ALA  32           H        ALA  32   9.100  14.060  -5.039
  926    HA   ALA  32           HA       ALA  32   9.109  16.837  -4.756
  927   1HB   ALA  32          1HB       ALA  32  10.100  14.546  -3.213
  928   2HB   ALA  32          2HB       ALA  32  10.941  16.067  -2.909
  929   3HB   ALA  32          3HB       ALA  32   9.193  15.965  -2.688
  930    H    GLN  33           H        GLN  33  11.386  14.744  -6.259
  931    HA   GLN  33           HA       GLN  33  13.222  17.019  -6.603
  932   1HB   GLN  33          2HB       GLN  33  13.855  14.149  -5.982
  933   2HB   GLN  33          3HB       GLN  33  15.025  15.173  -6.803
  934   1HG   GLN  33          2HG       GLN  33  15.287  16.566  -4.964
  935   2HG   GLN  33          3HG       GLN  33  13.776  16.036  -4.227
  936   1HE2  GLN  33          1HE2      GLN  33  14.372  15.195  -2.343
  937   2HE2  GLN  33          2HE2      GLN  33  15.552  13.951  -2.130
  938    H    CYS  34           H        CYS  34  10.970  16.130  -8.345
  939    HA   CYS  34           HA       CYS  34  12.126  14.680 -10.485
  940   1HB   CYS  34          2HB       CYS  34   9.671  14.746  -9.928
  941   2HB   CYS  34          3HB       CYS  34   9.621  16.392 -10.528
  942    HA   PRO  35           HA       PRO  35  14.366  18.148 -12.168
  943   1HB   PRO  35          2HB       PRO  35  15.078  16.941 -14.493
  944   2HB   PRO  35          3HB       PRO  35  15.851  16.577 -12.947
  945   1HG   PRO  35          2HG       PRO  35  13.705  15.071 -14.391
  946   2HG   PRO  35          3HG       PRO  35  15.139  14.449 -13.554
  947   1HD   PRO  35          2HD       PRO  35  12.673  14.424 -12.435
  948   2HD   PRO  35          3HD       PRO  35  14.155  14.619 -11.477
  949    H    LYS  36           H        LYS  36  11.508  16.760 -13.414
  950    HA   LYS  36           HA       LYS  36  11.318  18.704 -15.595
  951   1HB   LYS  36          2HB       LYS  36  10.424  16.045 -15.268
  952   2HB   LYS  36          3HB       LYS  36   8.982  17.049 -15.322
  953   1HG   LYS  36          2HG       LYS  36   9.314  17.657 -17.486
  954   2HG   LYS  36          3HG       LYS  36  11.072  17.541 -17.367
  955   1HD   LYS  36          2HD       LYS  36  10.662  15.004 -17.129
  956   2HD   LYS  36          3HD       LYS  36   9.057  15.356 -17.775
  957   1HE   LYS  36          2HE       LYS  36  11.708  15.940 -19.090
  958   2HE   LYS  36          3HE       LYS  36  10.539  14.713 -19.572
  959   1HZ   LYS  36          1HZ       LYS  36   9.101  17.026 -19.556
  960   2HZ   LYS  36          2HZ       LYS  36   9.728  16.260 -20.927
  961   3HZ   LYS  36          3HZ       LYS  36  10.597  17.507 -20.184
  962    H    LYS  37           H        LYS  37  10.690  18.650 -12.393
  963    HA   LYS  37           HA       LYS  37   8.079  19.582 -12.098
  964   1HB   LYS  37          2HB       LYS  37  10.583  19.770 -10.506
  965   2HB   LYS  37          3HB       LYS  37   9.281  20.877 -10.087
  966   1HG   LYS  37          2HG       LYS  37   8.261  18.211 -10.419
  967   2HG   LYS  37          3HG       LYS  37   9.595  18.230  -9.264
  968   1HD   LYS  37          2HD       LYS  37   8.448  19.476  -7.754
  969   2HD   LYS  37          3HD       LYS  37   7.587  20.386  -8.999
  970   1HE   LYS  37          2HE       LYS  37   6.796  17.630  -9.082
  971   2HE   LYS  37          3HE       LYS  37   6.629  18.247  -7.440
  972   1HZ   LYS  37          1HZ       LYS  37   5.376  19.304  -9.907
  973   2HZ   LYS  37          2HZ       LYS  37   5.405  20.169  -8.455
  974   3HZ   LYS  37          3HZ       LYS  37   4.606  18.681  -8.536
  975    H    ARG  38           H        ARG  38  10.915  21.170 -13.292
  976    HA   ARG  38           HA       ARG  38   9.406  23.394 -14.230
  977   1HB   ARG  38          2HB       ARG  38  10.190  23.687 -11.624
  978   2HB   ARG  38          3HB       ARG  38  11.527  24.437 -12.484
  979   1HG   ARG  38          2HG       ARG  38  10.326  26.281 -12.686
  980   2HG   ARG  38          3HG       ARG  38   9.163  25.394 -13.674
  981   1HD   ARG  38          2HD       ARG  38   8.047  24.658 -11.567
  982   2HD   ARG  38          3HD       ARG  38   9.133  25.725 -10.679
  983    HE   ARG  38           HE       ARG  38   6.803  26.483 -12.138
  984   1HH1  ARG  38          2HH1      ARG  38   9.974  27.550 -11.175
  985   2HH1  ARG  38          1HH1      ARG  38   9.574  29.234 -11.255
  986   1HH2  ARG  38          2HH2      ARG  38   6.265  28.696 -12.248
  987   2HH2  ARG  38          1HH2      ARG  38   7.464  29.885 -11.865
  988    H    LYS  39           H        LYS  39  11.333  25.247 -14.696
  989    HA   LYS  39           HA       LYS  39  13.002  23.872 -16.628
  990   1HB   LYS  39          2HB       LYS  39  11.818  26.466 -16.400
  991   2HB   LYS  39          3HB       LYS  39  13.554  26.658 -16.594
  992   1HG   LYS  39          2HG       LYS  39  12.483  24.694 -18.427
  993   2HG   LYS  39          3HG       LYS  39  11.696  26.264 -18.603
  994   1HD   LYS  39          2HD       LYS  39  13.815  27.350 -18.937
  995   2HD   LYS  39          3HD       LYS  39  14.685  25.858 -18.571
  996   1HE   LYS  39          2HE       LYS  39  13.562  24.818 -20.549
  997   2HE   LYS  39          3HE       LYS  39  12.911  26.407 -20.946
  998   1HZ   LYS  39          1HZ       LYS  39  15.110  25.604 -22.022
  999   2HZ   LYS  39          2HZ       LYS  39  15.808  26.089 -20.560
 1000   3HZ   LYS  39          3HZ       LYS  39  14.970  27.210 -21.511
 1001    H    SER  40           H        SER  40  15.286  24.941 -16.905
 1002    HA   SER  40           HA       SER  40  16.601  25.614 -14.424
 1003   1HB   SER  40          2HB       SER  40  17.798  23.240 -15.767
 1004   2HB   SER  40          3HB       SER  40  17.825  23.704 -14.066
 1005    HG   SER  40           HG       SER  40  15.901  22.787 -13.764
 1006    H    GLY  41           H        GLY  41  19.206  25.225 -15.077
 1007   1HA   GLY  41          1HA       GLY  41  19.862  25.940 -17.750
 1008   2HA   GLY  41          2HA       GLY  41  19.822  27.367 -16.724
 1009    H    ASN  42           H        ASN  42  22.017  27.777 -16.883
 1010    HA   ASN  42           HA       ASN  42  23.673  26.169 -15.132
 1011   1HB   ASN  42          2HB       ASN  42  24.442  26.620 -18.025
 1012   2HB   ASN  42          3HB       ASN  42  25.487  25.922 -16.791
 1013   1HD2  ASN  42          1HD2      ASN  42  23.237  25.294 -19.184
 1014   2HD2  ASN  42          2HD2      ASN  42  22.914  23.638 -18.810
 1015    H    SER  43           H        SER  43  25.975  27.200 -15.075
 1016    HA   SER  43           HA       SER  43  26.386  29.870 -15.795
 1017   1HB   SER  43          2HB       SER  43  24.492  29.742 -13.802
 1018   2HB   SER  43          3HB       SER  43  25.981  30.001 -12.892
 1019    HG   SER  43           HG       SER  43  26.304  31.713 -14.645
 1020    H    ARG  44           H        ARG  44  28.031  30.892 -14.010
 1021    HA   ARG  44           HA       ARG  44  30.340  29.309 -14.174
 1022   1HB   ARG  44          2HB       ARG  44  31.416  31.011 -12.829
 1023   2HB   ARG  44          3HB       ARG  44  30.349  31.776 -13.999
 1024   1HG   ARG  44          2HG       ARG  44  29.020  31.245 -11.475
 1025   2HG   ARG  44          3HG       ARG  44  30.438  32.278 -11.294
 1026   1HD   ARG  44          2HD       ARG  44  28.511  32.850 -13.492
 1027   2HD   ARG  44          3HD       ARG  44  28.074  33.293 -11.843
 1028    HE   ARG  44           HE       ARG  44  30.680  34.212 -12.496
 1029   1HH1  ARG  44          2HH1      ARG  44  27.301  34.880 -12.995
 1030   2HH1  ARG  44          1HH1      ARG  44  27.540  36.577 -13.250
 1031   1HH2  ARG  44          2HH2      ARG  44  31.008  36.444 -12.831
 1032   2HH2  ARG  44          1HH2      ARG  44  29.650  37.465 -13.158
 1033    H    GLU  45           H        GLU  45  31.652  29.355 -11.809
 1034    HA   GLU  45           HA       GLU  45  30.023  27.602 -10.089
 1035   1HB   GLU  45          2HB       GLU  45  33.021  27.456 -10.382
 1036   2HB   GLU  45          3HB       GLU  45  31.954  26.288  -9.615
 1037   1HG   GLU  45          2HG       GLU  45  32.064  25.174 -11.533
 1038   2HG   GLU  45          3HG       GLU  45  30.964  26.399 -12.161
 1039    H    ARG  46           H        ARG  46  30.471  30.539  -9.961
 1040    HA   ARG  46           HA       ARG  46  31.886  30.720  -7.389
 1041   1HB   ARG  46          2HB       ARG  46  32.446  32.191  -9.497
 1042   2HB   ARG  46          3HB       ARG  46  31.057  33.127  -8.960
 1043   1HG   ARG  46          2HG       ARG  46  32.094  33.764  -6.980
 1044   2HG   ARG  46          3HG       ARG  46  33.278  32.458  -7.070
 1045   1HD   ARG  46          2HD       ARG  46  34.483  34.380  -7.646
 1046   2HD   ARG  46          3HD       ARG  46  34.121  33.608  -9.188
 1047    HE   ARG  46           HE       ARG  46  32.143  35.530  -8.470
 1048   1HH1  ARG  46          2HH1      ARG  46  35.333  35.163  -9.815
 1049   2HH1  ARG  46          1HH1      ARG  46  35.263  36.637 -10.722
 1050   1HH2  ARG  46          2HH2      ARG  46  32.038  37.474  -9.659
 1051   2HH2  ARG  46          1HH2      ARG  46  33.388  37.952 -10.631
 1052    H    CYS  47           H        CYS  47  30.928  32.617  -5.913
 1053    HA   CYS  47           HA       CYS  47  28.015  32.312  -5.998
 1054   1HB   CYS  47          2HB       CYS  47  28.983  30.939  -4.189
 1055   2HB   CYS  47          3HB       CYS  47  29.768  32.355  -3.519
 1056    H    GLN  48           H        GLN  48  27.130  34.234  -6.345
 1057    HA   GLN  48           HA       GLN  48  28.635  36.681  -5.818
 1058   1HB   GLN  48          2HB       GLN  48  27.010  35.882  -7.924
 1059   2HB   GLN  48          3HB       GLN  48  26.013  37.027  -7.035
 1060   1HG   GLN  48          2HG       GLN  48  28.814  37.805  -7.603
 1061   2HG   GLN  48          3HG       GLN  48  27.681  37.772  -8.954
 1062   1HE2  GLN  48          1HE2      GLN  48  25.623  38.955  -8.595
 1063   2HE2  GLN  48          2HE2      GLN  48  25.695  40.446  -7.725
 1064    H    LEU  49           H        LEU  49  27.409  35.118  -3.658
 1065    HA   LEU  49           HA       LEU  49  25.616  37.203  -2.605
 1066   1HB   LEU  49          2HB       LEU  49  25.047  34.460  -3.045
 1067   2HB   LEU  49          3HB       LEU  49  25.121  34.719  -1.304
 1068    HG   LEU  49           HG       LEU  49  23.508  36.674  -2.807
 1069   1HD1  LEU  49          1HD1      LEU  49  21.648  34.734  -2.518
 1070   2HD1  LEU  49          2HD1      LEU  49  23.045  33.781  -3.017
 1071   3HD1  LEU  49          3HD1      LEU  49  22.472  35.104  -4.033
 1072   1HD2  LEU  49          1HD2      LEU  49  23.191  37.005  -0.596
 1073   2HD2  LEU  49          2HD2      LEU  49  23.564  35.333  -0.179
 1074   3HD2  LEU  49          3HD2      LEU  49  21.971  35.750  -0.811
 1075    H    CYS  50           H        CYS  50  28.143  34.744  -1.916
 1076    HA   CYS  50           HA       CYS  50  28.682  36.260   0.528
 1077   1HB   CYS  50          2HB       CYS  50  29.036  34.330   1.819
 1078   2HB   CYS  50          3HB       CYS  50  27.546  34.008   0.954
 1079    H    ASN  51           H        ASN  51  29.606  35.941  -2.402
 1080    HA   ASN  51           HA       ASN  51  31.541  36.053  -3.593
 1081   1HB   ASN  51          2HB       ASN  51  31.999  37.713  -1.680
 1082   2HB   ASN  51          3HB       ASN  51  33.010  36.446  -0.992
 1083   1HD2  ASN  51          1HD2      ASN  51  34.238  38.711  -1.524
 1084   2HD2  ASN  51          2HD2      ASN  51  35.221  38.595  -2.941
 1085    H    GLY  52           H        GLY  52  30.659  33.502  -2.197
 1086   1HA   GLY  52          1HA       GLY  52  32.967  32.014  -1.509
 1087   2HA   GLY  52          2HA       GLY  52  31.405  31.343  -1.955
 1088    H    MET  53           H        MET  53  33.914  30.234  -2.668
 1089    HA   MET  53           HA       MET  53  33.804  30.561  -5.594
 1090   1HB   MET  53          2HB       MET  53  36.031  30.920  -3.838
 1091   2HB   MET  53          3HB       MET  53  36.340  29.520  -4.855
 1092   1HG   MET  53          2HG       MET  53  35.465  31.230  -6.717
 1093   2HG   MET  53          3HG       MET  53  36.140  32.374  -5.561
 1094   1HE   MET  53          1HE       MET  53  36.507  29.458  -7.772
 1095   2HE   MET  53          2HE       MET  53  38.190  29.451  -8.300
 1096   3HE   MET  53          3HE       MET  53  37.732  28.643  -6.800
 1097    H    GLY  54           H        GLY  54  32.554  28.825  -6.107
 1098   1HA   GLY  54          1HA       GLY  54  33.379  26.394  -6.674
 1099   2HA   GLY  54          2HA       GLY  54  33.196  26.220  -4.936
 1100    H    HIS  55           H        HIS  55  30.938  27.318  -4.240
 1101    HA   HIS  55           HA       HIS  55  28.948  25.703  -5.597
 1102   1HB   HIS  55          2HB       HIS  55  27.473  26.372  -3.728
 1103   2HB   HIS  55          3HB       HIS  55  28.986  25.671  -3.164
 1104    HD1  HIS  55           HD1      HIS  55  30.825  27.483  -2.346
 1105    HD2  HIS  55           HD2      HIS  55  26.910  28.829  -2.699
 1106    HE1  HIS  55           HE1      HIS  55  30.726  29.618  -1.022
 1107    H    ASN  56           H        ASN  56  26.628  27.007  -5.362
 1108    HA   ASN  56           HA       ASN  56  26.996  29.438  -6.987
 1109   1HB   ASN  56          2HB       ASN  56  26.074  27.518  -8.264
 1110   2HB   ASN  56          3HB       ASN  56  24.712  27.458  -7.148
 1111   1HD2  ASN  56          1HD2      ASN  56  26.363  29.487  -9.501
 1112   2HD2  ASN  56          2HD2      ASN  56  24.972  30.406  -9.956
 1113    H    ALA  57           H        ALA  57  25.507  31.143  -6.694
 1114    HA   ALA  57           HA       ALA  57  24.817  31.734  -4.067
 1115   1HB   ALA  57          1HB       ALA  57  23.264  33.464  -5.208
 1116   2HB   ALA  57          2HB       ALA  57  25.008  33.584  -5.445
 1117   3HB   ALA  57          3HB       ALA  57  23.994  32.879  -6.704
 1118    H    LYS  58           H        LYS  58  22.869  30.336  -6.661
 1119    HA   LYS  58           HA       LYS  58  20.381  30.414  -5.364
 1120   1HB   LYS  58          2HB       LYS  58  21.235  29.647  -7.831
 1121   2HB   LYS  58          3HB       LYS  58  20.885  28.085  -7.103
 1122   1HG   LYS  58          2HG       LYS  58  18.667  29.490  -6.420
 1123   2HG   LYS  58          3HG       LYS  58  19.069  30.208  -7.982
 1124   1HD   LYS  58          2HD       LYS  58  19.359  27.672  -8.671
 1125   2HD   LYS  58          3HD       LYS  58  18.254  27.423  -7.317
 1126   1HE   LYS  58          2HE       LYS  58  16.895  29.340  -8.478
 1127   2HE   LYS  58          3HE       LYS  58  17.808  28.846  -9.903
 1128   1HZ   LYS  58          1HZ       LYS  58  16.940  26.494  -8.890
 1129   2HZ   LYS  58          2HZ       LYS  58  16.202  27.340 -10.155
 1130   3HZ   LYS  58          3HZ       LYS  58  15.633  27.520  -8.572
 1131    H    GLN  59           H        GLN  59  23.133  28.389  -4.909
 1132    HA   GLN  59           HA       GLN  59  21.563  26.657  -3.114
 1133   1HB   GLN  59          2HB       GLN  59  22.917  25.761  -5.233
 1134   2HB   GLN  59          3HB       GLN  59  24.241  25.788  -4.076
 1135   1HG   GLN  59          2HG       GLN  59  22.045  24.579  -2.788
 1136   2HG   GLN  59          3HG       GLN  59  22.169  23.861  -4.394
 1137   1HE2  GLN  59          1HE2      GLN  59  24.667  23.567  -4.962
 1138   2HE2  GLN  59          2HE2      GLN  59  25.534  22.667  -3.770
 1139    H    CYS  60           H        CYS  60  23.127  29.372  -2.742
 1140    HA   CYS  60           HA       CYS  60  25.200  28.539  -0.942
 1141   1HB   CYS  60          2HB       CYS  60  25.545  30.528  -2.309
 1142   2HB   CYS  60          3HB       CYS  60  24.117  31.289  -1.635
 1143    H    ARG  61           H        ARG  61  24.997  28.429   1.228
 1144    HA   ARG  61           HA       ARG  61  22.340  28.587   2.380
 1145   1HB   ARG  61          2HB       ARG  61  24.271  26.799   2.771
 1146   2HB   ARG  61          3HB       ARG  61  24.737  27.938   4.028
 1147   1HG   ARG  61          2HG       ARG  61  22.707  27.662   5.179
 1148   2HG   ARG  61          3HG       ARG  61  21.945  26.860   3.804
 1149   1HD   ARG  61          2HD       ARG  61  24.099  25.252   4.273
 1150   2HD   ARG  61          3HD       ARG  61  23.680  25.775   5.903
 1151    HE   ARG  61           HE       ARG  61  21.820  24.455   5.797
 1152   1HH1  ARG  61          2HH1      ARG  61  22.986  25.013   2.564
 1153   2HH1  ARG  61          1HH1      ARG  61  21.864  23.916   1.831
 1154   1HH2  ARG  61          2HH2      ARG  61  20.338  23.008   4.842
 1155   2HH2  ARG  61          1HH2      ARG  61  20.358  22.776   3.127
 1156    H    LYS  62           H        LYS  62  22.892  31.078   1.741
 1157    HA   LYS  62           HA       LYS  62  24.405  32.686   3.397
 1158   1HB   LYS  62          2HB       LYS  62  22.903  34.515   2.774
 1159   2HB   LYS  62          3HB       LYS  62  23.281  33.509   1.383
 1160   1HG   LYS  62          2HG       LYS  62  20.839  32.802   2.880
 1161   2HG   LYS  62          3HG       LYS  62  20.807  34.324   1.985
 1162   1HD   LYS  62          2HD       LYS  62  21.811  32.839   0.062
 1163   2HD   LYS  62          3HD       LYS  62  21.067  31.527   0.980
 1164   1HE   LYS  62          2HE       LYS  62  18.951  32.984   0.953
 1165   2HE   LYS  62          3HE       LYS  62  19.758  33.892  -0.326
 1166   1HZ   LYS  62          1HZ       LYS  62  18.667  32.361  -1.571
 1167   2HZ   LYS  62          2HZ       LYS  62  18.689  31.172  -0.367
 1168   3HZ   LYS  62          3HZ       LYS  62  20.079  31.474  -1.282
 1169    H    ARG  63           H        ARG  63  23.986  33.866   5.283
 1170    HA   ARG  63           HA       ARG  63  21.952  32.650   7.015
 1171   1HB   ARG  63          2HB       ARG  63  24.256  34.390   7.888
 1172   2HB   ARG  63          3HB       ARG  63  23.273  33.321   8.881
 1173   1HG   ARG  63          2HG       ARG  63  24.882  31.814   8.638
 1174   2HG   ARG  63          3HG       ARG  63  24.344  31.641   6.966
 1175   1HD   ARG  63          2HD       ARG  63  26.587  32.083   6.684
 1176   2HD   ARG  63          3HD       ARG  63  25.890  33.698   6.552
 1177    HE   ARG  63           HE       ARG  63  26.510  33.341   9.218
 1178   1HH1  ARG  63          2HH1      ARG  63  28.218  33.379   6.185
 1179   2HH1  ARG  63          1HH1      ARG  63  29.696  33.965   6.875
 1180   1HH2  ARG  63          2HH2      ARG  63  28.450  34.113  10.138
 1181   2HH2  ARG  63          1HH2      ARG  63  29.826  34.381   9.124
 1182    H    ASP  64           H        ASP  64  20.828  34.360   5.292
 1183    HA   ASP  64           HA       ASP  64  20.506  36.891   6.758
 1184   1HB   ASP  64          2HB       ASP  64  21.181  37.226   4.456
 1185   2HB   ASP  64          3HB       ASP  64  19.876  36.191   3.885
  Start of MODEL    8
    1   1H5*    C 160          1H5*        C 160  26.877  20.362  -4.316
    2   2H5*    C 160          2H5*        C 160  25.327  21.186  -4.486
    3    H4*    C 160           H4*        C 160  25.913  21.341  -2.210
    4    H3*    C 160           H3*        C 160  26.359  23.923  -3.688
    5    H2*    C 160           H2*        C 160  26.923  24.984  -1.634
    6   2HO*    C 160          2HO*        C 160  26.466  22.465  -0.352
    7    H1*    C 160           H1*        C 160  28.698  22.945  -0.886
    8   1H4     C 160          1H4         C 160  32.498  27.254  -3.646
    9   2H4     C 160          2H4         C 160  31.920  26.765  -5.223
   10    H5     C 160           H5         C 160  30.203  25.178  -5.560
   11    H6     C 160           H6         C 160  28.603  23.656  -4.456
   12   1H5*    U 161          1H5*        U 161  23.888  24.804  -0.356
   13   2H5*    U 161          2H5*        U 161  22.481  25.745  -0.849
   14    H4*    U 161           H4*        U 161  23.443  26.920   0.943
   15    H3*    U 161           H3*        U 161  24.081  28.183  -1.710
   16    H2*    U 161           H2*        U 161  25.157  29.983  -0.582
   17   2HO*    U 161          2HO*        U 161  25.010  29.287   1.975
   18    H1*    U 161           H1*        U 161  26.672  28.282   1.040
   19    H3     U 161           H3         U 161  29.658  30.078  -1.893
   20    H5     U 161           H5         U 161  27.759  27.041  -4.064
   21    H6     U 161           H6         U 161  26.205  26.804  -2.183
   22   1H5*    G 162          1H5*        G 162  22.436  30.911   0.932
   23   2H5*    G 162          2H5*        G 162  21.166  31.958   0.300
   24    H4*    G 162           H4*        G 162  22.741  33.363   1.360
   25    H3*    G 162           H3*        G 162  22.874  33.469  -1.637
   26    H2*    G 162           H2*        G 162  24.543  35.165  -1.513
   27   2HO*    G 162          2HO*        G 162  24.869  36.162   0.508
   28    H1*    G 162           H1*        G 162  26.116  33.728   0.288
   29    H8     G 162           H8         G 162  24.648  31.261  -2.043
   30    H1     G 162           H1         G 162  29.681  34.431  -4.590
   31   1H2     G 162          1H2         G 162  30.170  36.031  -3.384
   32   2H2     G 162          2H2         G 162  29.339  36.452  -1.903
   33   1H5*    C 163          1H5*        C 163  22.746  37.221  -0.136
   34   2H5*    C 163          2H5*        C 163  21.606  38.353  -0.863
   35    H4*    C 163           H4*        C 163  23.702  39.419  -0.907
   36    H3*    C 163           H3*        C 163  22.888  38.359  -3.598
   37    H2*    C 163           H2*        C 163  24.837  39.303  -4.572
   38   2HO*    C 163          2HO*        C 163  25.442  41.123  -3.558
   39    H1*    C 163           H1*        C 163  26.535  38.290  -2.575
   40   1H4     C 163          1H4         C 163  26.892  34.030  -7.322
   41   2H4     C 163          2H4         C 163  25.426  33.277  -6.735
   42    H5     C 163           H5         C 163  24.124  34.135  -4.962
   43    H6     C 163           H6         C 163  23.905  35.946  -3.299
   44   1H5*    C 164          1H5*        C 164  23.796  42.432  -4.326
   45   2H5*    C 164          2H5*        C 164  22.473  43.186  -5.216
   46    H4*    C 164           H4*        C 164  24.444  43.608  -6.446
   47    H3*    C 164           H3*        C 164  22.702  41.497  -7.682
   48    H2*    C 164           H2*        C 164  24.185  41.338  -9.533
   49   2HO*    C 164          2HO*        C 164  25.919  42.960  -9.596
   50    H1*    C 164           H1*        C 164  26.465  41.191  -7.881
   51   1H4     C 164          1H4         C 164  25.174  35.105  -9.300
   52   2H4     C 164          2H4         C 164  23.897  35.102  -8.105
   53    H5     C 164           H5         C 164  23.221  37.015  -6.895
   54    H6     C 164           H6         C 164  23.608  39.427  -6.533
   55   1H5*    C 165          1H5*        C 165  23.654  44.202 -10.523
   56   2H5*    C 165          2H5*        C 165  22.323  44.875 -11.464
   57    H4*    C 165           H4*        C 165  23.846  44.106 -13.057
   58    H3*    C 165           H3*        C 165  21.603  42.130 -12.691
   59    H2*    C 165           H2*        C 165  22.488  40.823 -14.464
   60   2HO*    C 165          2HO*        C 165  24.016  41.812 -15.831
   61    H1*    C 165           H1*        C 165  25.114  40.942 -13.464
   62   1H4     C 165          1H4         C 165  22.891  35.391 -11.244
   63   2H4     C 165          2H4         C 165  21.991  36.245 -10.011
   64    H5     C 165           H5         C 165  21.864  38.599  -9.866
   65    H6     C 165           H6         C 165  22.575  40.735 -10.880
   66   1H5*    U 166          1H5*        U 166  22.021  42.899 -16.603
   67   2H5*    U 166          2H5*        U 166  20.585  43.464 -17.456
   68    H4*    U 166           H4*        U 166  21.405  41.745 -18.793
   69    H3*    U 166           H3*        U 166  19.140  40.751 -17.082
   70    H2*    U 166           H2*        U 166  19.255  38.641 -18.167
   71   2HO*    U 166          2HO*        U 166  21.060  38.682 -19.938
   72    H1*    U 166           H1*        U 166  22.037  38.450 -17.900
   73    H3     U 166           H3         U 166  20.430  35.332 -15.009
   74    H5     U 166           H5         U 166  19.890  38.970 -13.004
   75    H6     U 166           H6         U 166  20.565  40.097 -15.074
   76   1H5*    C 167          1H5*        C 167  17.629  40.287 -21.357
   77   2H5*    C 167          2H5*        C 167  15.871  40.208 -21.248
   78    H4*    C 167           H4*        C 167  16.974  38.161 -22.168
   79    H3*    C 167           H3*        C 167  15.162  38.009 -19.770
   80    H2*    C 167           H2*        C 167  15.314  35.635 -19.836
   81   2HO*    C 167          2HO*        C 167  16.653  34.826 -21.736
   82    H1*    C 167           H1*        C 167  18.115  35.672 -20.076
   83   1H4     C 167          1H4         C 167  17.001  34.854 -13.836
   84   2H4     C 167          2H4         C 167  16.843  36.588 -13.659
   85    H5     C 167           H5         C 167  16.869  38.104 -15.469
   86    H6     C 167           H6         C 167  17.057  38.333 -17.921
   87   1H5*    A 168          1H5*        A 168  12.514  39.782 -20.597
   88   2H5*    A 168          2H5*        A 168  13.883  39.608 -19.498
   89    H4*    A 168           H4*        A 168  11.102  38.972 -18.557
   90    H3*    A 168           H3*        A 168  12.232  41.725 -18.992
   91    H2*    A 168           H2*        A 168  11.154  42.468 -17.005
   92   2HO*    A 168          2HO*        A 168   9.362  41.345 -16.477
   93    H1*    A 168           H1*        A 168  12.099  40.309 -15.491
   94    H8     A 168           H8         A 168  13.432  42.927 -17.927
   95   1H6     A 168          1H6         A 168  17.657  44.206 -13.514
   96   2H6     A 168          2H6         A 168  17.051  44.695 -15.081
   97    H2     A 168           H2         A 168  15.263  40.711 -12.175
   98   1H5*    U 169          1H5*        U 169   6.727  42.645 -21.275
   99   2H5*    U 169          2H5*        U 169   8.140  42.220 -22.239
  100    H4*    U 169           H4*        U 169   8.663  44.809 -21.312
  101    H3*    U 169           H3*        U 169   5.741  44.462 -21.701
  102    H2*    U 169           H2*        U 169   5.553  46.350 -23.127
  103   2HO*    U 169          2HO*        U 169   8.197  47.033 -23.281
  104    H1*    U 169           H1*        U 169   7.560  45.600 -24.840
  105    H3     U 169           H3         U 169   3.492  44.586 -26.749
  106    H5     U 169           H5         U 169   4.633  41.165 -24.618
  107    H6     U 169           H6         U 169   6.442  42.499 -23.639
  108   1H5*    C 170          1H5*        C 170   6.655  43.883 -19.318
  109   2H5*    C 170          2H5*        C 170   5.017  43.290 -19.035
  110    H4*    C 170           H4*        C 170   6.204  42.315 -17.317
  111    H3*    C 170           H3*        C 170   4.994  44.872 -16.274
  112    H2*    C 170           H2*        C 170   5.778  44.312 -14.106
  113   2HO*    C 170          2HO*        C 170   5.271  42.089 -14.331
  114    H1*    C 170           H1*        C 170   8.336  43.572 -15.075
  115   1H4     C 170          1H4         C 170   8.888  49.510 -12.719
  116   2H4     C 170          2H4         C 170   8.573  50.120 -14.329
  117    H5     C 170           H5         C 170   7.946  48.757 -16.153
  118    H6     C 170           H6         C 170   7.463  46.451 -16.890
  119   1H5*    C 171          1H5*        C 171   0.629  45.258 -16.299
  120   2H5*    C 171          2H5*        C 171   1.455  46.599 -15.506
  121    H4*    C 171           H4*        C 171   0.347  44.147 -14.384
  122    H3*    C 171           H3*        C 171   1.090  46.877 -13.342
  123    H2*    C 171           H2*        C 171   0.861  46.052 -11.130
  124   2HO*    C 171          2HO*        C 171   0.112  43.515 -12.196
  125    H1*    C 171           H1*        C 171   2.309  43.691 -11.706
  126   1H4     C 171          1H4         C 171   6.392  47.728  -8.851
  127   2H4     C 171          2H4         C 171   6.885  48.267 -10.441
  128    H5     C 171           H5         C 171   5.828  47.596 -12.443
  129    H6     C 171           H6         C 171   4.021  46.228 -13.423
  130   1H5*    G 172          1H5*        G 172  -3.342  46.676 -11.157
  131   2H5*    G 172          2H5*        G 172  -3.659  48.279 -11.821
  132    H4*    G 172           H4*        G 172  -4.002  48.190  -9.398
  133    H3*    G 172           H3*        G 172  -1.866  50.001 -10.487
  134    H2*    G 172           H2*        G 172  -1.485  50.858  -8.297
  135   2HO*    G 172          2HO*        G 172  -2.999  50.165  -6.639
  136    H1*    G 172           H1*        G 172  -1.278  48.317  -7.156
  137    H8     G 172           H8         G 172   0.247  48.345 -10.571
  138    H1     G 172           H1         G 172   4.217  50.505  -5.939
  139   1H2     G 172          1H2         G 172   3.159  50.757  -4.187
  140   2H2     G 172          2H2         G 172   1.451  50.431  -4.000
  141   1H5*    U 173          1H5*        U 173  -4.431  52.679  -8.023
  142   2H5*    U 173          2H5*        U 173  -4.420  54.226  -8.868
  143    H4*    U 173           H4*        U 173  -3.595  54.369  -6.546
  144    H3*    U 173           H3*        U 173  -1.769  55.138  -8.812
  145    H2*    U 173           H2*        U 173  -0.160  55.891  -7.237
  146   2HO*    U 173          2HO*        U 173  -1.092  56.672  -5.441
  147    H1*    U 173           H1*        U 173  -0.420  53.564  -5.652
  148    H3     U 173           H3         U 173   3.802  53.581  -7.455
  149    H5     U 173           H5         U 173   1.340  51.924 -10.411
  150    H6     U 173           H6         U 173  -0.582  52.578  -9.037
  151   1H5*    C 174          1H5*        C 174  -1.636  58.654  -6.408
  152   2H5*    C 174          2H5*        C 174  -2.158  59.978  -7.452
  153    H4*    C 174           H4*        C 174  -0.131  60.690  -6.526
  154    H3*    C 174           H3*        C 174   0.232  59.709  -9.344
  155    H2*    C 174           H2*        C 174   2.521  60.322  -9.270
  156   2HO*    C 174          2HO*        C 174   3.038  61.378  -7.013
  157    H1*    C 174           H1*        C 174   2.870  59.171  -6.692
  158   1H4     C 174          1H4         C 174   5.308  54.953 -10.842
  159   2H4     C 174          2H4         C 174   3.709  54.265 -11.030
  160    H5     C 174           H5         C 174   1.760  55.183 -10.064
  161    H6     C 174           H6         C 174   0.853  57.006  -8.668
  162   1H5*    U 175          1H5*        U 175  -1.903  64.333 -10.691
  163   2H5*    U 175          2H5*        U 175  -2.500  63.272 -11.965
  164    H4*    U 175           H4*        U 175  -0.079  63.694 -12.969
  165    H3*    U 175           H3*        U 175  -0.329  65.847 -10.939
  166    H2*    U 175           H2*        U 175   0.316  67.552 -12.461
  167   2HO*    U 175          2HO*        U 175   1.566  66.867 -14.111
  168    H1*    U 175           H1*        U 175  -1.507  66.854 -14.406
  169    H3     U 175           H3         U 175  -3.040  70.571 -12.158
  170    H5     U 175           H5         U 175  -4.588  67.273 -10.092
  171    H6     U 175           H6         U 175  -3.127  65.856 -11.460
  172   1H5*    C 176          1H5*        C 176   3.649  63.464  -8.613
  173   2H5*    C 176          2H5*        C 176   3.566  65.006  -7.759
  174    H4*    C 176           H4*        C 176   5.601  65.689  -8.490
  175    H3*    C 176           H3*        C 176   4.929  64.362 -11.084
  176    H2*    C 176           H2*        C 176   7.226  64.087 -11.621
  177   2HO*    C 176          2HO*        C 176   8.749  65.115 -10.070
  178    H1*    C 176           H1*        C 176   7.903  62.966  -9.177
  179   1H4     C 176          1H4         C 176   6.349  58.007 -12.909
  180   2H4     C 176          2H4         C 176   4.693  58.155 -12.362
  181    H5     C 176           H5         C 176   3.915  59.909 -10.987
  182    H6     C 176           H6         C 176   4.539  61.974  -9.784
  183   1H5*    G 177          1H5*        G 177   7.745  67.403 -11.630
  184   2H5*    G 177          2H5*        G 177   7.505  68.455 -13.024
  185    H4*    G 177           H4*        G 177   9.730  67.595 -13.099
  186    H3*    G 177           H3*        G 177   7.865  66.515 -15.184
  187    H2*    G 177           H2*        G 177   9.641  65.256 -16.154
  188   2HO*    G 177          2HO*        G 177  11.661  66.003 -15.748
  189    H1*    G 177           H1*        G 177  10.414  64.143 -13.714
  190    H8     G 177           H8         G 177   6.725  64.379 -13.650
  191    H1     G 177           H1         G 177   8.855  59.357 -17.132
  192   1H2     G 177          1H2         G 177  10.886  59.540 -17.433
  193   2H2     G 177          2H2         G 177  11.867  60.857 -16.830
  194   1H5*    C 178          1H5*        C 178  11.170  68.054 -17.774
  195   2H5*    C 178          2H5*        C 178  10.299  68.814 -19.106
  196    H4*    C 178           H4*        C 178  11.843  67.062 -19.862
  197    H3*    C 178           H3*        C 178   8.900  66.719 -20.376
  198    H2*    C 178           H2*        C 178   9.361  64.766 -21.653
  199   2HO*    C 178          2HO*        C 178  11.292  64.877 -22.637
  200    H1*    C 178           H1*        C 178  11.078  63.714 -19.679
  201   1H4     C 178          1H4         C 178   5.479  60.840 -18.609
  202   2H4     C 178          2H4         C 178   4.918  62.266 -17.766
  203    H5     C 178           H5         C 178   6.147  64.278 -17.620
  204    H6     C 178           H6         C 178   8.239  65.428 -18.254
  205   1H5*    U 179          1H5*        U 179  10.917  66.565 -24.372
  206   2H5*    U 179          2H5*        U 179   9.757  67.192 -25.543
  207    H4*    U 179           H4*        U 179  10.568  64.859 -25.968
  208    H3*    U 179           H3*        U 179   7.633  65.488 -25.734
  209    H2*    U 179           H2*        U 179   7.122  63.251 -26.348
  210   2HO*    U 179          2HO*        U 179   9.102  61.933 -26.926
  211    H1*    U 179           H1*        U 179   8.970  62.148 -24.548
  212    H3     U 179           H3         U 179   4.676  61.253 -23.119
  213    H5     U 179           H5         U 179   5.697  64.952 -21.440
  214    H6     U 179           H6         U 179   7.688  64.941 -22.873
  215   1H5*    U 180          1H5*        U 180   8.244  63.593 -29.170
  216   2H5*    U 180          2H5*        U 180   7.448  64.157 -30.640
  217    H4*    U 180           H4*        U 180   6.829  61.886 -30.298
  218    H3*    U 180           H3*        U 180   4.649  63.880 -29.793
  219    H2*    U 180           H2*        U 180   3.112  62.144 -29.297
  220   2HO*    U 180          2HO*        U 180   3.903  59.933 -29.714
  221    H1*    U 180           H1*        U 180   4.966  60.801 -27.621
  222    H3     U 180           H3         U 180   1.759  62.072 -24.689
  223    H5     U 180           H5         U 180   3.706  65.652 -25.650
  224    H6     U 180           H6         U 180   4.965  64.398 -27.341
  225   1H5*    A 181          1H5*        A 181   3.448  62.979 -34.442
  226   2H5*    A 181          2H5*        A 181   2.539  64.475 -34.661
  227    H4*    A 181           H4*        A 181   1.211  62.323 -34.678
  228    H3*    A 181           H3*        A 181   0.509  64.665 -32.926
  229    H2*    A 181           H2*        A 181  -1.457  63.535 -32.217
  230   2HO*    A 181          2HO*        A 181  -1.992  62.620 -34.202
  231    H1*    A 181           H1*        A 181  -0.115  61.140 -31.684
  232    H8     A 181           H8         A 181   1.963  64.114 -30.742
  233   1H6     A 181          1H6         A 181  -0.880  63.918 -25.190
  234   2H6     A 181          2H6         A 181   0.416  64.668 -26.092
  235    H2     A 181           H2         A 181  -2.927  61.054 -27.901
  236   1H5*    U 182          1H5*        U 182  -2.072  64.136 -36.551
  237   2H5*    U 182          2H5*        U 182  -0.977  64.726 -37.802
  238    H4*    U 182           H4*        U 182  -3.367  66.400 -37.338
  239    H3*    U 182           H3*        U 182  -3.732  63.541 -37.803
  240    H2*    U 182           H2*        U 182  -3.890  63.799 -40.084
  241   2HO*    U 182          2HO*        U 182  -6.110  65.410 -39.939
  242    H1*    U 182           H1*        U 182  -4.407  66.777 -39.559
  243    H3     U 182           H3         U 182  -5.096  67.006 -44.071
  244    H5     U 182           H5         U 182  -1.068  65.934 -43.654
  245    H6     U 182           H6         U 182  -1.497  65.641 -41.257
  246   1H5*    U 183          1H5*        U 183  -6.724  66.599 -35.339
  247   2H5*    U 183          2H5*        U 183  -5.161  65.808 -35.132
  248    H4*    U 183           H4*        U 183  -7.072  65.000 -33.086
  249    H3*    U 183           H3*        U 183  -6.586  67.956 -33.457
  250    H2*    U 183           H2*        U 183  -6.478  68.216 -31.140
  251   2HO*    U 183          2HO*        U 183  -7.248  65.809 -30.226
  252    H1*    U 183           H1*        U 183  -5.304  65.534 -30.867
  253    H3     U 183           H3         U 183  -2.562  68.023 -28.239
  254    H5     U 183           H5         U 183  -1.725  69.343 -32.125
  255    H6     U 183           H6         U 183  -3.610  67.973 -32.890
  256   1H5*    C 184          1H5*        C 184  -8.800  71.380 -31.995
  257   2H5*    C 184          2H5*        C 184  -7.681  70.745 -33.201
  258    H4*    C 184           H4*        C 184  -6.043  70.265 -31.425
  259    H3*    C 184           H3*        C 184  -8.230  71.177 -29.606
  260    H2*    C 184           H2*        C 184  -6.690  72.307 -28.194
  261   2HO*    C 184          2HO*        C 184  -4.893  71.063 -28.197
  262    H1*    C 184           H1*        C 184  -5.441  73.673 -30.248
  263   1H4     C 184          1H4         C 184 -10.344  77.314 -28.237
  264   2H4     C 184          2H4         C 184 -11.198  76.815 -29.680
  265    H5     C 184           H5         C 184 -10.411  75.158 -31.168
  266    H6     C 184           H6         C 184  -8.592  73.558 -31.643
  267   1H5*    G 185          1H5*        G 185  -7.952  68.658 -25.359
  268   2H5*    G 185          2H5*        G 185  -6.763  69.802 -24.735
  269    H4*    G 185           H4*        G 185  -6.322  66.937 -25.579
  270    H3*    G 185           H3*        G 185  -6.354  68.363 -22.954
  271    H2*    G 185           H2*        G 185  -4.560  67.028 -22.130
  272   2HO*    G 185          2HO*        G 185  -4.309  65.722 -24.630
  273    H1*    G 185           H1*        G 185  -2.952  67.506 -24.361
  274    H8     G 185           H8         G 185  -5.055  69.347 -21.794
  275    H1     G 185           H1         G 185   0.717  72.020 -22.983
  276   1H2     G 185          1H2         G 185   1.617  71.042 -24.560
  277   2H2     G 185          2H2         G 185   0.913  69.697 -25.430
  278   1H5*    G 186          1H5*        G 186  -7.629  64.872 -19.423
  279   2H5*    G 186          2H5*        G 186  -8.154  66.546 -19.238
  280    H4*    G 186           H4*        G 186  -5.309  65.592 -18.851
  281    H3*    G 186           H3*        G 186  -7.568  65.819 -16.892
  282    H2*    G 186           H2*        G 186  -6.070  66.616 -15.219
  283   2HO*    G 186          2HO*        G 186  -3.958  66.485 -17.131
  284    H1*    G 186           H1*        G 186  -4.968  68.560 -16.888
  285    H8     G 186           H8         G 186  -8.684  67.917 -17.301
  286    H1     G 186           H1         G 186  -7.199  72.521 -13.002
  287   1H2     G 186          1H2         G 186  -5.157  72.570 -12.723
  288   2H2     G 186          2H2         G 186  -4.016  71.521 -13.533
  289   1H5*    G 187          1H5*        G 187  -6.365  60.411 -16.364
  290   2H5*    G 187          2H5*        G 187  -5.492  61.699 -17.193
  291    H4*    G 187           H4*        G 187  -7.957  60.260 -18.198
  292    H3*    G 187           H3*        G 187  -5.036  59.983 -18.840
  293    H2*    G 187           H2*        G 187  -5.578  59.493 -21.108
  294   2HO*    G 187          2HO*        G 187  -8.330  59.884 -20.688
  295    H1*    G 187           H1*        G 187  -7.258  61.704 -21.366
  296    H8     G 187           H8         G 187  -4.499  62.856 -19.228
  297    H1     G 187           H1         G 187  -2.792  62.474 -25.459
  298   1H2     G 187          1H2         G 187  -4.235  61.439 -26.507
  299   2H2     G 187          2H2         G 187  -5.691  60.773 -25.802
  300   1H5*    G 188          1H5*        G 188  -6.767  57.013 -21.215
  301   2H5*    G 188          2H5*        G 188  -6.229  55.511 -20.463
  302    H4*    G 188           H4*        G 188  -5.820  55.148 -22.710
  303    H3*    G 188           H3*        G 188  -3.289  56.061 -21.369
  304    H2*    G 188           H2*        G 188  -2.107  55.756 -23.415
  305   2HO*    G 188          2HO*        G 188  -4.385  55.048 -24.872
  306    H1*    G 188           H1*        G 188  -3.986  57.195 -24.904
  307    H8     G 188           H8         G 188  -3.739  58.978 -21.703
  308    H1     G 188           H1         G 188   1.336  60.127 -25.551
  309   1H2     G 188          1H2         G 188   1.331  58.785 -27.116
  310   2H2     G 188          2H2         G 188   0.131  57.535 -27.352
  311   1H5*    A 189          1H5*        A 189  -1.787  52.355 -23.325
  312   2H5*    A 189          2H5*        A 189  -0.650  51.750 -22.120
  313    H4*    A 189           H4*        A 189   0.341  52.307 -24.352
  314    H3*    A 189           H3*        A 189   1.395  53.550 -21.819
  315    H2*    A 189           H2*        A 189   3.171  54.521 -23.067
  316   2HO*    A 189          2HO*        A 189   3.730  53.394 -24.843
  317    H1*    A 189           H1*        A 189   1.437  55.468 -25.075
  318    H8     A 189           H8         A 189  -0.086  55.908 -21.698
  319   1H6     A 189          1H6         A 189   2.975  61.337 -21.361
  320   2H6     A 189          2H6         A 189   1.756  60.346 -20.590
  321    H2     A 189           H2         A 189   4.446  59.131 -24.925
  322   1H5*    G 190          1H5*        G 190   4.551  51.521 -23.942
  323   2H5*    G 190          2H5*        G 190   5.539  50.565 -22.838
  324    H4*    G 190           H4*        G 190   6.991  51.889 -24.190
  325    H3*    G 190           H3*        G 190   6.801  52.761 -21.321
  326    H2*    G 190           H2*        G 190   8.487  54.399 -21.710
  327   2HO*    G 190          2HO*        G 190   9.424  54.341 -23.936
  328    H1*    G 190           H1*        G 190   7.219  55.414 -23.980
  329    H8     G 190           H8         G 190   4.537  54.527 -21.600
  330    H1     G 190           H1         G 190   7.457  60.107 -20.108
  331   1H2     G 190          1H2         G 190   9.172  60.310 -21.236
  332   2H2     G 190          2H2         G 190   9.734  59.143 -22.410
  333   1H5*    C 191          1H5*        C 191  10.756  52.502 -22.086
  334   2H5*    C 191          2H5*        C 191  11.598  51.342 -21.057
  335    H4*    C 191           H4*        C 191  12.910  53.241 -20.892
  336    H3*    C 191           H3*        C 191  11.041  53.111 -18.540
  337    H2*    C 191           H2*        C 191  12.055  55.060 -17.631
  338   2HO*    C 191          2HO*        C 191  14.155  55.186 -18.161
  339    H1*    C 191           H1*        C 191  11.906  56.483 -20.033
  340   1H4     C 191          1H4         C 191   6.561  58.183 -17.003
  341   2H4     C 191          2H4         C 191   5.841  56.636 -17.389
  342    H5     C 191           H5         C 191   6.993  54.885 -18.480
  343    H6     C 191           H6         C 191   9.140  54.180 -19.476
  344   1H5*    G 192          1H5*        G 192  15.198  53.314 -17.031
  345   2H5*    G 192          2H5*        G 192  15.344  52.268 -15.618
  346    H4*    G 192           H4*        G 192  16.140  54.472 -15.077
  347    H3*    G 192           H3*        G 192  13.590  53.623 -13.736
  348    H2*    G 192           H2*        G 192  13.592  55.635 -12.459
  349   2HO*    G 192          2HO*        G 192  15.514  56.799 -12.373
  350    H1*    G 192           H1*        G 192  13.981  57.256 -14.696
  351    H8     G 192           H8         G 192  11.763  54.447 -15.686
  352    H1     G 192           H1         G 192   8.638  59.167 -12.550
  353   1H2     G 192          1H2         G 192  10.007  60.474 -11.730
  354   2H2     G 192          2H2         G 192  11.743  60.313 -11.872
  355   1H5*    G 193          1H5*        G 193  16.035  55.291 -10.904
  356   2H5*    G 193          2H5*        G 193  16.242  54.252  -9.494
  357    H4*    G 193           H4*        G 193  15.618  56.393  -8.699
  358    H3*    G 193           H3*        G 193  13.428  54.348  -8.519
  359    H2*    G 193           H2*        G 193  12.026  55.933  -7.426
  360   2HO*    G 193          2HO*        G 193  13.331  58.160  -7.321
  361    H1*    G 193           H1*        G 193  12.469  57.907  -9.349
  362    H8     G 193           H8         G 193  12.346  54.700 -11.173
  363    H1     G 193           H1         G 193   6.471  56.864  -9.533
  364   1H2     G 193          1H2         G 193   6.659  58.419  -8.191
  365   2H2     G 193          2H2         G 193   8.182  59.043  -7.600
  366   1H5*    A 194          1H5*        A 194  13.534  56.147  -4.724
  367   2H5*    A 194          2H5*        A 194  14.057  54.917  -3.573
  368    H4*    A 194           H4*        A 194  12.267  55.927  -2.504
  369    H3*    A 194           H3*        A 194  11.378  53.390  -3.838
  370    H2*    A 194           H2*        A 194   9.175  53.695  -3.002
  371   2HO*    A 194          2HO*        A 194   9.344  56.043  -1.740
  372    H1*    A 194           H1*        A 194   8.986  56.331  -3.858
  373    H8     A 194           H8         A 194  10.988  54.347  -6.314
  374   1H6     A 194          1H6         A 194   5.568  52.797  -8.992
  375   2H6     A 194          2H6         A 194   7.307  52.730  -9.170
  376    H2     A 194           H2         A 194   4.684  54.862  -5.158
  377   1H5*    C 195          1H5*        C 195  10.244  53.092   0.272
  378   2H5*    C 195          2H5*        C 195  10.319  51.442   0.891
  379    H4*    C 195           H4*        C 195   8.069  52.326   1.064
  380    H3*    C 195           H3*        C 195   8.484  50.045  -0.857
  381    H2*    C 195           H2*        C 195   6.133  49.939  -1.205
  382   2HO*    C 195          2HO*        C 195   5.064  50.507   0.594
  383    H1*    C 195           H1*        C 195   5.915  52.717  -1.593
  384   1H4     C 195          1H4         C 195   6.292  50.219  -7.468
  385   2H4     C 195          2H4         C 195   8.037  50.265  -7.348
  386    H5     C 195           H5         C 195   9.206  50.872  -5.386
  387    H6     C 195           H6         C 195   8.986  51.590  -3.034
  388   1H5*    G 196          1H5*        G 196   5.339  48.280   1.758
  389   2H5*    G 196          2H5*        G 196   6.135  46.797   2.283
  390    H4*    G 196           H4*        G 196   4.040  46.143   1.442
  391    H3*    G 196           H3*        G 196   6.283  45.554  -0.464
  392    H2*    G 196           H2*        G 196   4.752  44.500  -1.956
  393   2HO*    G 196          2HO*        G 196   2.582  44.177  -1.156
  394    H1*    G 196           H1*        G 196   2.965  46.646  -1.901
  395    H8     G 196           H8         G 196   6.408  48.026  -1.807
  396    H1     G 196           H1         G 196   4.532  46.299  -7.755
  397   1H2     G 196          1H2         G 196   2.784  45.212  -7.638
  398   2H2     G 196          2H2         G 196   1.951  44.825  -6.149
  399   1H5*    A 197          1H5*        A 197   8.841  42.137   1.537
  400   2H5*    A 197          2H5*        A 197   9.526  42.526  -0.042
  401    H4*    A 197           H4*        A 197   7.921  40.195   0.822
  402    H3*    A 197           H3*        A 197  10.325  40.706  -0.833
  403    H2*    A 197           H2*        A 197   9.830  39.021  -2.407
  404   2HO*    A 197          2HO*        A 197   7.475  38.265  -1.041
  405    H1*    A 197           H1*        A 197   7.253  39.719  -2.896
  406    H8     A 197           H8         A 197  10.129  40.106  -4.190
  407   1H6     A 197          1H6         A 197   9.644  46.196  -5.469
  408   2H6     A 197          2H6         A 197  10.525  44.734  -5.850
  409    H2     A 197           H2         A 197   6.580  45.168  -2.420
  410   1H5*    U 198          1H5*        U 198  10.901  36.942   2.621
  411   2H5*    U 198          2H5*        U 198  12.604  37.372   2.761
  412    H4*    U 198           H4*        U 198  12.411  35.148   0.989
  413    H3*    U 198           H3*        U 198  10.665  34.885   3.426
  414    H2*    U 198           H2*        U 198  11.482  32.759   3.831
  415   2HO*    U 198          2HO*        U 198  12.466  31.690   1.845
  416    H1*    U 198           H1*        U 198  14.013  33.483   2.435
  417    H3     U 198           H3         U 198  16.001  31.212   5.761
  418    H5     U 198           H5         U 198  13.701  34.048   7.811
  419    H6     U 198           H6         U 198  12.786  34.730   5.641
  420   1H5*    G 199          1H5*        G 199   6.698  35.046  -1.057
  421   2H5*    G 199          2H5*        G 199   6.631  35.948   0.457
  422    H4*    G 199           H4*        G 199   4.697  34.684   0.517
  423    H3*    G 199           H3*        G 199   6.845  33.288   2.091
  424    H2*    G 199           H2*        G 199   5.274  31.615   2.730
  425   2HO*    G 199          2HO*        G 199   3.152  32.190   2.636
  426    H1*    G 199           H1*        G 199   4.387  31.217   0.105
  427    H8     G 199           H8         G 199   8.095  31.869   0.452
  428    H1     G 199           H1         G 199   6.420  25.635   0.922
  429   1H2     G 199          1H2         G 199   4.364  25.477   0.986
  430   2H2     G 199          2H2         G 199   3.260  26.833   0.922
  431   1H5*    A 200          1H5*        A 200   5.821  36.208   6.144
  432   2H5*    A 200          2H5*        A 200   7.409  36.835   5.701
  433    H4*    A 200           H4*        A 200   7.105  35.720   8.002
  434    H3*    A 200           H3*        A 200   9.391  35.217   6.114
  435    H2*    A 200           H2*        A 200  10.409  33.805   7.729
  436   2HO*    A 200          2HO*        A 200   8.586  33.849   9.711
  437    H1*    A 200           H1*        A 200   8.075  32.365   8.244
  438    H8     A 200           H8         A 200   8.320  33.276   4.617
  439   1H6     A 200          1H6         A 200  11.594  28.016   3.862
  440   2H6     A 200          2H6         A 200  10.809  29.332   3.016
  441    H2     A 200           H2         A 200  11.032  28.691   8.218
  442   1H5*    C 201          1H5*        C 201  12.636  37.174   9.276
  443   2H5*    C 201          2H5*        C 201  13.558  35.712   8.928
  444    H4*    C 201           H4*        C 201  10.981  36.031  10.418
  445    H3*    C 201           H3*        C 201  13.643  34.743  10.953
  446    H2*    C 201           H2*        C 201  12.633  33.159  12.362
  447   2HO*    C 201          2HO*        C 201  10.187  34.626  12.085
  448    H1*    C 201           H1*        C 201  10.310  33.028  10.597
  449   1H4     C 201          1H4         C 201  12.920  27.225  10.153
  450   2H4     C 201          2H4         C 201  14.255  27.895   9.244
  451    H5     C 201           H5         C 201  14.545  30.204   8.840
  452    H6     C 201           H6         C 201  13.614  32.461   9.212
  453   1H5*    C 202          1H5*        C 202  12.435  36.104  15.080
  454   2H5*    C 202          2H5*        C 202  13.934  36.198  16.005
  455    H4*    C 202           H4*        C 202  12.316  34.458  16.779
  456    H3*    C 202           H3*        C 202  15.113  33.653  15.965
  457    H2*    C 202           H2*        C 202  14.679  31.498  16.813
  458   2HO*    C 202          2HO*        C 202  13.402  31.510  18.573
  459    H1*    C 202           H1*        C 202  11.983  31.553  15.779
  460   1H4     C 202          1H4         C 202  15.173  27.351  12.161
  461   2H4     C 202          2H4         C 202  15.754  28.681  11.184
  462    H5     C 202           H5         C 202  15.377  30.954  11.702
  463    H6     C 202           H6         C 202  14.340  32.526  13.299
  464   1H5*    C 203          1H5*        C 203  14.997  33.051  20.383
  465   2H5*    C 203          2H5*        C 203  16.649  32.908  20.983
  466    H4*    C 203           H4*        C 203  15.245  30.842  21.181
  467    H3*    C 203           H3*        C 203  17.871  30.770  19.692
  468    H2*    C 203           H2*        C 203  17.679  28.418  19.576
  469   2HO*    C 203          2HO*        C 203  16.383  27.420  21.104
  470    H1*    C 203           H1*        C 203  14.885  28.576  18.958
  471   1H4     C 203          1H4         C 203  17.834  27.071  13.480
  472   2H4     C 203          2H4         C 203  18.099  28.777  13.196
  473    H5     C 203           H5         C 203  17.584  30.468  14.761
  474    H6     C 203           H6         C 203  16.680  30.943  17.011
  475   1H5*    U 204          1H5*        U 204  18.170  28.255  23.358
  476   2H5*    U 204          2H5*        U 204  19.848  28.110  23.877
  477    H4*    U 204           H4*        U 204  18.731  25.941  23.416
  478    H3*    U 204           H3*        U 204  21.228  26.719  21.929
  479    H2*    U 204           H2*        U 204  21.279  24.565  20.916
  480   2HO*    U 204          2HO*        U 204  19.277  23.219  21.731
  481    H1*    U 204           H1*        U 204  18.587  24.675  20.158
  482    H3     U 204           H3         U 204  21.354  25.035  16.464
  483    H5     U 204           H5         U 204  20.631  28.946  17.776
  484    H6     U 204           H6         U 204  19.618  27.978  19.789
  485   1H5*    A 205          1H5*        A 205  23.375  24.308  25.468
  486   2H5*    A 205          2H5*        A 205  25.019  24.911  25.253
  487    H4*    A 205           H4*        A 205  24.518  22.514  24.531
  488    H3*    A 205           H3*        A 205  25.973  24.521  22.825
  489    H2*    A 205           H2*        A 205  26.369  22.835  21.201
  490   2HO*    A 205          2HO*        A 205  25.597  20.622  21.894
  491    H1*    A 205           H1*        A 205  23.717  21.943  21.201
  492    H8     A 205           H8         A 205  23.538  25.605  21.515
  493   1H6     A 205          1H6         A 205  24.338  25.963  15.335
  494   2H6     A 205          2H6         A 205  23.911  26.876  16.764
  495    H2     A 205           H2         A 205  25.169  21.787  16.606
  496   1H5*    G 206          1H5*        G 206  28.162  23.311  20.446
  497   2H5*    G 206          2H5*        G 206  29.779  23.465  21.132
  498    H4*    G 206           H4*        G 206  28.067  25.644  19.929
  499    H3*    G 206           H3*        G 206  30.486  24.161  19.010
  500    H2*    G 206           H2*        G 206  31.450  26.130  18.080
  501   2HO*    G 206          2HO*        G 206  29.282  26.871  17.493
  502    H1*    G 206           H1*        G 206  31.111  27.613  20.417
  503    H8     G 206           H8         G 206  31.955  24.130  21.389
  504    H1     G 206           H1         G 206  37.132  27.609  19.664
  505   1H2     G 206          1H2         G 206  36.516  29.376  18.796
  506   2H2     G 206          2H2         G 206  34.847  29.844  18.569
  507   1H5*    U 207          1H5*        U 207  27.385  24.720  14.808
  508   2H5*    U 207          2H5*        U 207  28.611  24.865  13.548
  509    H4*    U 207           H4*        U 207  26.702  26.554  13.546
  510    H3*    U 207           H3*        U 207  29.608  27.305  13.341
  511    H2*    U 207           H2*        U 207  28.990  29.575  13.018
  512   2HO*    U 207          2HO*        U 207  26.371  29.611  13.151
  513    H1*    U 207           H1*        U 207  27.197  29.591  15.166
  514    H3     U 207           H3         U 207  30.469  32.041  17.030
  515    H5     U 207           H5         U 207  32.249  28.274  16.605
  516    H6     U 207           H6         U 207  30.218  27.556  15.433
  517   1H5*    A 208          1H5*        A 208  29.574  28.582   8.130
  518   2H5*    A 208          2H5*        A 208  27.977  28.214   7.478
  519    H4*    A 208           H4*        A 208  29.603  27.065   6.167
  520    H3*    A 208           H3*        A 208  27.871  25.359   7.898
  521    H2*    A 208           H2*        A 208  28.971  23.375   7.184
  522   2HO*    A 208          2HO*        A 208  30.449  23.583   5.406
  523    H1*    A 208           H1*        A 208  31.526  24.406   7.667
  524    H8     A 208           H8         A 208  28.516  25.071   9.948
  525   1H6     A 208          1H6         A 208  31.009  20.725  13.670
  526   2H6     A 208          2H6         A 208  29.699  21.875  13.512
  527    H2     A 208           H2         A 208  33.511  21.022  10.011
  528   1H5*    G 209          1H5*        G 209  26.586  23.826   4.749
  529   2H5*    G 209          2H5*        G 209  24.893  23.330   4.726
  530    H4*    G 209           H4*        G 209  26.435  21.668   5.745
  531    H3*    G 209           H3*        G 209  24.115  22.775   7.300
  532    H2*    G 209           H2*        G 209  24.611  21.289   9.096
  533   2HO*    G 209          2HO*        G 209  26.487  19.800   8.624
  534    H1*    G 209           H1*        G 209  27.313  21.998   9.154
  535    H8     G 209           H8         G 209  25.332  25.048   8.403
  536    H1     G 209           H1         G 209  25.387  23.540  14.697
  537   1H2     G 209          1H2         G 209  26.184  21.655  14.947
  538   2H2     G 209          2H2         G 209  26.752  20.634  13.645
  539   1H5*    A 210          1H5*        A 210  24.293  18.627   8.377
  540   2H5*    A 210          2H5*        A 210  22.690  18.035   7.943
  541    H4*    A 210           H4*        A 210  23.138  17.403  10.198
  542    H3*    A 210           H3*        A 210  21.101  19.603   9.917
  543    H2*    A 210           H2*        A 210  20.688  19.487  12.253
  544   2HO*    A 210          2HO*        A 210  21.627  17.668  13.387
  545    H1*    A 210           H1*        A 210  23.421  19.482  12.909
  546    H8     A 210           H8         A 210  22.611  21.810  10.077
  547   1H6     A 210          1H6         A 210  21.554  26.164  14.421
  548   2H6     A 210          2H6         A 210  21.713  25.887  12.701
  549    H2     A 210           H2         A 210  22.121  22.264  16.471
  550   1H5*    G 211          1H5*        G 211  18.917  16.192  12.104
  551   2H5*    G 211          2H5*        G 211  17.261  16.378  11.530
  552    H4*    G 211           H4*        G 211  17.546  16.444  14.015
  553    H3*    G 211           H3*        G 211  16.199  18.676  12.520
  554    H2*    G 211           H2*        G 211  15.667  19.733  14.588
  555   2HO*    G 211          2HO*        G 211  16.331  18.459  16.540
  556    H1*    G 211           H1*        G 211  18.279  19.542  15.553
  557    H8     G 211           H8         G 211  18.609  20.238  11.953
  558    H1     G 211           H1         G 211  17.030  25.510  15.358
  559   1H2     G 211          1H2         G 211  16.469  24.957  17.263
  560   2H2     G 211          2H2         G 211  16.431  23.310  17.851
  561   1H5*    G 212          1H5*        G 212  12.671  17.045  15.269
  562   2H5*    G 212          2H5*        G 212  11.331  17.395  14.178
  563    H4*    G 212           H4*        G 212  11.148  18.415  16.455
  564    H3*    G 212           H3*        G 212  11.000  20.084  13.961
  565    H2*    G 212           H2*        G 212  10.510  22.007  15.280
  566   2HO*    G 212          2HO*        G 212  10.096  21.630  17.549
  567    H1*    G 212           H1*        G 212  12.649  21.571  17.018
  568    H8     G 212           H8         G 212  13.888  20.578  13.701
  569    H1     G 212           H1         G 212  13.666  27.006  14.429
  570   1H2     G 212          1H2         G 212  12.586  27.470  16.123
  571   2H2     G 212          2H2         G 212  11.851  26.293  17.188
  572   1H5*    G 213          1H5*        G 213   6.299  19.595  14.585
  573   2H5*    G 213          2H5*        G 213   5.812  19.534  12.892
  574    H4*    G 213           H4*        G 213   4.982  21.521  14.148
  575    H3*    G 213           H3*        G 213   6.629  21.840  11.651
  576    H2*    G 213           H2*        G 213   6.274  24.195  11.734
  577   2HO*    G 213          2HO*        G 213   4.831  24.873  13.598
  578    H1*    G 213           H1*        G 213   7.008  24.371  14.429
  579    H8     G 213           H8         G 213   9.268  21.887  12.909
  580    H1     G 213           H1         G 213  10.930  27.972  11.459
  581   1H2     G 213          1H2         G 213   9.405  29.250  11.998
  582   2H2     G 213          2H2         G 213   7.899  28.748  12.733
  583   1H5*    G 214          1H5*        G 214   5.146  25.006  10.029
  584   2H5*    G 214          2H5*        G 214   4.745  24.339   8.447
  585    H4*    G 214           H4*        G 214   6.702  25.911   8.506
  586    H3*    G 214           H3*        G 214   6.898  23.147   7.344
  587    H2*    G 214           H2*        G 214   9.131  23.598   6.648
  588   2HO*    G 214          2HO*        G 214   8.878  26.189   7.829
  589    H1*    G 214           H1*        G 214   9.910  24.546   9.150
  590    H8     G 214           H8         G 214   7.609  21.795   9.912
  591    H1     G 214           H1         G 214  13.388  19.665   7.926
  592   1H2     G 214          1H2         G 214  14.460  21.232   7.120
  593   2H2     G 214          2H2         G 214  13.879  22.877   7.000
  594   1H5*    G 215          1H5*        G 215   8.572  25.452   3.541
  595   2H5*    G 215          2H5*        G 215   7.090  25.069   2.666
  596    H4*    G 215           H4*        G 215   8.926  24.483   1.275
  597    H3*    G 215           H3*        G 215   7.448  22.145   2.439
  598    H2*    G 215           H2*        G 215   8.827  20.642   1.207
  599   2HO*    G 215          2HO*        G 215   9.435  21.558  -0.664
  600    H1*    G 215           H1*        G 215  11.196  21.814   2.060
  601    H8     G 215           H8         G 215   8.913  22.071   4.940
  602    H1     G 215           H1         G 215  11.326  16.110   4.211
  603   1H2     G 215          1H2         G 215  12.248  15.961   2.372
  604   2H2     G 215          2H2         G 215  12.351  17.257   1.202
  605   1H5*    C 216          1H5*        C 216   5.395  22.263  -1.773
  606   2H5*    C 216          2H5*        C 216   3.996  21.218  -1.535
  607    H4*    C 216           H4*        C 216   6.032  20.246  -2.735
  608    H3*    C 216           H3*        C 216   4.605  18.877  -0.465
  609    H2*    C 216           H2*        C 216   5.977  16.963  -0.791
  610   2HO*    C 216          2HO*        C 216   7.239  18.360  -2.944
  611    H1*    C 216           H1*        C 216   8.342  18.470  -0.895
  612   1H4     C 216          1H4         C 216   7.764  16.451   5.159
  613   2H4     C 216          2H4         C 216   6.943  17.950   5.531
  614    H5     C 216           H5         C 216   6.323  19.548   3.907
  615    H6     C 216           H6         C 216   6.338  20.107   1.501
  616   1H5*    U 217          1H5*        U 217   3.621  15.898  -3.791
  617   2H5*    U 217          2H5*        U 217   2.253  15.025  -3.099
  618    H4*    U 217           H4*        U 217   4.450  13.759  -3.424
  619    H3*    U 217           H3*        U 217   2.839  13.732  -0.883
  620    H2*    U 217           H2*        U 217   4.332  12.110   0.023
  621   2HO*    U 217          2HO*        U 217   5.642  11.007  -1.419
  622    H1*    U 217           H1*        U 217   6.608  13.581  -0.657
  623    H3     U 217           H3         U 217   5.810  13.613   3.920
  624    H5     U 217           H5         U 217   3.998  17.049   2.356
  625    H6     U 217           H6         U 217   4.402  16.125   0.121
  626   1H5*    G 218          1H5*        G 218   0.400   9.263  -2.002
  627   2H5*    G 218          2H5*        G 218   0.707   8.820  -0.323
  628    H4*    G 218           H4*        G 218   1.612   7.040  -1.469
  629    H3*    G 218           H3*        G 218   3.792   9.008  -0.850
  630    H2*    G 218           H2*        G 218   5.388   7.645  -1.918
  631   2HO*    G 218          2HO*        G 218   3.464   5.639  -2.453
  632    H1*    G 218           H1*        G 218   3.568   7.023  -4.063
  633    H8     G 218           H8         G 218   3.682  10.662  -3.652
  634    H1     G 218           H1         G 218   8.885   8.399  -6.767
  635   1H2     G 218          1H2         G 218   8.960   6.347  -6.579
  636   2H2     G 218          2H2         G 218   7.789   5.383  -5.709
  637   1H5*    C 219          1H5*        C 219   2.169   4.305   3.326
  638   2H5*    C 219          2H5*        C 219   0.973   5.382   2.606
  639    H4*    C 219           H4*        C 219   3.366   6.092   4.293
  640    H3*    C 219           H3*        C 219   0.504   5.985   4.782
  641    H2*    C 219           H2*        C 219   0.259   8.253   4.338
  642   2HO*    C 219          2HO*        C 219   0.024   8.426   6.501
  643    H1*    C 219           H1*        C 219   3.183   8.692   5.110
  644   1H4     C 219          1H4         C 219   1.352  14.248   2.385
  645   2H4     C 219          2H4         C 219   1.967  13.578   0.890
  646    H5     C 219           H5         C 219   2.679  11.339   0.646
  647    H6     C 219           H6         C 219   2.978   9.171   1.788
  648   1H5*    G 220          1H5*        G 220   5.067   4.568   7.062
  649   2H5*    G 220          2H5*        G 220   4.682   5.982   6.081
  650    H4*    G 220           H4*        G 220   6.196   3.501   5.287
  651    H3*    G 220           H3*        G 220   6.870   6.446   5.395
  652    H2*    G 220           H2*        G 220   8.408   6.126   3.687
  653   2HO*    G 220          2HO*        G 220   8.199   3.314   4.250
  654    H1*    G 220           H1*        G 220   6.783   3.854   2.676
  655    H8     G 220           H8         G 220   6.907   4.334   0.224
  656    H1     G 220           H1         G 220   6.352  10.725   1.074
  657   1H2     G 220          1H2         G 220   6.225  11.144   3.089
  658   2H2     G 220          2H2         G 220   6.263   9.942   4.359
  659   1H5*    G 221          1H5*        G 221  10.223   5.325   6.189
  660   2H5*    G 221          2H5*        G 221  11.307   6.540   6.868
  661    H4*    G 221           H4*        G 221  10.608   6.368   4.250
  662    H3*    G 221           H3*        G 221  11.557   8.726   5.876
  663    H2*    G 221           H2*        G 221  11.493  10.049   3.908
  664   2HO*    G 221          2HO*        G 221  10.771   8.574   1.949
  665    H1*    G 221           H1*        G 221   8.957   9.074   3.144
  666    H8     G 221           H8         G 221   8.833   9.652   6.777
  667    H1     G 221           H1         G 221   8.353  15.141   3.383
  668   1H2     G 221          1H2         G 221   8.842  14.777   1.413
  669   2H2     G 221          2H2         G 221   9.313  13.218   0.776
  670   1H5*    C 222          1H5*        C 222  15.272   7.895   3.545
  671   2H5*    C 222          2H5*        C 222  16.535   8.928   4.213
  672    H4*    C 222           H4*        C 222  15.142   9.736   2.179
  673    H3*    C 222           H3*        C 222  15.834  11.436   4.579
  674    H2*    C 222           H2*        C 222  14.932  13.299   3.450
  675   2HO*    C 222          2HO*        C 222  14.255  12.462   1.069
  676    H1*    C 222           H1*        C 222  12.746  11.747   2.414
  677   1H4     C 222          1H4         C 222  10.309  15.493   7.004
  678   2H4     C 222          2H4         C 222  10.702  14.248   8.167
  679    H5     C 222           H5         C 222  11.932  12.300   7.647
  680    H6     C 222           H6         C 222  13.099  11.055   5.862
  681   1H5*    U 223          1H5*        U 223  16.196  14.295   1.889
  682   2H5*    U 223          2H5*        U 223  17.871  14.830   2.014
  683    H4*    U 223           H4*        U 223  16.451  16.713   2.378
  684    H3*    U 223           H3*        U 223  17.873  15.712   4.830
  685    H2*    U 223           H2*        U 223  16.892  17.371   6.141
  686   2HO*    U 223          2HO*        U 223  16.125  19.276   5.027
  687    H1*    U 223           H1*        U 223  14.448  17.292   4.520
  688    H3     U 223           H3         U 223  12.897  17.151   8.804
  689    H5     U 223           H5         U 223  14.576  13.366   8.167
  690    H6     U 223           H6         U 223  15.447  14.221   6.040
  691   1H5*    U 224          1H5*        U 224  19.678  14.900   1.188
  692   2H5*    U 224          2H5*        U 224  20.808  15.789   0.167
  693    H4*    U 224           H4*        U 224  18.817  15.387  -1.085
  694    H3*    U 224           H3*        U 224  19.125  18.264  -0.221
  695    H2*    U 224           H2*        U 224  17.281  18.817  -1.597
  696   2HO*    U 224          2HO*        U 224  16.669  16.397  -2.640
  697    H1*    U 224           H1*        U 224  15.808  16.526  -0.743
  698    H3     U 224           H3         U 224  13.011  19.219   1.443
  699    H5     U 224           H5         U 224  16.745  20.760   2.548
  700    H6     U 224           H6         U 224  17.764  19.040   1.130
  701   1H5*    A 225          1H5*        A 225  20.802  18.958  -4.566
  702   2H5*    A 225          2H5*        A 225  20.921  20.716  -4.510
  703    H4*    A 225           H4*        A 225  18.840  19.435  -5.572
  704    H3*    A 225           H3*        A 225  18.856  22.078  -4.110
  705    H2*    A 225           H2*        A 225  16.564  22.324  -4.651
  706   2HO*    A 225          2HO*        A 225  15.748  20.532  -6.144
  707    H1*    A 225           H1*        A 225  15.973  19.627  -3.991
  708    H8     A 225           H8         A 225  18.199  21.222  -1.457
  709   1H6     A 225          1H6         A 225  13.018  23.286   1.346
  710   2H6     A 225          2H6         A 225  14.753  23.123   1.513
  711    H2     A 225           H2         A 225  11.879  21.566  -2.590
  712   1H5*    G 226          1H5*        G 226  16.923  22.274  -7.930
  713   2H5*    G 226          2H5*        G 226  16.966  23.889  -8.636
  714    H4*    G 226           H4*        G 226  14.679  23.059  -8.331
  715    H3*    G 226           H3*        G 226  15.531  25.524  -6.832
  716    H2*    G 226           H2*        G 226  13.293  25.810  -6.064
  717   2HO*    G 226          2HO*        G 226  11.728  24.858  -7.277
  718    H1*    G 226           H1*        G 226  13.077  23.147  -5.225
  719    H8     G 226           H8         G 226  16.507  24.350  -4.467
  720    H1     G 226           H1         G 226  12.127  26.249  -0.099
  721   1H2     G 226          1H2         G 226  10.232  25.852  -0.807
  722   2H2     G 226          2H2         G 226   9.881  25.115  -2.354
  723   1H5*    G 227          1H5*        G 227  14.589  24.553 -11.465
  724   2H5*    G 227          2H5*        G 227  16.197  24.456 -10.747
  725    H4*    G 227           H4*        G 227  16.140  24.236 -13.231
  726    H3*    G 227           H3*        G 227  17.810  26.330 -11.877
  727    H2*    G 227           H2*        G 227  18.706  26.992 -13.983
  728   2HO*    G 227          2HO*        G 227  17.380  25.487 -15.721
  729    H1*    G 227           H1*        G 227  16.201  27.224 -15.179
  730    H8     G 227           H8         G 227  16.591  28.209 -11.514
  731    H1     G 227           H1         G 227  17.152  33.077 -15.741
  732   1H2     G 227          1H2         G 227  17.107  32.330 -17.663
  733   2H2     G 227          2H2         G 227  16.942  30.637 -18.068
  734   1H5*    A 228          1H5*        A 228  20.174  24.346 -15.041
  735   2H5*    A 228          2H5*        A 228  21.855  24.390 -14.510
  736    H4*    A 228           H4*        A 228  21.450  25.534 -16.671
  737    H3*    A 228           H3*        A 228  22.580  27.094 -14.352
  738    H2*    A 228           H2*        A 228  22.924  28.939 -15.805
  739   2HO*    A 228          2HO*        A 228  22.540  28.493 -18.121
  740    H1*    A 228           H1*        A 228  20.350  28.701 -16.950
  741    H8     A 228           H8         A 228  20.119  28.222 -13.279
  742   1H6     A 228          1H6         A 228  19.863  34.436 -12.750
  743   2H6     A 228          2H6         A 228  19.673  32.930 -11.881
  744    H2     A 228           H2         A 228  20.948  33.441 -16.943
  745   1H5*    G 229          1H5*        G 229  25.731  27.038 -17.702
  746   2H5*    G 229          2H5*        G 229  27.283  27.093 -16.865
  747    H4*    G 229           H4*        G 229  27.039  28.861 -18.560
  748    H3*    G 229           H3*        G 229  27.456  29.613 -15.683
  749    H2*    G 229           H2*        G 229  27.583  31.912 -16.299
  750   2HO*    G 229          2HO*        G 229  27.025  31.449 -18.995
  751    H1*    G 229           H1*        G 229  25.231  31.815 -17.799
  752    H8     G 229           H8         G 229  24.605  29.627 -14.912
  753    H1     G 229           H1         G 229  24.261  35.903 -13.365
  754   1H2     G 229          1H2         G 229  25.026  37.035 -14.909
  755   2H2     G 229          2H2         G 229  25.666  36.382 -16.401
  756   1H5*    G 230          1H5*        G 230  30.845  31.643 -17.923
  757   2H5*    G 230          2H5*        G 230  32.228  31.409 -16.854
  758    H4*    G 230           H4*        G 230  31.916  33.760 -17.433
  759    H3*    G 230           H3*        G 230  31.625  32.947 -14.557
  760    H2*    G 230           H2*        G 230  31.353  35.231 -13.934
  761   2HO*    G 230          2HO*        G 230  31.917  36.799 -15.464
  762    H1*    G 230           H1*        G 230  29.393  35.702 -15.862
  763    H8     G 230           H8         G 230  28.754  32.284 -14.670
  764    H1     G 230           H1         G 230  26.755  36.774 -10.460
  765   1H2     G 230          1H2         G 230  27.516  38.612 -11.001
  766   2H2     G 230          2H2         G 230  28.544  38.895 -12.388
  767   1H5*    G 231          1H5*        G 231  34.808  36.408 -14.449
  768   2H5*    G 231          2H5*        G 231  35.919  35.648 -13.311
  769    H4*    G 231           H4*        G 231  35.268  37.915 -12.629
  770    H3*    G 231           H3*        G 231  34.588  35.593 -10.850
  771    H2*    G 231           H2*        G 231  33.744  37.096  -9.204
  772   2HO*    G 231          2HO*        G 231  34.419  39.202  -9.338
  773    H1*    G 231           H1*        G 231  32.147  38.473 -11.034
  774    H8     G 231           H8         G 231  32.016  34.938 -12.065
  775    H1     G 231           H1         G 231  28.288  36.156  -6.918
  776   1H2     G 231          1H2         G 231  28.735  38.025  -6.170
  777   2H2     G 231          2H2         G 231  29.940  39.102  -6.840
  778   1H5*    C 232          1H5*        C 232  36.521  38.390  -8.580
  779   2H5*    C 232          2H5*        C 232  37.832  37.782  -7.568
  780    H4*    C 232           H4*        C 232  36.370  38.990  -6.154
  781    H3*    C 232           H3*        C 232  36.187  36.013  -5.827
  782    H2*    C 232           H2*        C 232  34.594  36.268  -4.088
  783   2HO*    C 232          2HO*        C 232  34.854  38.108  -2.962
  784    H1*    C 232           H1*        C 232  33.075  38.147  -5.557
  785   1H4     C 232          1H4         C 232  30.019  32.604  -6.396
  786   2H4     C 232          2H4         C 232  31.182  32.162  -7.627
  787    H5     C 232           H5         C 232  33.089  33.448  -8.159
  788    H6     C 232           H6         C 232  34.364  35.497  -7.635
  789   1H5*    A 233          1H5*        A 233  36.801  37.819  -1.912
  790   2H5*    A 233          2H5*        A 233  38.191  37.033  -1.163
  791    H4*    A 233           H4*        A 233  36.526  37.082   0.489
  792    H3*    A 233           H3*        A 233  36.851  34.375  -0.752
  793    H2*    A 233           H2*        A 233  35.167  33.473   0.662
  794   2HO*    A 233          2HO*        A 233  34.428  34.832   2.402
  795    H1*    A 233           H1*        A 233  33.347  35.525   0.117
  796    H8     A 233           H8         A 233  35.225  34.703  -2.991
  797   1H6     A 233          1H6         A 233  31.057  30.159  -3.961
  798   2H6     A 233          2H6         A 233  32.380  31.046  -4.683
  799    H2     A 233           H2         A 233  30.434  31.767   0.135
  800   1H5*    G 234          1H5*        G 234  36.674  34.017   3.371
  801   2H5*    G 234          2H5*        G 234  38.059  33.173   4.059
  802    H4*    G 234           H4*        G 234  36.195  32.184   5.061
  803    H3*    G 234           H3*        G 234  37.283  30.477   2.842
  804    H2*    G 234           H2*        G 234  35.677  28.791   3.347
  805   2HO*    G 234          2HO*        G 234  34.258  29.377   5.264
  806    H1*    G 234           H1*        G 234  33.538  30.583   3.340
  807    H8     G 234           H8         G 234  36.005  31.546   0.707
  808    H1     G 234           H1         G 234  31.941  26.865  -1.152
  809   1H2     G 234          1H2         G 234  30.876  26.190   0.480
  810   2H2     G 234          2H2         G 234  31.057  26.801   2.109
  811   1H    GLY  15          1H        GLY  15   6.631  -2.084  -3.759
  812   1HA   GLY  15          1HA       GLY  15   5.122  -1.265  -1.440
  813   2HA   GLY  15          2HA       GLY  15   6.700  -2.038  -1.442
  814    H    ARG  16           H        ARG  16   8.557  -0.788  -1.457
  815    HA   ARG  16           HA       ARG  16   8.339   1.773  -0.268
  816   1HB   ARG  16          2HB       ARG  16  10.560   0.039  -1.223
  817   2HB   ARG  16          3HB       ARG  16  10.907   1.750  -1.008
  818   1HG   ARG  16          2HG       ARG  16  10.725   1.648   1.251
  819   2HG   ARG  16          3HG       ARG  16   9.516   0.364   1.206
  820   1HD   ARG  16          2HD       ARG  16  11.081  -1.293   1.104
  821   2HD   ARG  16          3HD       ARG  16  12.253  -0.282   0.258
  822    HE   ARG  16           HE       ARG  16  11.857   0.643   2.906
  823   1HH1  ARG  16          2HH1      ARG  16  13.394  -1.888   1.077
  824   2HH1  ARG  16          1HH1      ARG  16  14.638  -2.162   2.253
  825   1HH2  ARG  16          2HH2      ARG  16  13.488   0.292   4.462
  826   2HH2  ARG  16          1HH2      ARG  16  14.690  -0.921   4.177
  827    H    ALA  17           H        ALA  17   9.852   0.898  -3.382
  828    HA   ALA  17           HA       ALA  17   9.909   1.971  -5.393
  829   1HB   ALA  17          1HB       ALA  17   8.120   3.303  -6.069
  830   2HB   ALA  17          2HB       ALA  17   7.413   2.230  -4.861
  831   3HB   ALA  17          3HB       ALA  17   7.819   3.892  -4.434
  832    H    ARG  18           H        ARG  18  10.987   3.119  -2.619
  833    HA   ARG  18           HA       ARG  18  11.440   5.867  -3.055
  834   1HB   ARG  18          2HB       ARG  18  11.704   4.517  -0.887
  835   2HB   ARG  18          3HB       ARG  18  13.289   4.070  -1.503
  836   1HG   ARG  18          2HG       ARG  18  12.622   6.952  -1.471
  837   2HG   ARG  18          3HG       ARG  18  12.898   6.165   0.084
  838   1HD   ARG  18          2HD       ARG  18  14.998   5.196  -1.235
  839   2HD   ARG  18          3HD       ARG  18  14.777   6.686  -2.151
  840    HE   ARG  18           HE       ARG  18  14.713   7.362   0.541
  841   1HH1  ARG  18          2HH1      ARG  18  16.967   6.016  -1.745
  842   2HH1  ARG  18          1HH1      ARG  18  18.364   6.651  -0.939
  843   1HH2  ARG  18          2HH2      ARG  18  16.544   8.203   1.611
  844   2HH2  ARG  18          1HH2      ARG  18  18.121   7.894   0.969
  845    H    GLY  19           H        GLY  19  12.112   6.099  -5.219
  846   1HA   GLY  19          1HA       GLY  19  14.716   6.529  -5.771
  847   2HA   GLY  19          2HA       GLY  19  14.550   4.812  -6.106
  848    H    LEU  20           H        LEU  20  11.647   5.502  -6.898
  849    HA   LEU  20           HA       LEU  20  12.320   6.391  -9.624
  850   1HB   LEU  20          2HB       LEU  20  10.520   4.295  -8.563
  851   2HB   LEU  20          3HB       LEU  20   9.955   5.188  -9.974
  852    HG   LEU  20           HG       LEU  20  12.697   4.101 -10.138
  853   1HD1  LEU  20          1HD1      LEU  20  10.532   2.155 -10.689
  854   2HD1  LEU  20          2HD1      LEU  20  11.009   2.389  -9.007
  855   3HD1  LEU  20          3HD1      LEU  20  12.205   1.886 -10.201
  856   1HD2  LEU  20          1HD2      LEU  20  10.730   5.127 -11.862
  857   2HD2  LEU  20          2HD2      LEU  20  10.905   3.420 -12.268
  858   3HD2  LEU  20          3HD2      LEU  20  12.314   4.481 -12.290
  859    H    CYS  21           H        CYS  21  11.712   8.496  -9.998
  860    HA   CYS  21           HA       CYS  21   9.983   9.889  -8.384
  861   1HB   CYS  21          2HB       CYS  21  11.547  11.000  -9.875
  862   2HB   CYS  21          3HB       CYS  21  10.722  10.370 -11.287
  863    H    TYR  22           H        TYR  22   7.803  10.249  -8.451
  864    HA   TYR  22           HA       TYR  22   6.219   8.496 -10.200
  865   1HB   TYR  22          2HB       TYR  22   6.009   8.196  -7.721
  866   2HB   TYR  22          3HB       TYR  22   5.352   9.825  -7.625
  867    HD1  TYR  22           HD1      TYR  22   4.663   7.271 -10.232
  868    HD2  TYR  22           HD2      TYR  22   3.160   9.423  -6.884
  869    HE1  TYR  22           HE1      TYR  22   2.413   6.383 -10.678
  870    HE2  TYR  22           HE2      TYR  22   0.906   8.541  -7.320
  871    HH   TYR  22           HH       TYR  22  -0.085   6.515  -8.474
  872    H    THR  23           H        THR  23   7.204  10.907 -11.244
  873    HA   THR  23           HA       THR  23   4.676  12.292 -11.769
  874    HB   THR  23           HB       THR  23   7.265  13.682 -11.062
  875    HG1  THR  23           HG1      THR  23   4.751  13.379  -9.813
  876   1HG2  THR  23          1HG2      THR  23   4.710  14.728 -12.261
  877   2HG2  THR  23          2HG2      THR  23   6.363  14.945 -12.839
  878   3HG2  THR  23          3HG2      THR  23   5.828  15.763 -11.373
  879    H    CYS  24           H        CYS  24   8.175  12.011 -12.722
  880    HA   CYS  24           HA       CYS  24   7.260  12.454 -15.468
  881   1HB   CYS  24          2HB       CYS  24   9.552  13.141 -15.988
  882   2HB   CYS  24          3HB       CYS  24   8.870  14.132 -14.715
  883    H    GLY  25           H        GLY  25   9.109  10.473 -13.227
  884   1HA   GLY  25          1HA       GLY  25   9.096   8.069 -13.447
  885   2HA   GLY  25          2HA       GLY  25   9.084   8.276 -15.193
  886    H    SER  26           H        SER  26  11.160  10.126 -13.066
  887    HA   SER  26           HA       SER  26  13.480   8.909 -14.379
  888   1HB   SER  26          2HB       SER  26  13.039  11.466 -14.254
  889   2HB   SER  26          3HB       SER  26  13.600  11.322 -12.588
  890    HG   SER  26           HG       SER  26  15.437  10.111 -13.751
  891    HA   PRO  27           HA       PRO  27  14.159   6.602 -10.620
  892   1HB   PRO  27          2HB       PRO  27  16.399   5.339 -11.489
  893   2HB   PRO  27          3HB       PRO  27  14.772   4.857 -11.983
  894   1HG   PRO  27          2HG       PRO  27  16.777   6.530 -13.445
  895   2HG   PRO  27          3HG       PRO  27  15.730   5.240 -14.066
  896   1HD   PRO  27          2HD       PRO  27  15.154   7.866 -14.390
  897   2HD   PRO  27          3HD       PRO  27  13.894   6.627 -14.212
  898    H    GLY  28           H        GLY  28  14.687   8.403  -9.293
  899   1HA   GLY  28          1HA       GLY  28  17.205   8.455  -8.189
  900   2HA   GLY  28          2HA       GLY  28  17.240   9.687  -9.442
  901    H    HIS  29           H        HIS  29  15.349  11.260  -9.352
  902    HA   HIS  29           HA       HIS  29  15.175  12.243  -6.621
  903   1HB   HIS  29          2HB       HIS  29  14.387  14.307  -7.588
  904   2HB   HIS  29          3HB       HIS  29  15.779  13.755  -8.516
  905    HD1  HIS  29           HD1      HIS  29  15.466  13.623 -10.976
  906    HD2  HIS  29           HD2      HIS  29  11.844  13.689  -8.942
  907    HE1  HIS  29           HE1      HIS  29  13.697  13.764 -12.757
  908    H    TYR  30           H        TYR  30  12.999  13.331  -6.052
  909    HA   TYR  30           HA       TYR  30  10.855  11.397  -6.634
  910   1HB   TYR  30          2HB       TYR  30  11.891  12.418  -4.154
  911   2HB   TYR  30          3HB       TYR  30  10.195  12.863  -4.313
  912    HD1  TYR  30           HD1      TYR  30  12.367   9.866  -4.876
  913    HD2  TYR  30           HD2      TYR  30   8.654  11.383  -3.455
  914    HE1  TYR  30           HE1      TYR  30  11.715   7.600  -4.178
  915    HE2  TYR  30           HE2      TYR  30   7.992   9.121  -2.752
  916    HH   TYR  30           HH       TYR  30   9.259   6.954  -2.089
  917    H    GLN  31           H        GLN  31   8.612  12.421  -6.167
  918    HA   GLN  31           HA       GLN  31   8.031  14.281  -8.110
  919   1HB   GLN  31          2HB       GLN  31   6.272  12.967  -7.162
  920   2HB   GLN  31          3HB       GLN  31   6.560  13.626  -5.558
  921   1HG   GLN  31          2HG       GLN  31   5.673  15.731  -6.158
  922   2HG   GLN  31          3HG       GLN  31   5.667  15.316  -7.872
  923   1HE2  GLN  31          1HE2      GLN  31   3.704  14.998  -8.604
  924   2HE2  GLN  31          2HE2      GLN  31   2.400  14.253  -7.751
  925    H    ALA  32           H        ALA  32   8.737  14.842  -4.690
  926    HA   ALA  32           HA       ALA  32   8.192  17.591  -4.624
  927   1HB   ALA  32          1HB       ALA  32   9.229  17.627  -2.544
  928   2HB   ALA  32          2HB       ALA  32   8.675  15.958  -2.691
  929   3HB   ALA  32          3HB       ALA  32  10.369  16.354  -2.981
  930    H    GLN  33           H        GLN  33  10.948  15.806  -5.797
  931    HA   GLN  33           HA       GLN  33  12.360  18.334  -6.319
  932   1HB   GLN  33          2HB       GLN  33  13.311  15.535  -5.841
  933   2HB   GLN  33          3HB       GLN  33  14.309  16.645  -6.772
  934   1HG   GLN  33          2HG       GLN  33  15.131  17.399  -4.865
  935   2HG   GLN  33          3HG       GLN  33  13.544  18.075  -4.505
  936   1HE2  GLN  33          1HE2      GLN  33  12.449  17.300  -2.821
  937   2HE2  GLN  33          2HE2      GLN  33  12.896  15.913  -1.894
  938    H    CYS  34           H        CYS  34  10.114  16.821  -7.914
  939    HA   CYS  34           HA       CYS  34  11.457  15.978 -10.267
  940   1HB   CYS  34          2HB       CYS  34   9.219  15.125  -9.515
  941   2HB   CYS  34          3HB       CYS  34   8.526  16.682  -9.917
  942    HA   PRO  35           HA       PRO  35  12.153  20.123 -11.772
  943   1HB   PRO  35          2HB       PRO  35  13.067  19.385 -14.220
  944   2HB   PRO  35          3HB       PRO  35  14.043  19.256 -12.750
  945   1HG   PRO  35          2HG       PRO  35  12.488  17.138 -14.186
  946   2HG   PRO  35          3HG       PRO  35  14.112  17.049 -13.479
  947   1HD   PRO  35          2HD       PRO  35  11.925  16.055 -12.231
  948   2HD   PRO  35          3HD       PRO  35  13.303  16.737 -11.344
  949    H    LYS  36           H        LYS  36   9.926  17.829 -12.984
  950    HA   LYS  36           HA       LYS  36   8.850  19.697 -14.968
  951   1HB   LYS  36          2HB       LYS  36   9.223  17.060 -15.206
  952   2HB   LYS  36          3HB       LYS  36   7.608  17.032 -14.513
  953   1HG   LYS  36          2HG       LYS  36   6.653  18.028 -16.348
  954   2HG   LYS  36          3HG       LYS  36   8.158  18.809 -16.841
  955   1HD   LYS  36          2HD       LYS  36   9.060  16.680 -17.567
  956   2HD   LYS  36          3HD       LYS  36   7.621  15.841 -16.983
  957   1HE   LYS  36          2HE       LYS  36   7.013  18.025 -18.815
  958   2HE   LYS  36          3HE       LYS  36   8.026  16.778 -19.540
  959   1HZ   LYS  36          1HZ       LYS  36   6.321  15.164 -18.576
  960   2HZ   LYS  36          2HZ       LYS  36   5.866  16.064 -19.934
  961   3HZ   LYS  36          3HZ       LYS  36   5.315  16.512 -18.398
  962    H    LYS  37           H        LYS  37   8.540  19.197 -11.767
  963    HA   LYS  37           HA       LYS  37   5.647  19.391 -11.600
  964   1HB   LYS  37          2HB       LYS  37   7.716  18.514  -9.873
  965   2HB   LYS  37          3HB       LYS  37   6.941  19.885  -9.091
  966   1HG   LYS  37          2HG       LYS  37   5.327  17.631 -10.224
  967   2HG   LYS  37          3HG       LYS  37   6.039  17.536  -8.612
  968   1HD   LYS  37          2HD       LYS  37   4.900  19.766  -8.152
  969   2HD   LYS  37          3HD       LYS  37   3.991  19.486  -9.638
  970   1HE   LYS  37          2HE       LYS  37   2.989  17.527  -8.761
  971   2HE   LYS  37          3HE       LYS  37   4.101  17.484  -7.394
  972   1HZ   LYS  37          1HZ       LYS  37   1.653  18.958  -7.718
  973   2HZ   LYS  37          2HZ       LYS  37   2.930  19.906  -7.142
  974   3HZ   LYS  37          3HZ       LYS  37   2.466  18.510  -6.304
  975    H    ARG  38           H        ARG  38   4.711  21.291 -11.946
  976    HA   ARG  38           HA       ARG  38   5.534  23.616 -10.470
  977   1HB   ARG  38          2HB       ARG  38   5.901  25.069 -12.392
  978   2HB   ARG  38          3HB       ARG  38   7.053  23.741 -12.398
  979   1HG   ARG  38          2HG       ARG  38   5.575  22.570 -14.036
  980   2HG   ARG  38          3HG       ARG  38   4.611  24.045 -14.123
  981   1HD   ARG  38          2HD       ARG  38   6.002  24.532 -15.829
  982   2HD   ARG  38          3HD       ARG  38   7.066  25.066 -14.529
  983    HE   ARG  38           HE       ARG  38   7.646  22.417 -14.843
  984   1HH1  ARG  38          2HH1      ARG  38   7.594  25.193 -16.944
  985   2HH1  ARG  38          1HH1      ARG  38   8.855  24.601 -17.974
  986   1HH2  ARG  38          2HH2      ARG  38   9.308  21.626 -16.191
  987   2HH2  ARG  38          1HH2      ARG  38   9.828  22.571 -17.544
  988    H    LYS  39           H        LYS  39   3.201  22.063 -10.476
  989    HA   LYS  39           HA       LYS  39   0.932  22.210 -10.582
  990   1HB   LYS  39          2HB       LYS  39   1.898  24.649  -9.707
  991   2HB   LYS  39          3HB       LYS  39   0.796  25.099 -11.002
  992   1HG   LYS  39          2HG       LYS  39  -1.044  24.384  -9.878
  993   2HG   LYS  39          3HG       LYS  39  -0.164  23.125  -9.011
  994   1HD   LYS  39          2HD       LYS  39   0.492  25.968  -8.424
  995   2HD   LYS  39          3HD       LYS  39  -1.017  25.308  -7.788
  996   1HE   LYS  39          2HE       LYS  39   1.021  23.401  -7.313
  997   2HE   LYS  39          3HE       LYS  39   1.640  24.973  -6.809
  998   1HZ   LYS  39          1HZ       LYS  39  -0.912  23.739  -5.920
  999   2HZ   LYS  39          2HZ       LYS  39  -0.355  25.268  -5.458
 1000   3HZ   LYS  39          3HZ       LYS  39   0.500  23.883  -4.997
 1001    H    SER  40           H        SER  40  -0.862  23.757 -11.897
 1002    HA   SER  40           HA       SER  40  -0.280  23.099 -14.691
 1003   1HB   SER  40          2HB       SER  40  -2.695  23.201 -15.041
 1004   2HB   SER  40          3HB       SER  40  -2.329  22.148 -13.674
 1005    HG   SER  40           HG       SER  40  -3.866  24.326 -13.728
 1006    H    GLY  41           H        GLY  41  -1.300  25.768 -12.623
 1007   1HA   GLY  41          1HA       GLY  41  -1.045  28.041 -12.950
 1008   2HA   GLY  41          2HA       GLY  41  -0.235  27.689 -14.468
 1009    H    ASN  42           H        ASN  42  -2.149  29.775 -13.976
 1010    HA   ASN  42           HA       ASN  42  -4.044  29.096 -16.083
 1011   1HB   ASN  42          2HB       ASN  42  -5.044  28.705 -13.713
 1012   2HB   ASN  42          3HB       ASN  42  -5.100  30.463 -13.626
 1013   1HD2  ASN  42          1HD2      ASN  42  -6.985  31.270 -14.147
 1014   2HD2  ASN  42          2HD2      ASN  42  -8.092  30.622 -15.304
 1015    H    SER  43           H        SER  43  -1.999  30.617 -16.644
 1016    HA   SER  43           HA       SER  43  -1.354  32.631 -17.482
 1017   1HB   SER  43          2HB       SER  43  -4.178  33.612 -17.103
 1018   2HB   SER  43          3HB       SER  43  -3.013  34.075 -18.343
 1019    HG   SER  43           HG       SER  43  -3.362  32.201 -19.392
 1020    H    ARG  44           H        ARG  44  -0.417  32.539 -15.139
 1021    HA   ARG  44           HA       ARG  44  -1.280  34.977 -13.727
 1022   1HB   ARG  44          2HB       ARG  44  -1.163  32.399 -12.715
 1023   2HB   ARG  44          3HB       ARG  44   0.330  33.132 -12.145
 1024   1HG   ARG  44          2HG       ARG  44  -0.843  34.849 -11.007
 1025   2HG   ARG  44          3HG       ARG  44  -2.366  34.408 -11.781
 1026   1HD   ARG  44          2HD       ARG  44  -0.807  32.698  -9.846
 1027   2HD   ARG  44          3HD       ARG  44  -2.261  33.618  -9.465
 1028    HE   ARG  44           HE       ARG  44  -2.740  31.856 -11.626
 1029   1HH1  ARG  44          2HH1      ARG  44  -2.302  31.909  -8.173
 1030   2HH1  ARG  44          1HH1      ARG  44  -3.249  30.484  -7.899
 1031   1HH2  ARG  44          2HH2      ARG  44  -3.990  29.979 -11.279
 1032   2HH2  ARG  44          1HH2      ARG  44  -4.208  29.387  -9.668
 1033    H    GLU  45           H        GLU  45   0.774  35.462 -12.086
 1034    HA   GLU  45           HA       GLU  45   3.041  35.866 -13.925
 1035   1HB   GLU  45          2HB       GLU  45   1.787  37.593 -11.846
 1036   2HB   GLU  45          3HB       GLU  45   3.523  37.729 -12.088
 1037   1HG   GLU  45          2HG       GLU  45   2.982  38.034 -14.560
 1038   2HG   GLU  45          3HG       GLU  45   1.318  38.284 -14.038
 1039    H    ARG  46           H        ARG  46   4.675  34.545 -13.498
 1040    HA   ARG  46           HA       ARG  46   5.126  33.671 -10.733
 1041   1HB   ARG  46          2HB       ARG  46   4.908  32.096 -12.834
 1042   2HB   ARG  46          3HB       ARG  46   6.599  32.520 -13.067
 1043   1HG   ARG  46          2HG       ARG  46   7.262  31.486 -11.098
 1044   2HG   ARG  46          3HG       ARG  46   5.630  31.506 -10.424
 1045   1HD   ARG  46          2HD       ARG  46   5.913  29.284 -11.027
 1046   2HD   ARG  46          3HD       ARG  46   5.044  29.957 -12.405
 1047    HE   ARG  46           HE       ARG  46   7.870  30.069 -12.766
 1048   1HH1  ARG  46          2HH1      ARG  46   5.103  27.963 -12.940
 1049   2HH1  ARG  46          1HH1      ARG  46   5.816  26.908 -14.115
 1050   1HH2  ARG  46          2HH2      ARG  46   8.820  28.687 -14.313
 1051   2HH2  ARG  46          1HH2      ARG  46   7.931  27.321 -14.894
 1052    H    CYS  47           H        CYS  47   7.618  33.227 -10.231
 1053    HA   CYS  47           HA       CYS  47   9.081  35.553 -11.249
 1054   1HB   CYS  47          2HB       CYS  47   8.338  35.934  -8.924
 1055   2HB   CYS  47          3HB       CYS  47   9.143  34.462  -8.415
 1056    H    GLN  48           H        GLN  48  10.767  34.865 -12.377
 1057    HA   GLN  48           HA       GLN  48  11.799  32.157 -12.009
 1058   1HB   GLN  48          2HB       GLN  48  11.299  33.696 -14.266
 1059   2HB   GLN  48          3HB       GLN  48  13.051  33.728 -14.116
 1060   1HG   GLN  48          2HG       GLN  48  12.838  31.169 -13.842
 1061   2HG   GLN  48          3HG       GLN  48  11.236  31.394 -14.542
 1062   1HE2  GLN  48          1HE2      GLN  48  11.260  30.874 -16.600
 1063   2HE2  GLN  48          2HE2      GLN  48  12.500  31.262 -17.738
 1064    H    LEU  49           H        LEU  49  12.366  34.312 -10.096
 1065    HA   LEU  49           HA       LEU  49  15.301  34.307 -10.323
 1066   1HB   LEU  49          2HB       LEU  49  13.547  36.535 -10.186
 1067   2HB   LEU  49          3HB       LEU  49  14.449  36.460  -8.674
 1068    HG   LEU  49           HG       LEU  49  16.066  36.189 -11.122
 1069   1HD1  LEU  49          1HD1      LEU  49  14.231  38.437 -10.727
 1070   2HD1  LEU  49          2HD1      LEU  49  15.087  37.906 -12.174
 1071   3HD1  LEU  49          3HD1      LEU  49  15.914  38.900 -10.975
 1072   1HD2  LEU  49          1HD2      LEU  49  16.259  37.673  -8.512
 1073   2HD2  LEU  49          2HD2      LEU  49  17.436  37.863  -9.812
 1074   3HD2  LEU  49          3HD2      LEU  49  17.205  36.286  -9.054
 1075    H    CYS  50           H        CYS  50  12.427  34.174  -8.171
 1076    HA   CYS  50           HA       CYS  50  14.207  32.976  -6.182
 1077   1HB   CYS  50          2HB       CYS  50  13.221  34.133  -4.393
 1078   2HB   CYS  50          3HB       CYS  50  13.492  35.364  -5.608
 1079    H    ASN  51           H        ASN  51  12.194  32.250  -8.410
 1080    HA   ASN  51           HA       ASN  51  10.643  30.642  -8.833
 1081   1HB   ASN  51          2HB       ASN  51  12.355  29.552  -7.004
 1082   2HB   ASN  51          3HB       ASN  51  10.807  29.361  -6.186
 1083   1HD2  ASN  51          1HD2      ASN  51  12.071  29.036  -9.489
 1084   2HD2  ASN  51          2HD2      ASN  51  11.336  27.503  -9.799
 1085    H    GLY  52           H        GLY  52   9.988  33.140  -7.221
 1086   1HA   GLY  52          1HA       GLY  52   7.900  32.526  -5.416
 1087   2HA   GLY  52          2HA       GLY  52   8.155  34.076  -6.204
 1088    H    MET  53           H        MET  53   5.620  32.962  -5.680
 1089    HA   MET  53           HA       MET  53   4.667  32.530  -8.433
 1090   1HB   MET  53          2HB       MET  53   3.921  31.103  -5.907
 1091   2HB   MET  53          3HB       MET  53   2.738  31.264  -7.197
 1092   1HG   MET  53          2HG       MET  53   3.859  29.864  -8.598
 1093   2HG   MET  53          3HG       MET  53   5.431  30.248  -7.902
 1094   1HE   MET  53          1HE       MET  53   1.986  28.222  -6.336
 1095   2HE   MET  53          2HE       MET  53   2.382  28.349  -8.050
 1096   3HE   MET  53          3HE       MET  53   2.711  26.851  -7.177
 1097    H    GLY  54           H        GLY  54   4.008  34.600  -8.841
 1098   1HA   GLY  54          1HA       GLY  54   1.579  35.554  -8.436
 1099   2HA   GLY  54          2HA       GLY  54   2.311  35.962  -6.890
 1100    H    HIS  55           H        HIS  55   4.696  36.931  -7.375
 1101    HA   HIS  55           HA       HIS  55   4.138  39.367  -8.852
 1102   1HB   HIS  55          2HB       HIS  55   6.277  40.159  -7.877
 1103   2HB   HIS  55          3HB       HIS  55   5.144  39.591  -6.653
 1104    HD1  HIS  55           HD1      HIS  55   5.649  37.087  -5.743
 1105    HD2  HIS  55           HD2      HIS  55   8.734  38.997  -7.768
 1106    HE1  HIS  55           HE1      HIS  55   7.738  35.827  -5.130
 1107    H    ASN  56           H        ASN  56   6.468  40.225  -9.818
 1108    HA   ASN  56           HA       ASN  56   7.235  38.177 -11.794
 1109   1HB   ASN  56          2HB       ASN  56   7.606  40.038 -13.385
 1110   2HB   ASN  56          3HB       ASN  56   5.933  39.945 -12.844
 1111   1HD2  ASN  56          1HD2      ASN  56   5.277  41.416 -11.135
 1112   2HD2  ASN  56          2HD2      ASN  56   6.016  42.975 -11.042
 1113    H    ALA  57           H        ALA  57   9.396  38.081 -12.453
 1114    HA   ALA  57           HA       ALA  57  11.341  38.433 -10.517
 1115   1HB   ALA  57          1HB       ALA  57  12.784  38.526 -12.848
 1116   2HB   ALA  57          2HB       ALA  57  12.250  37.059 -12.026
 1117   3HB   ALA  57          3HB       ALA  57  11.290  37.730 -13.346
 1118    H    LYS  58           H        LYS  58  10.567  40.540 -13.272
 1119    HA   LYS  58           HA       LYS  58  12.571  42.426 -12.976
 1120   1HB   LYS  58          2HB       LYS  58  10.537  42.157 -14.689
 1121   2HB   LYS  58          3HB       LYS  58   9.847  43.408 -13.663
 1122   1HG   LYS  58          2HG       LYS  58  12.607  43.727 -14.758
 1123   2HG   LYS  58          3HG       LYS  58  11.201  44.071 -15.769
 1124   1HD   LYS  58          2HD       LYS  58  10.918  46.043 -14.778
 1125   2HD   LYS  58          3HD       LYS  58  10.864  45.279 -13.188
 1126   1HE   LYS  58          2HE       LYS  58  13.041  45.733 -12.750
 1127   2HE   LYS  58          3HE       LYS  58  13.531  45.539 -14.431
 1128   1HZ   LYS  58          1HZ       LYS  58  11.990  47.756 -14.506
 1129   2HZ   LYS  58          2HZ       LYS  58  13.679  47.750 -14.423
 1130   3HZ   LYS  58          3HZ       LYS  58  12.763  47.918 -13.010
 1131    H    GLN  59           H        GLN  59   9.723  41.909 -11.059
 1132    HA   GLN  59           HA       GLN  59  10.129  44.431  -9.628
 1133   1HB   GLN  59          2HB       GLN  59   7.829  43.620 -10.417
 1134   2HB   GLN  59          3HB       GLN  59   7.931  42.436  -9.119
 1135   1HG   GLN  59          2HG       GLN  59   8.419  44.525  -7.638
 1136   2HG   GLN  59          3HG       GLN  59   7.652  45.397  -8.965
 1137   1HE2  GLN  59          1HE2      GLN  59   7.047  44.215  -6.051
 1138   2HE2  GLN  59          2HE2      GLN  59   5.381  43.787  -6.208
 1139    H    CYS  60           H        CYS  60  10.835  41.027  -9.379
 1140    HA   CYS  60           HA       CYS  60  10.768  40.820  -6.586
 1141   1HB   CYS  60          2HB       CYS  60  10.848  38.925  -8.284
 1142   2HB   CYS  60          3HB       CYS  60  12.563  39.243  -8.449
 1143    H    ARG  61           H        ARG  61  11.909  42.170  -5.353
 1144    HA   ARG  61           HA       ARG  61  14.489  43.207  -6.222
 1145   1HB   ARG  61          2HB       ARG  61  14.305  44.775  -4.428
 1146   2HB   ARG  61          3HB       ARG  61  12.734  44.690  -5.214
 1147   1HG   ARG  61          2HG       ARG  61  12.050  43.068  -3.413
 1148   2HG   ARG  61          3HG       ARG  61  13.550  43.488  -2.585
 1149   1HD   ARG  61          2HD       ARG  61  12.519  45.947  -3.164
 1150   2HD   ARG  61          3HD       ARG  61  11.059  45.005  -2.868
 1151    HE   ARG  61           HE       ARG  61  11.582  45.007  -0.649
 1152   1HH1  ARG  61          2HH1      ARG  61  14.475  45.667  -2.471
 1153   2HH1  ARG  61          1HH1      ARG  61  15.447  45.962  -1.067
 1154   1HH2  ARG  61          2HH2      ARG  61  12.852  45.392   1.206
 1155   2HH2  ARG  61          1HH2      ARG  61  14.523  45.806   1.023
 1156    H    LYS  62           H        LYS  62  15.865  43.585  -3.937
 1157    HA   LYS  62           HA       LYS  62  16.005  41.336  -2.224
 1158   1HB   LYS  62          2HB       LYS  62  16.952  40.624  -4.609
 1159   2HB   LYS  62          3HB       LYS  62  18.404  41.399  -3.989
 1160   1HG   LYS  62          2HG       LYS  62  18.799  39.294  -3.264
 1161   2HG   LYS  62          3HG       LYS  62  17.857  39.872  -1.888
 1162   1HD   LYS  62          2HD       LYS  62  15.926  38.979  -3.636
 1163   2HD   LYS  62          3HD       LYS  62  17.232  37.810  -3.852
 1164   1HE   LYS  62          2HE       LYS  62  16.598  38.537  -1.065
 1165   2HE   LYS  62          3HE       LYS  62  15.352  37.634  -1.925
 1166   1HZ   LYS  62          1HZ       LYS  62  18.039  36.608  -2.232
 1167   2HZ   LYS  62          2HZ       LYS  62  16.591  35.783  -1.944
 1168   3HZ   LYS  62          3HZ       LYS  62  17.420  36.508  -0.661
 1169    H    ARG  63           H        ARG  63  17.648  41.534  -0.631
 1170    HA   ARG  63           HA       ARG  63  19.588  43.617  -0.704
 1171   1HB   ARG  63          2HB       ARG  63  17.029  44.464  -0.016
 1172   2HB   ARG  63          3HB       ARG  63  17.843  44.265   1.530
 1173   1HG   ARG  63          2HG       ARG  63  19.721  45.592   0.044
 1174   2HG   ARG  63          3HG       ARG  63  18.206  46.289  -0.534
 1175   1HD   ARG  63          2HD       ARG  63  18.285  47.611   1.260
 1176   2HD   ARG  63          3HD       ARG  63  17.867  46.182   2.202
 1177    HE   ARG  63           HE       ARG  63  19.974  46.207   3.072
 1178   1HH1  ARG  63          2HH1      ARG  63  19.965  48.054   0.121
 1179   2HH1  ARG  63          1HH1      ARG  63  21.601  48.597   0.303
 1180   1HH2  ARG  63          2HH2      ARG  63  22.128  46.916   3.323
 1181   2HH2  ARG  63          1HH2      ARG  63  22.830  47.949   2.124
 1182    H    ASP  64           H        ASP  64  17.629  41.458   1.288
 1183    HA   ASP  64           HA       ASP  64  19.830  40.104   2.369
 1184   1HB   ASP  64          2HB       ASP  64  19.584  42.552   3.574
 1185   2HB   ASP  64          3HB       ASP  64  18.649  41.524   4.655
  Start of MODEL    9
    1   1H5*    C 160          1H5*        C 160   3.347  22.562 -18.306
    2   2H5*    C 160          2H5*        C 160   4.740  22.096 -17.329
    3    H4*    C 160           H4*        C 160   3.855  20.098 -18.204
    4    H3*    C 160           H3*        C 160   6.363  20.976 -19.602
    5    H2*    C 160           H2*        C 160   6.320  19.011 -20.944
    6   2HO*    C 160          2HO*        C 160   4.595  17.443 -20.374
    7    H1*    C 160           H1*        C 160   3.601  19.347 -21.599
    8   1H4     C 160          1H4         C 160   6.945  21.816 -26.475
    9   2H4     C 160          2H4         C 160   6.877  23.370 -25.674
   10    H5     C 160           H5         C 160   6.007  23.696 -23.504
   11    H6     C 160           H6         C 160   4.977  22.600 -21.545
   12   1H5*    U 161          1H5*        U 161   7.539  16.847 -18.108
   13   2H5*    U 161          2H5*        U 161   9.239  17.058 -17.689
   14    H4*    U 161           H4*        U 161   8.849  15.291 -19.371
   15    H3*    U 161           H3*        U 161  10.587  17.648 -20.061
   16    H2*    U 161           H2*        U 161  11.127  16.631 -22.138
   17   2HO*    U 161          2HO*        U 161   9.482  14.402 -21.552
   18    H1*    U 161           H1*        U 161   8.440  15.982 -22.696
   19    H3     U 161           H3         U 161   9.815  19.161 -25.715
   20    H5     U 161           H5         U 161   8.578  21.296 -22.331
   21    H6     U 161           H6         U 161   8.428  19.150 -21.154
   22   1H5*    G 162          1H5*        G 162  12.854  13.961 -20.633
   23   2H5*    G 162          2H5*        G 162  14.471  14.156 -19.958
   24    H4*    G 162           H4*        G 162  14.679  13.306 -22.177
   25    H3*    G 162           H3*        G 162  15.532  16.164 -21.829
   26    H2*    G 162           H2*        G 162  16.255  16.230 -24.099
   27   2HO*    G 162          2HO*        G 162  16.846  14.289 -24.880
   28    H1*    G 162           H1*        G 162  13.856  15.195 -25.074
   29    H8     G 162           H8         G 162  12.981  17.394 -22.232
   30    H1     G 162           H1         G 162  14.281  20.693 -27.647
   31   1H2     G 162          1H2         G 162  15.129  19.427 -29.037
   32   2H2     G 162          2H2         G 162  15.441  17.726 -28.774
   33   1H5*    C 163          1H5*        C 163  18.707  14.159 -23.573
   34   2H5*    C 163          2H5*        C 163  20.301  14.579 -22.944
   35    H4*    C 163           H4*        C 163  20.250  14.976 -25.311
   36    H3*    C 163           H3*        C 163  20.376  17.444 -23.593
   37    H2*    C 163           H2*        C 163  20.628  18.772 -25.545
   38   2HO*    C 163          2HO*        C 163  20.511  16.393 -27.116
   39    H1*    C 163           H1*        C 163  18.521  17.437 -26.883
   40   1H4     C 163          1H4         C 163  15.883  22.810 -24.654
   41   2H4     C 163          2H4         C 163  15.713  22.059 -23.083
   42    H5     C 163           H5         C 163  16.563  19.921 -22.546
   43    H6     C 163           H6         C 163  17.797  17.958 -23.394
   44   1H5*    C 164          1H5*        C 164  23.834  17.616 -26.213
   45   2H5*    C 164          2H5*        C 164  25.240  18.098 -25.264
   46    H4*    C 164           H4*        C 164  25.067  19.568 -27.130
   47    H3*    C 164           H3*        C 164  24.383  20.799 -24.482
   48    H2*    C 164           H2*        C 164  24.056  22.911 -25.517
   49   2HO*    C 164          2HO*        C 164  24.514  22.058 -28.113
   50    H1*    C 164           H1*        C 164  22.481  21.797 -27.590
   51   1H4     C 164          1H4         C 164  18.240  24.190 -23.461
   52   2H4     C 164          2H4         C 164  18.439  22.776 -22.450
   53    H5     C 164           H5         C 164  20.021  21.072 -22.869
   54    H6     C 164           H6         C 164  21.819  20.299 -24.375
   55   1H5*    C 165          1H5*        C 165  27.726  23.314 -26.014
   56   2H5*    C 165          2H5*        C 165  28.676  23.809 -24.614
   57    H4*    C 165           H4*        C 165  27.831  25.729 -25.857
   58    H3*    C 165           H3*        C 165  26.855  25.330 -23.041
   59    H2*    C 165           H2*        C 165  25.685  27.393 -23.153
   60   2HO*    C 165          2HO*        C 165  26.072  28.468 -25.418
   61    H1*    C 165           H1*        C 165  24.586  26.799 -25.688
   62   1H4     C 165          1H4         C 165  19.986  25.360 -21.491
   63   2H4     C 165          2H4         C 165  20.720  23.788 -21.257
   64    H5     C 165           H5         C 165  22.780  23.142 -22.218
   65    H6     C 165           H6         C 165  24.659  23.852 -23.653
   66   1H5*    U 166          1H5*        U 166  28.438  29.322 -23.128
   67   2H5*    U 166          2H5*        U 166  29.502  29.534 -21.737
   68    H4*    U 166           H4*        U 166  27.920  31.312 -21.730
   69    H3*    U 166           H3*        U 166  27.466  29.249 -19.591
   70    H2*    U 166           H2*        U 166  25.708  30.570 -18.693
   71   2HO*    U 166          2HO*        U 166  25.436  32.715 -19.867
   72    H1*    U 166           H1*        U 166  24.502  30.980 -21.192
   73    H3     U 166           H3         U 166  21.750  28.203 -18.807
   74    H5     U 166           H5         U 166  24.649  25.686 -20.480
   75    H6     U 166           H6         U 166  25.855  27.704 -21.177
   76   1H5*    C 167          1H5*        C 167  28.176  33.060 -17.181
   77   2H5*    C 167          2H5*        C 167  29.184  32.485 -15.853
   78    H4*    C 167           H4*        C 167  27.232  33.631 -15.000
   79    H3*    C 167           H3*        C 167  27.392  30.672 -14.476
   80    H2*    C 167           H2*        C 167  25.448  30.822 -13.116
   81   2HO*    C 167          2HO*        C 167  24.897  33.477 -13.454
   82    H1*    C 167           H1*        C 167  24.030  32.323 -15.018
   83   1H4     C 167          1H4         C 167  22.288  26.241 -15.979
   84   2H4     C 167          2H4         C 167  23.637  26.063 -17.080
   85    H5     C 167           H5         C 167  25.279  27.723 -17.427
   86    H6     C 167           H6         C 167  26.040  29.987 -16.799
   87   1H5*    A 168          1H5*        A 168  30.705  31.148  -9.915
   88   2H5*    A 168          2H5*        A 168  29.903  32.663 -10.330
   89    H4*    A 168           H4*        A 168  31.800  32.383 -12.330
   90    H3*    A 168           H3*        A 168  32.927  31.278  -9.754
   91    H2*    A 168           H2*        A 168  34.892  32.421 -10.138
   92   2HO*    A 168          2HO*        A 168  34.612  32.974 -12.809
   93    H1*    A 168           H1*        A 168  33.418  34.345 -11.886
   94    H8     A 168           H8         A 168  36.154  34.372 -10.163
   95   1H6     A 168          1H6         A 168  34.495  38.970  -6.283
   96   2H6     A 168          2H6         A 168  35.855  38.073  -6.917
   97    H2     A 168           H2         A 168  30.813  37.339  -8.161
   98   1H5*    U 169          1H5*        U 169  35.294  29.028 -10.876
   99   2H5*    U 169          2H5*        U 169  35.408  28.695 -12.605
  100    H4*    U 169           H4*        U 169  35.418  26.537 -10.488
  101    H3*    U 169           H3*        U 169  37.706  28.148 -11.574
  102    H2*    U 169           H2*        U 169  39.091  26.216 -11.569
  103   2HO*    U 169          2HO*        U 169  38.505  25.027  -9.840
  104    H1*    U 169           H1*        U 169  37.220  24.627 -12.885
  105    H3     U 169           H3         U 169  40.357  25.422 -16.068
  106    H5     U 169           H5         U 169  38.159  28.982 -15.896
  107    H6     U 169           H6         U 169  36.998  28.056 -13.945
  108   1H5*    C 170          1H5*        C 170  38.165  30.895 -10.029
  109   2H5*    C 170          2H5*        C 170  39.489  31.148  -8.892
  110    H4*    C 170           H4*        C 170  37.919  32.909  -8.591
  111    H3*    C 170           H3*        C 170  37.863  30.878  -6.361
  112    H2*    C 170           H2*        C 170  36.392  32.297  -5.164
  113   2HO*    C 170          2HO*        C 170  37.433  34.233  -5.686
  114    H1*    C 170           H1*        C 170  34.826  32.831  -7.481
  115   1H4     C 170          1H4         C 170  31.475  28.519  -4.167
  116   2H4     C 170          2H4         C 170  32.473  27.250  -4.841
  117    H5     C 170           H5         C 170  34.361  27.646  -6.205
  118    H6     C 170           H6         C 170  35.770  29.373  -7.266
  119   1H5*    C 171          1H5*        C 171  41.517  31.981  -3.050
  120   2H5*    C 171          2H5*        C 171  39.998  31.329  -3.667
  121    H4*    C 171           H4*        C 171  40.482  34.283  -3.255
  122    H3*    C 171           H3*        C 171  39.523  32.226  -1.280
  123    H2*    C 171           H2*        C 171  38.049  33.840  -0.341
  124   2HO*    C 171          2HO*        C 171  38.515  35.977  -0.736
  125    H1*    C 171           H1*        C 171  37.051  34.617  -2.845
  126   1H4     C 171          1H4         C 171  32.954  30.241  -0.592
  127   2H4     C 171          2H4         C 171  33.892  29.006  -1.403
  128    H5     C 171           H5         C 171  35.946  29.417  -2.494
  129    H6     C 171           H6         C 171  37.623  31.132  -3.081
  130   1H5*    G 172          1H5*        G 172  40.695  35.540   1.813
  131   2H5*    G 172          2H5*        G 172  41.741  34.485   2.763
  132    H4*    G 172           H4*        G 172  40.160  35.502   4.232
  133    H3*    G 172           H3*        G 172  39.739  32.571   3.741
  134    H2*    G 172           H2*        G 172  37.941  32.554   5.304
  135   2HO*    G 172          2HO*        G 172  37.907  34.195   6.778
  136    H1*    G 172           H1*        G 172  36.683  34.757   4.141
  137    H8     G 172           H8         G 172  38.138  32.769   1.380
  138    H1     G 172           H1         G 172  32.609  30.269   3.630
  139   1H2     G 172          1H2         G 172  32.096  31.207   5.394
  140   2H2     G 172          2H2         G 172  33.025  32.482   6.149
  141   1H5*    U 173          1H5*        U 173  39.670  33.094   7.803
  142   2H5*    U 173          2H5*        U 173  40.746  32.010   8.686
  143    H4*    U 173           H4*        U 173  38.602  31.801   9.663
  144    H3*    U 173           H3*        U 173  39.348  29.452   7.939
  145    H2*    U 173           H2*        U 173  37.352  28.345   8.595
  146   2HO*    U 173          2HO*        U 173  36.187  29.253  10.374
  147    H1*    U 173           H1*        U 173  35.749  30.608   8.130
  148    H3     U 173           H3         U 173  34.615  27.541   4.935
  149    H5     U 173           H5         U 173  38.086  29.378   3.479
  150    H6     U 173           H6         U 173  38.301  30.478   5.660
  151   1H5*    C 174          1H5*        C 174  38.284  27.871  11.525
  152   2H5*    C 174          2H5*        C 174  39.421  26.701  12.194
  153    H4*    C 174           H4*        C 174  37.336  25.613  12.109
  154    H3*    C 174           H3*        C 174  39.204  24.723   9.933
  155    H2*    C 174           H2*        C 174  37.605  23.163   9.154
  156   2HO*    C 174          2HO*        C 174  36.944  22.513  11.233
  157    H1*    C 174           H1*        C 174  35.483  25.078   9.422
  158   1H4     C 174          1H4         C 174  36.521  24.741   3.137
  159   2H4     C 174          2H4         C 174  37.982  25.684   3.329
  160    H5     C 174           H5         C 174  38.851  26.350   5.422
  161    H6     C 174           H6         C 174  38.529  26.275   7.869
  162   1H5*    U 175          1H5*        U 175  38.934  21.502  13.366
  163   2H5*    U 175          2H5*        U 175  39.369  22.591  14.684
  164    H4*    U 175           H4*        U 175  41.604  20.948  14.391
  165    H3*    U 175           H3*        U 175  39.086  19.342  13.925
  166    H2*    U 175           H2*        U 175  40.042  17.576  15.142
  167   2HO*    U 175          2HO*        U 175  42.332  17.554  15.345
  168    H1*    U 175           H1*        U 175  41.290  19.465  16.976
  169    H3     U 175           H3         U 175  39.133  16.876  19.971
  170    H5     U 175           H5         U 175  36.018  18.573  17.744
  171    H6     U 175           H6         U 175  37.728  19.538  16.274
  172   1H5*    C 176          1H5*        C 176  38.543  19.582  10.982
  173   2H5*    C 176          2H5*        C 176  37.509  19.535  12.411
  174    H4*    C 176           H4*        C 176  36.167  17.770  11.449
  175    H3*    C 176           H3*        C 176  38.270  17.679   9.302
  176    H2*    C 176           H2*        C 176  36.620  17.030   7.721
  177   2HO*    C 176          2HO*        C 176  34.486  16.527   8.610
  178    H1*    C 176           H1*        C 176  34.833  19.044   8.494
  179   1H4     C 176          1H4         C 176  38.136  21.378   3.521
  180   2H4     C 176          2H4         C 176  39.248  22.099   4.662
  181    H5     C 176           H5         C 176  39.177  21.716   6.992
  182    H6     C 176           H6         C 176  38.008  20.535   8.819
  183   1H5*    G 177          1H5*        G 177  36.173  13.826   8.823
  184   2H5*    G 177          2H5*        G 177  37.474  12.642   8.958
  185    H4*    G 177           H4*        G 177  36.207  12.123   7.012
  186    H3*    G 177           H3*        G 177  38.924  13.275   6.467
  187    H2*    G 177           H2*        G 177  38.597  12.971   4.126
  188   2HO*    G 177          2HO*        G 177  37.118  11.452   3.556
  189    H1*    G 177           H1*        G 177  36.102  14.220   4.139
  190    H8     G 177           H8         G 177  38.249  16.029   6.557
  191    H1     G 177           H1         G 177  39.428  17.678   0.411
  192   1H2     G 177          1H2         G 177  38.474  16.357  -0.853
  193   2H2     G 177          2H2         G 177  37.499  15.003  -0.325
  194   1H5*    C 178          1H5*        C 178  38.711   9.979   4.220
  195   2H5*    C 178          2H5*        C 178  40.072   8.863   4.320
  196    H4*    C 178           H4*        C 178  39.799   9.453   2.038
  197    H3*    C 178           H3*        C 178  42.190  10.710   3.348
  198    H2*    C 178           H2*        C 178  42.821  11.711   1.302
  199   2HO*    C 178          2HO*        C 178  42.033  10.784  -0.575
  200    H1*    C 178           H1*        C 178  40.116  12.470   0.728
  201   1H4     C 178          1H4         C 178  42.978  17.899   2.483
  202   2H4     C 178          2H4         C 178  42.872  17.404   4.158
  203    H5     C 178           H5         C 178  42.079  15.292   4.858
  204    H6     C 178           H6         C 178  41.184  13.114   4.116
  205   1H5*    U 179          1H5*        U 179  43.805   8.504  -0.004
  206   2H5*    U 179          2H5*        U 179  45.355   7.785   0.429
  207    H4*    U 179           H4*        U 179  45.628   9.250  -1.465
  208    H3*    U 179           H3*        U 179  46.910  10.158   1.102
  209    H2*    U 179           H2*        U 179  47.883  11.990  -0.035
  210   2HO*    U 179          2HO*        U 179  46.932  11.550  -2.547
  211    H1*    U 179           H1*        U 179  45.455  12.520  -1.461
  212    H3     U 179           H3         U 179  46.461  16.263   0.999
  213    H5     U 179           H5         U 179  44.581  13.648   3.677
  214    H6     U 179           H6         U 179  44.725  11.923   1.940
  215   1H5*    U 180          1H5*        U 180  49.633   9.999  -1.897
  216   2H5*    U 180          2H5*        U 180  51.277   9.453  -1.564
  217    H4*    U 180           H4*        U 180  51.437  11.632  -2.473
  218    H3*    U 180           H3*        U 180  51.972  11.499   0.476
  219    H2*    U 180           H2*        U 180  52.432  13.822   0.535
  220   2HO*    U 180          2HO*        U 180  51.954  13.987  -2.266
  221    H1*    U 180           H1*        U 180  50.155  14.432  -1.066
  222    H3     U 180           H3         U 180  49.191  16.473   2.866
  223    H5     U 180           H5         U 180  48.701  12.398   3.699
  224    H6     U 180           H6         U 180  49.615  11.934   1.471
  225   1H5*    A 181          1H5*        A 181  56.628  11.106  -0.906
  226   2H5*    A 181          2H5*        A 181  57.199  10.413   0.612
  227    H4*    A 181           H4*        A 181  57.977  12.758   0.066
  228    H3*    A 181           H3*        A 181  56.687  12.041   2.691
  229    H2*    A 181           H2*        A 181  57.146  14.231   3.489
  230   2HO*    A 181          2HO*        A 181  58.327  14.939   1.012
  231    H1*    A 181           H1*        A 181  56.156  15.466   1.171
  232    H8     A 181           H8         A 181  54.092  12.505   2.192
  233   1H6     A 181          1H6         A 181  50.836  16.442   5.776
  234   2H6     A 181          2H6         A 181  50.890  14.809   5.150
  235    H2     A 181           H2         A 181  54.384  18.606   4.202
  236   1H5*    U 182          1H5*        U 182  60.712  12.386   6.059
  237   2H5*    U 182          2H5*        U 182  59.289  11.429   6.472
  238    H4*    U 182           H4*        U 182  59.559  13.282   8.012
  239    H3*    U 182           H3*        U 182  57.138  12.974   6.413
  240    H2*    U 182           H2*        U 182  56.952  15.219   5.969
  241   2HO*    U 182          2HO*        U 182  55.855  16.042   7.739
  242    H1*    U 182           H1*        U 182  58.969  15.695   8.229
  243    H3     U 182           H3         U 182  59.707  20.027   7.492
  244    H5     U 182           H5         U 182  58.532  18.688   3.702
  245    H6     U 182           H6         U 182  58.302  16.448   4.673
  246   1H5*    U 183          1H5*        U 183  56.414  11.464  12.020
  247   2H5*    U 183          2H5*        U 183  57.475  11.084  10.664
  248    H4*    U 183           H4*        U 183  55.214   9.775   9.910
  249    H3*    U 183           H3*        U 183  55.111   9.956  12.902
  250    H2*    U 183           H2*        U 183  54.468   7.674  13.053
  251   2HO*    U 183          2HO*        U 183  53.273   7.101  11.337
  252    H1*    U 183           H1*        U 183  56.485   6.763  11.377
  253    H3     U 183           H3         U 183  58.157   5.482  15.360
  254    H5     U 183           H5         U 183  58.517   9.654  15.468
  255    H6     U 183           H6         U 183  57.301   9.715  13.339
  256   1H5*    C 184          1H5*        C 184  53.316  11.143  15.286
  257   2H5*    C 184          2H5*        C 184  53.790   9.608  16.014
  258    H4*    C 184           H4*        C 184  51.043   9.401  15.308
  259    H3*    C 184           H3*        C 184  51.741  12.059  16.531
  260    H2*    C 184           H2*        C 184  49.784  11.948  17.875
  261   2HO*    C 184          2HO*        C 184  49.059   9.422  16.870
  262    H1*    C 184           H1*        C 184  50.297   9.279  18.646
  263   1H4     C 184          1H4         C 184  52.384  13.090  23.374
  264   2H4     C 184          2H4         C 184  53.989  12.941  22.693
  265    H5     C 184           H5         C 184  54.449  11.882  20.633
  266    H6     C 184           H6         C 184  53.474  10.693  18.700
  267   1H5*    G 185          1H5*        G 185  47.816  15.159  14.191
  268   2H5*    G 185          2H5*        G 185  48.491  15.431  15.798
  269    H4*    G 185           H4*        G 185  45.787  14.527  14.989
  270    H3*    G 185           H3*        G 185  46.958  16.373  17.043
  271    H2*    G 185           H2*        G 185  45.020  16.121  18.406
  272   2HO*    G 185          2HO*        G 185  43.260  14.838  17.437
  273    H1*    G 185           H1*        G 185  45.084  13.333  18.279
  274    H8     G 185           H8         G 185  48.590  13.810  18.541
  275    H1     G 185           H1         G 185  45.699  15.744  23.999
  276   1H2     G 185          1H2         G 185  43.677  15.963  23.667
  277   2H2     G 185          2H2         G 185  42.881  15.667  22.137
  278   1H5*    G 186          1H5*        G 186  46.678  20.530  13.836
  279   2H5*    G 186          2H5*        G 186  47.472  20.483  15.411
  280    H4*    G 186           H4*        G 186  44.791  21.729  14.767
  281    H3*    G 186           H3*        G 186  47.525  22.862  15.155
  282    H2*    G 186           H2*        G 186  46.662  24.723  16.368
  283   2HO*    G 186          2HO*        G 186  44.031  23.822  16.387
  284    H1*    G 186           H1*        G 186  45.172  23.118  18.099
  285    H8     G 186           H8         G 186  48.091  21.062  17.852
  286    H1     G 186           H1         G 186  49.448  26.542  21.015
  287   1H2     G 186          1H2         G 186  47.931  27.905  20.713
  288   2H2     G 186          2H2         G 186  46.504  27.609  19.746
  289   1H5*    G 187          1H5*        G 187  46.431  25.333   9.899
  290   2H5*    G 187          2H5*        G 187  46.771  23.603   9.952
  291    H4*    G 187           H4*        G 187  48.781  25.848  10.227
  292    H3*    G 187           H3*        G 187  47.982  24.113   7.937
  293    H2*    G 187           H2*        G 187  50.244  23.843   7.240
  294   2HO*    G 187          2HO*        G 187  51.773  25.054   8.865
  295    H1*    G 187           H1*        G 187  51.125  23.070   9.763
  296    H8     G 187           H8         G 187  47.758  21.619   9.457
  297    H1     G 187           H1         G 187  52.185  18.316   6.083
  298   1H2     G 187          1H2         G 187  53.927  19.415   5.971
  299   2H2     G 187          2H2         G 187  54.154  20.996   6.685
  300   1H5*    G 188          1H5*        G 188  51.138  26.222   6.260
  301   2H5*    G 188          2H5*        G 188  50.358  27.336   5.136
  302    H4*    G 188           H4*        G 188  52.086  26.446   3.882
  303    H3*    G 188           H3*        G 188  49.542  24.962   3.279
  304    H2*    G 188           H2*        G 188  50.689  23.690   1.622
  305   2HO*    G 188          2HO*        G 188  53.161  24.434   1.660
  306    H1*    G 188           H1*        G 188  52.796  23.046   3.345
  307    H8     G 188           H8         G 188  49.782  22.927   5.439
  308    H1     G 188           H1         G 188  50.305  17.744   1.599
  309   1H2     G 188          1H2         G 188  51.761  18.082   0.179
  310   2H2     G 188          2H2         G 188  52.702  19.552   0.049
  311   1H5*    A 189          1H5*        A 189  50.581  26.185  -1.165
  312   2H5*    A 189          2H5*        A 189  48.905  26.557  -1.570
  313    H4*    A 189           H4*        A 189  50.028  24.788  -2.972
  314    H3*    A 189           H3*        A 189  47.398  24.319  -1.587
  315    H2*    A 189           H2*        A 189  47.227  22.203  -2.654
  316   2HO*    A 189          2HO*        A 189  49.590  22.160  -3.996
  317    H1*    A 189           H1*        A 189  49.851  21.465  -1.997
  318    H8     A 189           H8         A 189  48.215  23.352   0.794
  319   1H6     A 189          1H6         A 189  46.011  17.858   2.772
  320   2H6     A 189          2H6         A 189  46.181  19.549   3.186
  321    H2     A 189           H2         A 189  47.862  17.257  -1.223
  322   1H5*    G 190          1H5*        G 190  46.551  23.617  -6.174
  323   2H5*    G 190          2H5*        G 190  44.896  24.221  -6.248
  324    H4*    G 190           H4*        G 190  45.160  21.927  -7.134
  325    H3*    G 190           H3*        G 190  43.301  22.453  -4.834
  326    H2*    G 190           H2*        G 190  42.571  20.186  -4.911
  327   2HO*    G 190          2HO*        G 190  43.669  18.915  -6.723
  328    H1*    G 190           H1*        G 190  45.171  19.172  -4.919
  329    H8     G 190           H8         G 190  45.227  22.117  -2.697
  330    H1     G 190           H1         G 190  42.614  16.914   0.130
  331   1H2     G 190          1H2         G 190  42.261  15.463  -1.292
  332   2H2     G 190          2H2         G 190  42.618  15.630  -2.996
  333   1H5*    C 191          1H5*        C 191  40.570  20.878  -8.057
  334   2H5*    C 191          2H5*        C 191  38.983  21.571  -7.724
  335    H4*    C 191           H4*        C 191  39.071  19.083  -7.641
  336    H3*    C 191           H3*        C 191  38.133  20.673  -5.265
  337    H2*    C 191           H2*        C 191  37.552  18.648  -4.160
  338   2HO*    C 191          2HO*        C 191  38.354  16.793  -5.920
  339    H1*    C 191           H1*        C 191  40.016  17.436  -4.746
  340   1H4     C 191          1H4         C 191  40.592  19.885   1.146
  341   2H4     C 191          2H4         C 191  41.214  21.354   0.427
  342    H5     C 191           H5         C 191  41.278  21.756  -1.900
  343    H6     C 191           H6         C 191  40.756  20.838  -4.132
  344   1H5*    G 192          1H5*        G 192  34.724  17.710  -6.091
  345   2H5*    G 192          2H5*        G 192  33.369  18.838  -6.101
  346    H4*    G 192           H4*        G 192  32.891  16.964  -4.653
  347    H3*    G 192           H3*        G 192  33.215  19.648  -3.347
  348    H2*    G 192           H2*        G 192  32.632  18.702  -1.239
  349   2HO*    G 192          2HO*        G 192  31.769  16.573  -1.252
  350    H1*    G 192           H1*        G 192  34.456  16.602  -1.485
  351    H8     G 192           H8         G 192  36.090  19.554  -2.974
  352    H1     G 192           H1         G 192  36.205  19.645   3.495
  353   1H2     G 192          1H2         G 192  34.936  18.194   4.228
  354   2H2     G 192          2H2         G 192  33.983  17.113   3.236
  355   1H5*    G 193          1H5*        G 193  29.872  17.820  -1.699
  356   2H5*    G 193          2H5*        G 193  28.468  18.879  -1.831
  357    H4*    G 193           H4*        G 193  28.596  18.119   0.417
  358    H3*    G 193           H3*        G 193  29.353  21.001   0.041
  359    H2*    G 193           H2*        G 193  29.585  21.252   2.399
  360   2HO*    G 193          2HO*        G 193  29.151  18.689   3.185
  361    H1*    G 193           H1*        G 193  31.207  18.994   2.652
  362    H8     G 193           H8         G 193  32.083  20.675  -0.540
  363    H1     G 193           H1         G 193  34.778  23.485   4.629
  364   1H2     G 193          1H2         G 193  33.935  22.719   6.348
  365   2H2     G 193          2H2         G 193  32.684  21.497   6.384
  366   1H5*    A 194          1H5*        A 194  26.357  20.902   3.369
  367   2H5*    A 194          2H5*        A 194  25.200  22.142   2.889
  368    H4*    A 194           H4*        A 194  25.835  22.540   5.154
  369    H3*    A 194           H3*        A 194  26.857  24.524   3.157
  370    H2*    A 194           H2*        A 194  27.896  25.791   4.879
  371   2HO*    A 194          2HO*        A 194  27.451  24.425   7.084
  372    H1*    A 194           H1*        A 194  29.093  23.513   6.029
  373    H8     A 194           H8         A 194  29.251  23.353   2.307
  374   1H6     A 194          1H6         A 194  34.512  26.689   2.689
  375   2H6     A 194          2H6         A 194  33.493  25.768   1.606
  376    H2     A 194           H2         A 194  32.617  26.617   6.707
  377   1H5*    C 195          1H5*        C 195  24.495  26.931   6.122
  378   2H5*    C 195          2H5*        C 195  23.876  28.351   5.279
  379    H4*    C 195           H4*        C 195  25.371  28.861   7.200
  380    H3*    C 195           H3*        C 195  26.027  29.861   4.439
  381    H2*    C 195           H2*        C 195  27.857  31.086   5.325
  382   2HO*    C 195          2HO*        C 195  27.197  31.816   7.273
  383    H1*    C 195           H1*        C 195  28.785  28.907   6.852
  384   1H4     C 195          1H4         C 195  32.273  28.861   1.489
  385   2H4     C 195          2H4         C 195  31.038  27.880   0.731
  386    H5     C 195           H5         C 195  28.970  27.353   1.745
  387    H6     C 195           H6         C 195  27.565  27.640   3.755
  388   1H5*    G 196          1H5*        G 196  26.327  33.962   6.825
  389   2H5*    G 196          2H5*        G 196  25.014  34.650   5.869
  390    H4*    G 196           H4*        G 196  26.783  36.201   5.772
  391    H3*    G 196           H3*        G 196  26.475  34.616   3.242
  392    H2*    G 196           H2*        G 196  28.219  35.878   2.222
  393   2HO*    G 196          2HO*        G 196  29.132  37.581   3.814
  394    H1*    G 196           H1*        G 196  29.977  35.497   4.354
  395    H8     G 196           H8         G 196  27.864  32.456   3.744
  396    H1     G 196           H1         G 196  33.145  32.767   0.018
  397   1H2     G 196          1H2         G 196  34.028  34.620   0.228
  398   2H2     G 196          2H2         G 196  33.427  35.897   1.260
  399   1H5*    A 197          1H5*        A 197  23.800  39.624   2.855
  400   2H5*    A 197          2H5*        A 197  22.934  38.090   2.943
  401    H4*    A 197           H4*        A 197  21.711  39.346   1.414
  402    H3*    A 197           H3*        A 197  23.529  37.424  -0.009
  403    H2*    A 197           H2*        A 197  22.951  38.285  -2.063
  404   2HO*    A 197          2HO*        A 197  20.657  39.610  -1.515
  405    H1*    A 197           H1*        A 197  22.135  40.847  -0.749
  406    H8     A 197           H8         A 197  25.017  38.982  -2.443
  407   1H6     A 197          1H6         A 197  26.205  44.403  -5.298
  408   2H6     A 197          2H6         A 197  26.679  42.722  -5.193
  409    H2     A 197           H2         A 197  22.878  45.045  -2.424
  410   1H5*    U 198          1H5*        U 198  19.032  35.533   0.332
  411   2H5*    U 198          2H5*        U 198  19.066  35.571   2.095
  412    H4*    U 198           H4*        U 198  18.641  33.283   0.240
  413    H3*    U 198           H3*        U 198  17.392  34.295   2.780
  414    H2*    U 198           H2*        U 198  16.656  32.126   3.316
  415   2HO*    U 198          2HO*        U 198  17.527  30.795   1.087
  416    H1*    U 198           H1*        U 198  19.134  30.976   2.342
  417    H3     U 198           H3         U 198  20.584  29.801   6.406
  418    H5     U 198           H5         U 198  18.045  33.020   7.255
  419    H6     U 198           H6         U 198  17.734  33.284   4.837
  420   1H5*    G 199          1H5*        G 199  14.497  37.018  -1.338
  421   2H5*    G 199          2H5*        G 199  13.841  37.080   0.298
  422    H4*    G 199           H4*        G 199  11.956  36.855  -1.030
  423    H3*    G 199           H3*        G 199  12.762  34.191   0.087
  424    H2*    G 199           H2*        G 199  10.885  33.163  -0.958
  425   2HO*    G 199          2HO*        G 199  10.211  35.720  -2.045
  426    H1*    G 199           H1*        G 199  11.433  34.295  -3.450
  427    H8     G 199           H8         G 199  13.985  32.934  -0.917
  428    H1     G 199           H1         G 199  12.991  29.260  -6.151
  429   1H2     G 199          1H2         G 199  11.562  30.139  -7.350
  430   2H2     G 199          2H2         G 199  10.753  31.647  -6.989
  431   1H5*    A 200          1H5*        A 200  11.392  36.634   3.953
  432   2H5*    A 200          2H5*        A 200  13.115  37.010   3.916
  433    H4*    A 200           H4*        A 200  12.159  36.105   6.093
  434    H3*    A 200           H3*        A 200  14.623  35.004   4.766
  435    H2*    A 200           H2*        A 200  14.958  33.541   6.606
  436   2HO*    A 200          2HO*        A 200  12.839  34.077   8.155
  437    H1*    A 200           H1*        A 200  12.311  32.652   6.635
  438    H8     A 200           H8         A 200  13.557  33.216   3.139
  439   1H6     A 200          1H6         A 200  15.608  27.324   3.294
  440   2H6     A 200          2H6         A 200  15.363  28.712   2.258
  441    H2     A 200           H2         A 200  14.245  28.429   7.376
  442   1H5*    C 201          1H5*        C 201  17.375  36.633   8.533
  443   2H5*    C 201          2H5*        C 201  18.124  35.036   8.498
  444    H4*    C 201           H4*        C 201  15.374  35.841   9.331
  445    H3*    C 201           H3*        C 201  17.567  34.117  10.448
  446    H2*    C 201           H2*        C 201  15.997  32.812  11.608
  447   2HO*    C 201          2HO*        C 201  13.673  34.020  11.130
  448    H1*    C 201           H1*        C 201  14.138  32.998   9.369
  449   1H4     C 201          1H4         C 201  15.711  26.823   9.479
  450   2H4     C 201          2H4         C 201  17.345  27.222   8.997
  451    H5     C 201           H5         C 201  18.141  29.432   8.743
  452    H6     C 201           H6         C 201  17.558  31.826   8.890
  453   1H5*    C 202          1H5*        C 202  15.666  35.855  14.129
  454   2H5*    C 202          2H5*        C 202  16.891  35.811  15.397
  455    H4*    C 202           H4*        C 202  14.909  34.402  15.867
  456    H3*    C 202           H3*        C 202  17.618  33.080  15.680
  457    H2*    C 202           H2*        C 202  16.639  31.087  16.485
  458   2HO*    C 202          2HO*        C 202  15.375  32.067  18.080
  459    H1*    C 202           H1*        C 202  14.299  31.498  14.851
  460   1H4     C 202          1H4         C 202  17.517  26.650  12.182
  461   2H4     C 202          2H4         C 202  18.477  27.819  11.305
  462    H5     C 202           H5         C 202  18.342  30.152  11.645
  463    H6     C 202           H6         C 202  17.241  31.956  12.923
  464   1H5*    C 203          1H5*        C 203  16.661  32.761  20.164
  465   2H5*    C 203          2H5*        C 203  18.240  32.537  20.917
  466    H4*    C 203           H4*        C 203  16.655  30.648  21.253
  467    H3*    C 203           H3*        C 203  19.319  30.166  19.925
  468    H2*    C 203           H2*        C 203  18.895  27.830  20.022
  469   2HO*    C 203          2HO*        C 203  17.253  27.126  21.423
  470    H1*    C 203           H1*        C 203  16.243  28.157  19.067
  471   1H4     C 203          1H4         C 203  19.664  26.282  14.000
  472   2H4     C 203          2H4         C 203  20.129  27.946  13.729
  473    H5     C 203           H5         C 203  19.592  29.718  15.195
  474    H6     C 203           H6         C 203  18.466  30.335  17.304
  475   1H5*    U 204          1H5*        U 204  18.508  28.209  23.355
  476   2H5*    U 204          2H5*        U 204  19.667  27.695  24.582
  477    H4*    U 204           H4*        U 204  18.394  25.801  23.810
  478    H3*    U 204           H3*        U 204  21.309  25.833  23.078
  479    H2*    U 204           H2*        U 204  21.093  23.654  22.141
  480   2HO*    U 204          2HO*        U 204  19.216  22.483  22.651
  481    H1*    U 204           H1*        U 204  18.843  24.333  20.635
  482    H3     U 204           H3         U 204  22.512  23.814  17.877
  483    H5     U 204           H5         U 204  22.463  27.851  18.994
  484    H6     U 204           H6         U 204  20.721  27.276  20.622
  485   1H5*    A 205          1H5*        A 205  21.721  23.312  27.151
  486   2H5*    A 205          2H5*        A 205  23.479  23.328  27.298
  487    H4*    A 205           H4*        A 205  22.287  21.191  26.456
  488    H3*    A 205           H3*        A 205  24.785  22.387  25.282
  489    H2*    A 205           H2*        A 205  24.951  20.548  23.790
  490   2HO*    A 205          2HO*        A 205  22.587  19.441  24.930
  491    H1*    A 205           H1*        A 205  22.267  20.679  23.019
  492    H8     A 205           H8         A 205  23.329  24.178  23.376
  493   1H6     A 205          1H6         A 205  25.924  23.763  17.715
  494   2H6     A 205          2H6         A 205  25.460  24.875  18.984
  495    H2     A 205           H2         A 205  24.825  19.668  19.044
  496   1H5*    G 206          1H5*        G 206  28.636  21.379  25.964
  497   2H5*    G 206          2H5*        G 206  28.223  22.300  24.518
  498    H4*    G 206           H4*        G 206  29.916  20.457  24.220
  499    H3*    G 206           H3*        G 206  27.449  20.690  22.520
  500    H2*    G 206           H2*        G 206  28.191  18.856  21.193
  501   2HO*    G 206          2HO*        G 206  30.404  18.015  22.230
  502    H1*    G 206           H1*        G 206  28.690  17.228  23.399
  503    H8     G 206           H8         G 206  26.011  19.448  21.900
  504    H1     G 206           H1         G 206  23.830  13.856  24.322
  505   1H2     G 206          1H2         G 206  25.358  12.894  25.317
  506   2H2     G 206          2H2         G 206  26.988  13.511  25.474
  507   1H5*    U 207          1H5*        U 207  28.416  21.559  18.189
  508   2H5*    U 207          2H5*        U 207  30.086  21.248  17.715
  509    H4*    U 207           H4*        U 207  28.832  23.345  16.815
  510    H3*    U 207           H3*        U 207  31.688  23.226  17.752
  511    H2*    U 207           H2*        U 207  31.979  25.501  17.144
  512   2HO*    U 207          2HO*        U 207  30.193  26.477  15.930
  513    H1*    U 207           H1*        U 207  29.642  26.357  18.401
  514    H3     U 207           H3         U 207  32.593  27.956  21.387
  515    H5     U 207           H5         U 207  33.042  23.809  21.760
  516    H6     U 207           H6         U 207  31.480  23.570  19.885
  517   1H5*    A 208          1H5*        A 208  33.972  23.747  12.951
  518   2H5*    A 208          2H5*        A 208  32.675  23.902  11.766
  519    H4*    A 208           H4*        A 208  34.142  22.191  11.014
  520    H3*    A 208           H3*        A 208  31.478  21.263  11.988
  521    H2*    A 208           H2*        A 208  32.031  18.985  11.571
  522   2HO*    A 208          2HO*        A 208  33.233  19.369   9.690
  523    H1*    A 208           H1*        A 208  34.464  19.152  12.942
  524    H8     A 208           H8         A 208  31.286  20.923  14.141
  525   1H6     A 208          1H6         A 208  30.759  16.189  18.173
  526   2H6     A 208          2H6         A 208  30.056  17.710  17.674
  527    H2     A 208           H2         A 208  34.265  15.403  15.558
  528   1H5*    G 209          1H5*        G 209  30.825  20.015   8.550
  529   2H5*    G 209          2H5*        G 209  29.154  20.096   7.994
  530    H4*    G 209           H4*        G 209  29.715  18.112   9.411
  531    H3*    G 209           H3*        G 209  27.470  19.977  10.122
  532    H2*    G 209           H2*        G 209  26.864  18.553  11.934
  533   2HO*    G 209          2HO*        G 209  29.062  16.872  11.216
  534    H1*    G 209           H1*        G 209  29.468  18.426  12.928
  535    H8     G 209           H8         G 209  29.011  21.867  11.671
  536    H1     G 209           H1         G 209  26.202  20.920  17.423
  537   1H2     G 209          1H2         G 209  26.164  18.902  17.848
  538   2H2     G 209          2H2         G 209  26.797  17.652  16.800
  539   1H5*    A 210          1H5*        A 210  25.987  16.124  11.098
  540   2H5*    A 210          2H5*        A 210  24.490  15.998  10.173
  541    H4*    A 210           H4*        A 210  24.039  15.502  12.476
  542    H3*    A 210           H3*        A 210  22.916  18.127  11.507
  543    H2*    A 210           H2*        A 210  21.771  18.360  13.572
  544   2HO*    A 210          2HO*        A 210  21.816  16.456  14.990
  545    H1*    A 210           H1*        A 210  24.043  17.638  15.086
  546    H8     A 210           H8         A 210  24.957  19.904  12.265
  547   1H6     A 210          1H6         A 210  23.621  24.670  16.064
  548   2H6     A 210          2H6         A 210  24.324  24.242  14.520
  549    H2     A 210           H2         A 210  22.277  20.915  18.021
  550   1H5*    G 211          1H5*        G 211  20.197  15.473  13.061
  551   2H5*    G 211          2H5*        G 211  18.553  15.369  12.431
  552    H4*    G 211           H4*        G 211  18.499  15.730  14.813
  553    H3*    G 211           H3*        G 211  17.513  17.996  13.101
  554    H2*    G 211           H2*        G 211  16.851  19.178  15.061
  555   2HO*    G 211          2HO*        G 211  16.743  18.007  16.993
  556    H1*    G 211           H1*        G 211  19.320  18.812  16.317
  557    H8     G 211           H8         G 211  20.130  19.357  12.777
  558    H1     G 211           H1         G 211  18.527  24.848  15.802
  559   1H2     G 211          1H2         G 211  17.691  24.407  17.635
  560   2H2     G 211          2H2         G 211  17.458  22.789  18.258
  561   1H5*    G 212          1H5*        G 212  13.827  17.049  15.818
  562   2H5*    G 212          2H5*        G 212  12.591  17.061  14.560
  563    H4*    G 212           H4*        G 212  11.970  18.504  16.413
  564    H3*    G 212           H3*        G 212  12.487  19.797  13.751
  565    H2*    G 212           H2*        G 212  11.807  21.901  14.640
  566   2HO*    G 212          2HO*        G 212  11.141  21.696  17.034
  567    H1*    G 212           H1*        G 212  13.462  21.682  16.877
  568    H8     G 212           H8         G 212  15.234  20.207  13.960
  569    H1     G 212           H1         G 212  15.578  26.667  14.149
  570   1H2     G 212          1H2         G 212  14.270  27.385  15.573
  571   2H2     G 212          2H2         G 212  13.235  26.386  16.567
  572   1H5*    G 213          1H5*        G 213   8.051  20.821  14.598
  573   2H5*    G 213          2H5*        G 213   7.355  20.763  12.979
  574    H4*    G 213           H4*        G 213   7.006  22.912  14.195
  575    H3*    G 213           H3*        G 213   8.343  22.840  11.505
  576    H2*    G 213           H2*        G 213   8.399  25.223  11.473
  577   2HO*    G 213          2HO*        G 213   7.378  26.172  13.544
  578    H1*    G 213           H1*        G 213   9.516  25.402  14.023
  579    H8     G 213           H8         G 213  11.051  22.445  12.436
  580    H1     G 213           H1         G 213  13.602  28.008  10.334
  581   1H2     G 213          1H2         G 213  12.428  29.584  10.960
  582   2H2     G 213          2H2         G 213  10.970  29.422  11.912
  583   1H5*    G 214          1H5*        G 214   7.550  26.237   9.889
  584   2H5*    G 214          2H5*        G 214   6.226  25.731   8.840
  585    H4*    G 214           H4*        G 214   8.034  26.585   7.505
  586    H3*    G 214           H3*        G 214   7.505  23.636   7.286
  587    H2*    G 214           H2*        G 214   9.152  23.469   5.571
  588   2HO*    G 214          2HO*        G 214   9.986  25.462   4.729
  589    H1*    G 214           H1*        G 214  11.084  24.826   7.050
  590    H8     G 214           H8         G 214   9.090  22.755   9.402
  591    H1     G 214           H1         G 214  13.602  19.369   6.229
  592   1H2     G 214          1H2         G 214  14.382  20.519   4.705
  593   2H2     G 214          2H2         G 214  13.886  22.157   4.340
  594   1H5*    G 215          1H5*        G 215   7.006  25.000   3.090
  595   2H5*    G 215          2H5*        G 215   5.584  24.145   2.493
  596    H4*    G 215           H4*        G 215   7.570  23.762   1.102
  597    H3*    G 215           H3*        G 215   6.287  21.420   2.483
  598    H2*    G 215           H2*        G 215   7.776  19.947   1.348
  599   2HO*    G 215          2HO*        G 215   9.236  21.950   0.093
  600    H1*    G 215           H1*        G 215  10.038  21.436   2.039
  601    H8     G 215           H8         G 215   7.564  21.411   4.845
  602    H1     G 215           H1         G 215  11.364  16.174   4.686
  603   1H2     G 215          1H2         G 215  12.433  16.152   2.923
  604   2H2     G 215          2H2         G 215  12.316  17.370   1.674
  605   1H5*    C 216          1H5*        C 216   3.905  21.096  -1.676
  606   2H5*    C 216          2H5*        C 216   2.796  19.791  -1.253
  607    H4*    C 216           H4*        C 216   4.950  19.306  -2.643
  608    H3*    C 216           H3*        C 216   3.844  17.608  -0.412
  609    H2*    C 216           H2*        C 216   5.514  15.985  -0.862
  610   2HO*    C 216          2HO*        C 216   5.786  15.950  -3.023
  611    H1*    C 216           H1*        C 216   7.577  17.888  -1.003
  612   1H4     C 216          1H4         C 216   7.764  15.612   4.973
  613   2H4     C 216          2H4         C 216   6.590  16.822   5.439
  614    H5     C 216           H5         C 216   5.515  18.270   3.913
  615    H6     C 216           H6         C 216   5.301  18.919   1.540
  616   1H5*    U 217          1H5*        U 217   2.457  15.138  -3.870
  617   2H5*    U 217          2H5*        U 217   1.369  13.929  -3.189
  618    H4*    U 217           H4*        U 217   3.881  13.368  -3.544
  619    H3*    U 217           H3*        U 217   2.289  12.669  -1.071
  620    H2*    U 217           H2*        U 217   4.129  11.392  -0.328
  621   2HO*    U 217          2HO*        U 217   5.520  10.613  -1.886
  622    H1*    U 217           H1*        U 217   6.002  13.377  -1.208
  623    H3     U 217           H3         U 217   6.530  12.785   3.326
  624    H5     U 217           H5         U 217   3.346  15.473   2.902
  625    H6     U 217           H6         U 217   3.384  14.985   0.499
  626   1H5*    G 218          1H5*        G 218  -0.163   8.624  -2.863
  627   2H5*    G 218          2H5*        G 218  -0.255   8.196  -1.154
  628    H4*    G 218           H4*        G 218   0.836   6.375  -2.024
  629    H3*    G 218           H3*        G 218   2.858   8.313  -0.977
  630    H2*    G 218           H2*        G 218   4.648   7.069  -1.803
  631   2HO*    G 218          2HO*        G 218   3.536   4.805  -2.663
  632    H1*    G 218           H1*        G 218   3.034   6.220  -4.113
  633    H8     G 218           H8         G 218   3.852   9.860  -3.592
  634    H1     G 218           H1         G 218   8.121   6.688  -7.279
  635   1H2     G 218          1H2         G 218   7.709   4.667  -7.227
  636   2H2     G 218          2H2         G 218   6.402   3.941  -6.320
  637   1H5*    C 219          1H5*        C 219   3.949   7.547   1.424
  638   2H5*    C 219          2H5*        C 219   3.927   5.969   2.210
  639    H4*    C 219           H4*        C 219   4.826   6.897   4.007
  640    H3*    C 219           H3*        C 219   2.119   8.095   4.141
  641    H2*    C 219           H2*        C 219   2.750   9.859   5.550
  642   2HO*    C 219          2HO*        C 219   4.071   8.902   7.010
  643    H1*    C 219           H1*        C 219   5.053  10.590   4.245
  644   1H4     C 219          1H4         C 219   0.245  13.818   1.457
  645   2H4     C 219          2H4         C 219   0.365  12.690   0.125
  646    H5     C 219           H5         C 219   1.734  10.766   0.149
  647    H6     C 219           H6         C 219   3.341   9.436   1.471
  648   1H5*    G 220          1H5*        G 220   4.803   3.696   5.776
  649   2H5*    G 220          2H5*        G 220   5.284   5.394   5.776
  650    H4*    G 220           H4*        G 220   6.460   3.238   4.386
  651    H3*    G 220           H3*        G 220   6.965   6.224   4.376
  652    H2*    G 220           H2*        G 220   8.590   5.873   2.747
  653   2HO*    G 220          2HO*        G 220   9.555   3.728   2.676
  654    H1*    G 220           H1*        G 220   7.115   3.530   1.736
  655    H8     G 220           H8         G 220   6.743   4.016  -0.704
  656    H1     G 220           H1         G 220   6.982  10.420   0.201
  657   1H2     G 220          1H2         G 220   7.153  10.825   2.217
  658   2H2     G 220          2H2         G 220   7.221   9.610   3.473
  659   1H5*    G 221          1H5*        G 221  10.295   4.915   4.984
  660   2H5*    G 221          2H5*        G 221  11.522   5.663   6.006
  661    H4*    G 221           H4*        G 221  11.752   5.822   3.441
  662    H3*    G 221           H3*        G 221  12.182   8.067   5.389
  663    H2*    G 221           H2*        G 221  12.818   9.506   3.602
  664   2HO*    G 221          2HO*        G 221  12.322   7.445   1.719
  665    H1*    G 221           H1*        G 221  10.590   8.907   2.059
  666    H8     G 221           H8         G 221  10.293   9.057   5.867
  667    H1     G 221           H1         G 221   8.569  14.458   2.748
  668   1H2     G 221          1H2         G 221   8.951  14.242   0.733
  669   2H2     G 221          2H2         G 221   9.637  12.810  -0.002
  670   1H5*    C 222          1H5*        C 222  15.960   8.151   3.376
  671   2H5*    C 222          2H5*        C 222  17.152   8.774   4.515
  672    H4*    C 222           H4*        C 222  16.575  10.251   2.541
  673    H3*    C 222           H3*        C 222  16.432  11.270   5.382
  674    H2*    C 222           H2*        C 222  16.096  13.444   4.524
  675   2HO*    C 222          2HO*        C 222  16.285  13.401   1.988
  676    H1*    C 222           H1*        C 222  14.316  12.477   2.492
  677   1H4     C 222          1H4         C 222  10.584  15.338   6.825
  678   2H4     C 222          2H4         C 222  10.617  13.875   7.782
  679    H5     C 222           H5         C 222  11.946  11.993   7.266
  680    H6     C 222           H6         C 222  13.588  11.041   5.686
  681   1H5*    U 223          1H5*        U 223  19.859  13.650   3.523
  682   2H5*    U 223          2H5*        U 223  20.511  14.618   4.847
  683    H4*    U 223           H4*        U 223  19.100  15.704   2.912
  684    H3*    U 223           H3*        U 223  19.023  16.425   5.840
  685    H2*    U 223           H2*        U 223  17.556  18.205   5.327
  686   2HO*    U 223          2HO*        U 223  18.652  18.870   3.460
  687    H1*    U 223           H1*        U 223  15.966  16.667   3.587
  688    H3     U 223           H3         U 223  13.580  17.788   7.385
  689    H5     U 223           H5         U 223  15.496  14.165   8.241
  690    H6     U 223           H6         U 223  16.769  14.461   6.167
  691   1H5*    U 224          1H5*        U 224  20.295  15.838   0.617
  692   2H5*    U 224          2H5*        U 224  20.283  17.494   0.012
  693    H4*    U 224           H4*        U 224  18.339  15.546  -0.382
  694    H3*    U 224           H3*        U 224  18.354  18.532  -0.848
  695    H2*    U 224           H2*        U 224  16.148  18.347  -1.677
  696   2HO*    U 224          2HO*        U 224  16.527  16.454  -2.868
  697    H1*    U 224           H1*        U 224  15.382  16.553   0.402
  698    H3     U 224           H3         U 224  12.717  20.119   1.216
  699    H5     U 224           H5         U 224  16.534  21.465   2.291
  700    H6     U 224           H6         U 224  17.422  19.366   1.387
  701   1H5*    A 225          1H5*        A 225  19.794  17.134  -5.327
  702   2H5*    A 225          2H5*        A 225  19.947  18.727  -6.066
  703    H4*    A 225           H4*        A 225  17.914  17.278  -6.668
  704    H3*    A 225           H3*        A 225  17.790  20.196  -5.940
  705    H2*    A 225           H2*        A 225  15.465  20.205  -6.420
  706   2HO*    A 225          2HO*        A 225  14.617  18.294  -7.485
  707    H1*    A 225           H1*        A 225  14.958  17.874  -4.957
  708    H8     A 225           H8         A 225  17.514  20.290  -3.527
  709   1H6     A 225          1H6         A 225  12.774  22.699  -0.259
  710   2H6     A 225          2H6         A 225  14.507  22.756  -0.495
  711    H2     A 225           H2         A 225  11.130  19.677  -3.071
  712   1H5*    G 226          1H5*        G 226  16.145  19.029  -9.551
  713   2H5*    G 226          2H5*        G 226  16.038  20.114 -10.938
  714    H4*    G 226           H4*        G 226  13.852  19.248 -10.352
  715    H3*    G 226           H3*        G 226  14.325  22.190 -10.038
  716    H2*    G 226           H2*        G 226  12.064  22.516  -9.360
  717   2HO*    G 226          2HO*        G 226  10.838  21.062 -10.414
  718    H1*    G 226           H1*        G 226  12.173  20.478  -7.449
  719    H8     G 226           H8         G 226  15.459  22.108  -7.285
  720    H1     G 226           H1         G 226  10.834  25.620  -4.428
  721   1H2     G 226          1H2         G 226   8.983  24.858  -4.928
  722   2H2     G 226          2H2         G 226   8.724  23.474  -5.965
  723   1H5*    G 227          1H5*        G 227  13.057  24.087 -10.448
  724   2H5*    G 227          2H5*        G 227  12.404  24.005 -12.083
  725    H4*    G 227           H4*        G 227  12.767  26.314 -11.173
  726    H3*    G 227           H3*        G 227  13.943  25.422 -13.788
  727    H2*    G 227           H2*        G 227  14.775  27.622 -14.168
  728   2HO*    G 227          2HO*        G 227  14.177  29.124 -12.240
  729    H1*    G 227           H1*        G 227  15.963  27.801 -11.655
  730    H8     G 227           H8         G 227  15.992  24.414 -13.392
  731    H1     G 227           H1         G 227  21.234  28.063 -14.436
  732   1H2     G 227          1H2         G 227  20.952  29.927 -13.603
  733   2H2     G 227          2H2         G 227  19.511  30.428 -12.748
  734   1H5*    A 228          1H5*        A 228  12.067  29.317 -14.042
  735   2H5*    A 228          2H5*        A 228  11.361  29.553 -15.640
  736    H4*    A 228           H4*        A 228  12.963  31.312 -15.064
  737    H3*    A 228           H3*        A 228  13.544  29.543 -17.422
  738    H2*    A 228           H2*        A 228  15.472  30.834 -17.929
  739   2HO*    A 228          2HO*        A 228  15.712  32.729 -16.284
  740    H1*    A 228           H1*        A 228  16.393  30.803 -15.272
  741    H8     A 228           H8         A 228  14.991  27.470 -16.152
  742   1H6     A 228          1H6         A 228  20.578  26.070 -18.551
  743   2H6     A 228          2H6         A 228  19.022  25.409 -18.104
  744    H2     A 228           H2         A 228  20.517  30.412 -17.613
  745   1H5*    G 229          1H5*        G 229  13.622  33.777 -19.116
  746   2H5*    G 229          2H5*        G 229  12.698  33.587 -20.606
  747    H4*    G 229           H4*        G 229  14.819  34.646 -21.066
  748    H3*    G 229           H3*        G 229  14.418  31.884 -22.176
  749    H2*    G 229           H2*        G 229  16.510  32.035 -23.308
  750   2HO*    G 229          2HO*        G 229  17.242  34.498 -22.284
  751    H1*    G 229           H1*        G 229  17.883  32.856 -21.024
  752    H8     G 229           H8         G 229  15.361  30.413 -19.882
  753    H1     G 229           H1         G 229  20.506  27.596 -22.615
  754   1H2     G 229          1H2         G 229  21.650  29.025 -23.567
  755   2H2     G 229          2H2         G 229  21.270  30.732 -23.618
  756   1H5*    G 230          1H5*        G 230  15.448  34.388 -25.762
  757   2H5*    G 230          2H5*        G 230  14.284  33.864 -26.978
  758    H4*    G 230           H4*        G 230  16.538  33.723 -27.845
  759    H3*    G 230           H3*        G 230  15.061  31.135 -27.454
  760    H2*    G 230           H2*        G 230  16.870  29.953 -28.459
  761   2HO*    G 230          2HO*        G 230  18.658  31.406 -29.247
  762    H1*    G 230           H1*        G 230  18.789  31.173 -26.844
  763    H8     G 230           H8         G 230  15.782  30.655 -24.748
  764    H1     G 230           H1         G 230  19.285  25.265 -25.499
  765   1H2     G 230          1H2         G 230  20.695  25.561 -26.975
  766   2H2     G 230          2H2         G 230  20.898  27.047 -27.875
  767   1H5*    G 231          1H5*        G 231  16.702  31.028 -31.369
  768   2H5*    G 231          2H5*        G 231  15.384  30.731 -32.502
  769    H4*    G 231           H4*        G 231  17.083  29.206 -33.065
  770    H3*    G 231           H3*        G 231  14.824  27.909 -31.569
  771    H2*    G 231           H2*        G 231  15.856  25.780 -31.858
  772   2HO*    G 231          2HO*        G 231  17.362  25.610 -33.476
  773    H1*    G 231           H1*        G 231  18.335  26.666 -30.934
  774    H8     G 231           H8         G 231  15.634  28.347 -28.992
  775    H1     G 231           H1         G 231  16.980  22.379 -26.881
  776   1H2     G 231          1H2         G 231  18.215  21.432 -28.234
  777   2H2     G 231          2H2         G 231  18.798  22.148 -29.721
  778   1H5*    C 232          1H5*        C 232  15.653  25.676 -35.035
  779   2H5*    C 232          2H5*        C 232  14.204  25.040 -35.813
  780    H4*    C 232           H4*        C 232  15.732  23.243 -35.294
  781    H3*    C 232           H3*        C 232  13.152  23.288 -33.741
  782    H2*    C 232           H2*        C 232  13.718  21.192 -32.776
  783   2HO*    C 232          2HO*        C 232  16.156  20.770 -33.860
  784    H1*    C 232           H1*        C 232  16.345  22.019 -32.164
  785   1H4     C 232          1H4         C 232  13.055  22.800 -26.741
  786   2H4     C 232          2H4         C 232  12.511  24.360 -27.318
  787    H5     C 232           H5         C 232  12.957  25.190 -29.484
  788    H6     C 232           H6         C 232  14.044  24.721 -31.652
  789   1H5*    A 233          1H5*        A 233  13.162  19.359 -35.937
  790   2H5*    A 233          2H5*        A 233  11.516  19.181 -36.542
  791    H4*    A 233           H4*        A 233  12.174  17.207 -35.318
  792    H3*    A 233           H3*        A 233   9.987  18.886 -34.146
  793    H2*    A 233           H2*        A 233   9.725  17.362 -32.343
  794   2HO*    A 233          2HO*        A 233  11.276  15.421 -32.558
  795    H1*    A 233           H1*        A 233  12.483  17.256 -31.814
  796    H8     A 233           H8         A 233  11.562  20.753 -32.647
  797   1H6     A 233          1H6         A 233   9.899  21.455 -26.672
  798   2H6     A 233          2H6         A 233  10.185  22.307 -28.173
  799    H2     A 233           H2         A 233  10.641  17.137 -27.410
  800   1H5*    G 234          1H5*        G 234   8.011  14.673 -34.514
  801   2H5*    G 234          2H5*        G 234   6.513  15.160 -35.307
  802    H4*    G 234           H4*        G 234   5.965  13.799 -33.424
  803    H3*    G 234           H3*        G 234   5.293  16.710 -33.126
  804    H2*    G 234           H2*        G 234   4.267  16.265 -31.022
  805   2HO*    G 234          2HO*        G 234   3.490  14.241 -30.844
  806    H1*    G 234           H1*        G 234   6.465  14.824 -30.070
  807    H8     G 234           H8         G 234   7.661  17.683 -32.141
  808    H1     G 234           H1         G 234   6.158  19.357 -26.072
  809   1H2     G 234          1H2         G 234   5.185  17.792 -25.147
  810   2H2     G 234          2H2         G 234   4.829  16.255 -25.903
  811   1H    GLY  15          1H        GLY  15   3.092  -1.489  -2.405
  812   1HA   GLY  15          1HA       GLY  15   4.855  -2.336  -0.321
  813   2HA   GLY  15          2HA       GLY  15   5.133  -2.501  -2.048
  814    H    ARG  16           H        ARG  16   7.370  -1.987  -1.368
  815    HA   ARG  16           HA       ARG  16   7.778   0.889  -0.916
  816   1HB   ARG  16          2HB       ARG  16  10.138   0.181  -0.349
  817   2HB   ARG  16          3HB       ARG  16   8.891  -0.376   0.759
  818   1HG   ARG  16          2HG       ARG  16   9.399  -2.271  -1.380
  819   2HG   ARG  16          3HG       ARG  16  10.838  -1.922  -0.421
  820   1HD   ARG  16          2HD       ARG  16   8.161  -2.776   0.677
  821   2HD   ARG  16          3HD       ARG  16   9.565  -3.823   0.474
  822    HE   ARG  16           HE       ARG  16  10.498  -1.802   2.021
  823   1HH1  ARG  16          2HH1      ARG  16   7.772  -3.956   2.251
  824   2HH1  ARG  16          1HH1      ARG  16   7.750  -3.953   3.984
  825   1HH2  ARG  16          2HH2      ARG  16  10.478  -1.789   4.303
  826   2HH2  ARG  16          1HH2      ARG  16   9.288  -2.720   5.149
  827    H    ALA  17           H        ALA  17   7.634   1.713  -2.968
  828    HA   ALA  17           HA       ALA  17   9.260   0.533  -5.088
  829   1HB   ALA  17          1HB       ALA  17   7.270   1.046  -6.061
  830   2HB   ALA  17          2HB       ALA  17   6.974   2.420  -4.995
  831   3HB   ALA  17          3HB       ALA  17   8.108   2.573  -6.337
  832    H    ARG  18           H        ARG  18  10.287   2.105  -2.697
  833    HA   ARG  18           HA       ARG  18  11.188   4.620  -3.318
  834   1HB   ARG  18          2HB       ARG  18  11.994   2.493  -1.507
  835   2HB   ARG  18          3HB       ARG  18  13.370   3.440  -2.054
  836   1HG   ARG  18          2HG       ARG  18  11.406   5.312  -1.412
  837   2HG   ARG  18          3HG       ARG  18  11.339   4.101  -0.131
  838   1HD   ARG  18          2HD       ARG  18  13.742   5.676  -1.040
  839   2HD   ARG  18          3HD       ARG  18  12.905   5.800   0.507
  840    HE   ARG  18           HE       ARG  18  14.915   3.911  -0.201
  841   1HH1  ARG  18          2HH1      ARG  18  12.041   4.346   1.714
  842   2HH1  ARG  18          1HH1      ARG  18  12.478   3.141   2.880
  843   1HH2  ARG  18          2HH2      ARG  18  15.502   2.322   1.326
  844   2HH2  ARG  18          1HH2      ARG  18  14.447   1.990   2.659
  845    H    GLY  19           H        GLY  19  12.610   5.494  -4.700
  846   1HA   GLY  19          1HA       GLY  19  14.738   5.413  -5.855
  847   2HA   GLY  19          2HA       GLY  19  14.486   3.689  -6.087
  848    H    LEU  20           H        LEU  20  11.646   4.113  -6.823
  849    HA   LEU  20           HA       LEU  20  12.115   5.097  -9.558
  850   1HB   LEU  20          2HB       LEU  20  10.716   2.768  -8.463
  851   2HB   LEU  20          3HB       LEU  20   9.811   3.640  -9.700
  852    HG   LEU  20           HG       LEU  20  12.580   3.099 -10.456
  853   1HD1  LEU  20          1HD1      LEU  20  11.782   1.088  -9.002
  854   2HD1  LEU  20          2HD1      LEU  20  12.567   0.801 -10.555
  855   3HD1  LEU  20          3HD1      LEU  20  10.812   0.696 -10.423
  856   1HD2  LEU  20          1HD2      LEU  20  11.235   3.829 -12.182
  857   2HD2  LEU  20          2HD2      LEU  20   9.844   2.890 -11.638
  858   3HD2  LEU  20          3HD2      LEU  20  11.203   2.081 -12.419
  859    H    CYS  21           H        CYS  21  11.142   7.015 -10.099
  860    HA   CYS  21           HA       CYS  21   9.313   8.198  -8.326
  861   1HB   CYS  21          2HB       CYS  21  10.879   9.457  -9.802
  862   2HB   CYS  21          3HB       CYS  21   9.935   8.970 -11.196
  863    H    TYR  22           H        TYR  22   7.095   8.633  -8.725
  864    HA   TYR  22           HA       TYR  22   5.773   6.705 -10.519
  865   1HB   TYR  22          2HB       TYR  22   5.036   6.010  -8.455
  866   2HB   TYR  22          3HB       TYR  22   5.159   7.617  -7.749
  867    HD1  TYR  22           HD1      TYR  22   3.184   5.824 -10.371
  868    HD2  TYR  22           HD2      TYR  22   3.193   8.713  -7.248
  869    HE1  TYR  22           HE1      TYR  22   0.758   6.123 -10.649
  870    HE2  TYR  22           HE2      TYR  22   0.768   9.019  -7.515
  871    HH   TYR  22           HH       TYR  22  -1.084   8.268  -8.512
  872    H    THR  23           H        THR  23   6.068  10.013  -9.569
  873    HA   THR  23           HA       THR  23   3.671  11.029 -10.649
  874    HB   THR  23           HB       THR  23   6.341  12.409 -10.312
  875    HG1  THR  23           HG1      THR  23   5.678  11.955  -8.297
  876   1HG2  THR  23          1HG2      THR  23   5.103  13.738 -11.820
  877   2HG2  THR  23          2HG2      THR  23   4.844  14.470 -10.237
  878   3HG2  THR  23          3HG2      THR  23   3.594  13.455 -10.954
  879    H    CYS  24           H        CYS  24   6.970  10.606 -12.091
  880    HA   CYS  24           HA       CYS  24   5.721  11.237 -14.664
  881   1HB   CYS  24          2HB       CYS  24   7.920  11.883 -15.474
  882   2HB   CYS  24          3HB       CYS  24   7.513  12.804 -14.039
  883    H    GLY  25           H        GLY  25   7.783   9.096 -12.781
  884   1HA   GLY  25          1HA       GLY  25   7.703   6.717 -13.046
  885   2HA   GLY  25          2HA       GLY  25   7.313   6.955 -14.743
  886    H    SER  26           H        SER  26   9.879   8.622 -13.009
  887    HA   SER  26           HA       SER  26  11.806   7.451 -14.877
  888   1HB   SER  26          2HB       SER  26  11.547   9.988 -14.514
  889   2HB   SER  26          3HB       SER  26  12.368   9.721 -12.977
  890    HG   SER  26           HG       SER  26  13.363   9.673 -15.548
  891    HA   PRO  27           HA       PRO  27  13.191   4.816 -11.562
  892   1HB   PRO  27          2HB       PRO  27  15.187   3.633 -12.971
  893   2HB   PRO  27          3HB       PRO  27  13.484   3.205 -13.174
  894   1HG   PRO  27          2HG       PRO  27  15.198   5.003 -14.845
  895   2HG   PRO  27          3HG       PRO  27  14.022   3.781 -15.362
  896   1HD   PRO  27          2HD       PRO  27  13.451   6.428 -15.321
  897   2HD   PRO  27          3HD       PRO  27  12.224   5.182 -15.012
  898    H    GLY  28           H        GLY  28  14.012   6.479 -10.205
  899   1HA   GLY  28          1HA       GLY  28  16.684   6.417  -9.599
  900   2HA   GLY  28          2HA       GLY  28  16.527   7.742 -10.744
  901    H    HIS  29           H        HIS  29  14.687   9.308 -10.186
  902    HA   HIS  29           HA       HIS  29  15.057  10.081  -7.401
  903   1HB   HIS  29          2HB       HIS  29  14.213  12.240  -8.047
  904   2HB   HIS  29          3HB       HIS  29  15.385  11.726  -9.256
  905    HD1  HIS  29           HD1      HIS  29  14.627  11.847 -11.615
  906    HD2  HIS  29           HD2      HIS  29  11.436  11.788  -8.956
  907    HE1  HIS  29           HE1      HIS  29  12.573  12.187 -13.023
  908    H    TYR  30           H        TYR  30  12.850  11.478  -6.774
  909    HA   TYR  30           HA       TYR  30  10.586   9.632  -7.075
  910   1HB   TYR  30          2HB       TYR  30  12.115   9.919  -4.725
  911   2HB   TYR  30          3HB       TYR  30  10.602  10.767  -4.429
  912    HD1  TYR  30           HD1      TYR  30  11.736   7.545  -5.959
  913    HD2  TYR  30           HD2      TYR  30   8.908   9.533  -3.481
  914    HE1  TYR  30           HE1      TYR  30  10.627   5.396  -5.511
  915    HE2  TYR  30           HE2      TYR  30   7.791   7.390  -3.024
  916    HH   TYR  30           HH       TYR  30   7.599   5.221  -3.763
  917    H    GLN  31           H        GLN  31   8.586  10.724  -5.920
  918    HA   GLN  31           HA       GLN  31   7.812  12.903  -7.412
  919   1HB   GLN  31          2HB       GLN  31   6.175  11.574  -6.260
  920   2HB   GLN  31          3HB       GLN  31   6.852  12.002  -4.695
  921   1HG   GLN  31          2HG       GLN  31   5.626  13.842  -4.568
  922   2HG   GLN  31          3HG       GLN  31   6.091  14.350  -6.191
  923   1HE2  GLN  31          1HE2      GLN  31   4.285  14.844  -7.218
  924   2HE2  GLN  31          2HE2      GLN  31   2.868  13.860  -7.301
  925    H    ALA  32           H        ALA  32   9.207  12.883  -4.153
  926    HA   ALA  32           HA       ALA  32   9.011  15.598  -3.583
  927   1HB   ALA  32          1HB       ALA  32  11.090  15.153  -2.150
  928   2HB   ALA  32          2HB       ALA  32   9.632  14.222  -1.803
  929   3HB   ALA  32          3HB       ALA  32  10.953  13.486  -2.711
  930    H    GLN  33           H        GLN  33  11.150  13.910  -5.727
  931    HA   GLN  33           HA       GLN  33  12.510  16.454  -6.319
  932   1HB   GLN  33          2HB       GLN  33  13.644  13.678  -6.123
  933   2HB   GLN  33          3HB       GLN  33  14.440  14.918  -7.081
  934   1HG   GLN  33          2HG       GLN  33  15.336  15.848  -5.282
  935   2HG   GLN  33          3HG       GLN  33  13.780  15.900  -4.452
  936   1HE2  GLN  33          1HE2      GLN  33  13.064  13.865  -3.448
  937   2HE2  GLN  33          2HE2      GLN  33  14.258  12.839  -2.736
  938    H    CYS  34           H        CYS  34  10.038  15.337  -7.559
  939    HA   CYS  34           HA       CYS  34  10.935  14.306 -10.082
  940   1HB   CYS  34          2HB       CYS  34   8.823  13.539  -8.995
  941   2HB   CYS  34          3HB       CYS  34   8.145  15.140  -9.223
  942    HA   PRO  35           HA       PRO  35  11.589  18.449 -11.637
  943   1HB   PRO  35          2HB       PRO  35  12.198  17.689 -14.171
  944   2HB   PRO  35          3HB       PRO  35  13.333  17.538 -12.824
  945   1HG   PRO  35          2HG       PRO  35  11.574  15.455 -14.061
  946   2HG   PRO  35          3HG       PRO  35  13.267  15.330 -13.547
  947   1HD   PRO  35          2HD       PRO  35  11.217  14.388 -12.051
  948   2HD   PRO  35          3HD       PRO  35  12.704  15.038 -11.331
  949    H    LYS  36           H        LYS  36   9.207  16.188 -12.620
  950    HA   LYS  36           HA       LYS  36   7.948  18.075 -14.466
  951   1HB   LYS  36          2HB       LYS  36   8.221  15.518 -14.868
  952   2HB   LYS  36          3HB       LYS  36   6.848  15.368 -13.780
  953   1HG   LYS  36          2HG       LYS  36   5.435  16.569 -15.244
  954   2HG   LYS  36          3HG       LYS  36   6.796  17.098 -16.234
  955   1HD   LYS  36          2HD       LYS  36   6.308  15.360 -17.554
  956   2HD   LYS  36          3HD       LYS  36   7.019  14.356 -16.289
  957   1HE   LYS  36          2HE       LYS  36   4.984  13.339 -16.498
  958   2HE   LYS  36          3HE       LYS  36   4.596  14.535 -15.264
  959   1HZ   LYS  36          1HZ       LYS  36   4.254  15.632 -17.853
  960   2HZ   LYS  36          2HZ       LYS  36   3.120  15.462 -16.610
  961   3HZ   LYS  36          3HZ       LYS  36   3.362  14.201 -17.710
  962    H    LYS  37           H        LYS  37   7.996  17.621 -11.243
  963    HA   LYS  37           HA       LYS  37   5.388  17.462 -10.356
  964   1HB   LYS  37          2HB       LYS  37   7.895  18.635  -9.317
  965   2HB   LYS  37          3HB       LYS  37   6.414  19.251  -8.595
  966   1HG   LYS  37          2HG       LYS  37   6.142  16.457  -8.685
  967   2HG   LYS  37          3HG       LYS  37   7.777  16.786  -8.109
  968   1HD   LYS  37          2HD       LYS  37   6.703  16.912  -6.113
  969   2HD   LYS  37          3HD       LYS  37   6.443  18.578  -6.640
  970   1HE   LYS  37          2HE       LYS  37   4.397  16.887  -7.722
  971   2HE   LYS  37          3HE       LYS  37   4.507  16.643  -5.978
  972   1HZ   LYS  37          1HZ       LYS  37   4.161  18.944  -5.599
  973   2HZ   LYS  37          2HZ       LYS  37   2.968  18.447  -6.689
  974   3HZ   LYS  37          3HZ       LYS  37   4.307  19.319  -7.243
  975    H    ARG  38           H        ARG  38   3.866  19.078  -9.689
  976    HA   ARG  38           HA       ARG  38   3.175  20.918 -11.627
  977   1HB   ARG  38          2HB       ARG  38   2.272  20.221  -8.971
  978   2HB   ARG  38          3HB       ARG  38   2.155  21.956  -9.230
  979   1HG   ARG  38          2HG       ARG  38   1.002  19.883 -11.082
  980   2HG   ARG  38          3HG       ARG  38   0.097  20.705  -9.810
  981   1HD   ARG  38          2HD       ARG  38   1.589  22.279 -11.871
  982   2HD   ARG  38          3HD       ARG  38  -0.003  21.614 -12.237
  983    HE   ARG  38           HE       ARG  38  -0.206  22.967  -9.817
  984   1HH1  ARG  38          2HH1      ARG  38   0.482  23.686 -13.154
  985   2HH1  ARG  38          1HH1      ARG  38  -0.154  25.296 -13.074
  986   1HH2  ARG  38          2HH2      ARG  38  -1.047  25.083  -9.700
  987   2HH2  ARG  38          1HH2      ARG  38  -1.023  26.090 -11.108
  988    H    LYS  39           H        LYS  39   4.316  22.602 -12.309
  989    HA   LYS  39           HA       LYS  39   5.150  24.634 -10.428
  990   1HB   LYS  39          2HB       LYS  39   7.041  22.859 -10.757
  991   2HB   LYS  39          3HB       LYS  39   7.267  23.650 -12.311
  992   1HG   LYS  39          2HG       LYS  39   7.113  25.577 -10.166
  993   2HG   LYS  39          3HG       LYS  39   8.384  24.386  -9.882
  994   1HD   LYS  39          2HD       LYS  39   9.454  24.902 -11.928
  995   2HD   LYS  39          3HD       LYS  39   8.064  25.821 -12.507
  996   1HE   LYS  39          2HE       LYS  39   9.226  26.763  -9.975
  997   2HE   LYS  39          3HE       LYS  39  10.274  26.919 -11.383
  998   1HZ   LYS  39          1HZ       LYS  39   7.605  28.117 -10.948
  999   2HZ   LYS  39          2HZ       LYS  39   8.286  27.999 -12.491
 1000   3HZ   LYS  39          3HZ       LYS  39   9.066  28.900 -11.291
 1001    H    SER  40           H        SER  40   5.671  26.645 -11.441
 1002    HA   SER  40           HA       SER  40   5.750  27.094 -14.198
 1003   1HB   SER  40          2HB       SER  40   3.553  26.563 -14.619
 1004   2HB   SER  40          3HB       SER  40   3.027  26.989 -12.990
 1005    HG   SER  40           HG       SER  40   3.254  28.562 -15.251
 1006    H    GLY  41           H        GLY  41   6.592  29.060 -14.484
 1007   1HA   GLY  41          1HA       GLY  41   5.776  31.437 -13.314
 1008   2HA   GLY  41          2HA       GLY  41   7.030  30.787 -12.269
 1009    H    ASN  42           H        ASN  42   7.834  33.027 -13.083
 1010    HA   ASN  42           HA       ASN  42   9.666  32.479 -15.309
 1011   1HB   ASN  42          2HB       ASN  42   7.557  34.473 -15.251
 1012   2HB   ASN  42          3HB       ASN  42   9.137  35.217 -15.477
 1013   1HD2  ASN  42          1HD2      ASN  42  10.513  34.210 -17.174
 1014   2HD2  ASN  42          2HD2      ASN  42   9.731  33.678 -18.621
 1015    H    SER  43           H        SER  43  11.589  33.817 -15.303
 1016    HA   SER  43           HA       SER  43  12.158  35.203 -12.788
 1017   1HB   SER  43          2HB       SER  43  13.247  32.622 -13.564
 1018   2HB   SER  43          3HB       SER  43  14.520  33.817 -13.318
 1019    HG   SER  43           HG       SER  43  14.181  33.668 -11.261
 1020    H    ARG  44           H        ARG  44  14.118  36.518 -12.887
 1021    HA   ARG  44           HA       ARG  44  15.197  37.056 -15.533
 1022   1HB   ARG  44          2HB       ARG  44  13.380  38.895 -14.056
 1023   2HB   ARG  44          3HB       ARG  44  14.750  39.605 -14.898
 1024   1HG   ARG  44          2HG       ARG  44  13.680  37.890 -16.768
 1025   2HG   ARG  44          3HG       ARG  44  12.262  38.547 -15.949
 1026   1HD   ARG  44          2HD       ARG  44  14.504  40.253 -17.013
 1027   2HD   ARG  44          3HD       ARG  44  13.068  39.847 -17.950
 1028    HE   ARG  44           HE       ARG  44  12.128  40.894 -15.592
 1029   1HH1  ARG  44          2HH1      ARG  44  14.201  41.979 -18.170
 1030   2HH1  ARG  44          1HH1      ARG  44  13.776  43.648 -17.984
 1031   1HH2  ARG  44          2HH2      ARG  44  11.561  43.088 -15.339
 1032   2HH2  ARG  44          1HH2      ARG  44  12.275  44.278 -16.373
 1033    H    GLU  45           H        GLU  45  17.321  37.234 -15.316
 1034    HA   GLU  45           HA       GLU  45  19.386  37.557 -14.415
 1035   1HB   GLU  45          2HB       GLU  45  17.970  39.785 -12.940
 1036   2HB   GLU  45          3HB       GLU  45  19.711  39.619 -13.113
 1037   1HG   GLU  45          2HG       GLU  45  19.297  41.107 -14.777
 1038   2HG   GLU  45          3HG       GLU  45  19.120  39.600 -15.676
 1039    H    ARG  46           H        ARG  46  19.551  35.621 -13.288
 1040    HA   ARG  46           HA       ARG  46  18.785  35.666 -10.452
 1041   1HB   ARG  46          2HB       ARG  46  18.162  33.773 -12.178
 1042   2HB   ARG  46          3HB       ARG  46  19.788  33.206 -11.821
 1043   1HG   ARG  46          2HG       ARG  46  19.280  32.732  -9.614
 1044   2HG   ARG  46          3HG       ARG  46  17.883  33.811  -9.601
 1045   1HD   ARG  46          2HD       ARG  46  17.362  31.908 -11.588
 1046   2HD   ARG  46          3HD       ARG  46  18.024  31.006 -10.226
 1047    HE   ARG  46           HE       ARG  46  15.964  32.889  -9.514
 1048   1HH1  ARG  46          2HH1      ARG  46  16.672  29.638 -10.539
 1049   2HH1  ARG  46          1HH1      ARG  46  15.199  28.980  -9.909
 1050   1HH2  ARG  46          2HH2      ARG  46  14.019  32.034  -8.681
 1051   2HH2  ARG  46          1HH2      ARG  46  13.690  30.343  -8.853
 1052    H    CYS  47           H        CYS  47  20.398  34.229  -9.007
 1053    HA   CYS  47           HA       CYS  47  23.106  35.034  -9.783
 1054   1HB   CYS  47          2HB       CYS  47  22.243  36.518  -8.007
 1055   2HB   CYS  47          3HB       CYS  47  21.922  35.129  -6.988
 1056    H    GLN  48           H        GLN  48  24.271  33.259 -10.072
 1057    HA   GLN  48           HA       GLN  48  23.449  30.725  -8.876
 1058   1HB   GLN  48          2HB       GLN  48  24.425  31.406 -11.389
 1059   2HB   GLN  48          3HB       GLN  48  25.785  30.613 -10.605
 1060   1HG   GLN  48          2HG       GLN  48  23.088  29.346 -10.518
 1061   2HG   GLN  48          3HG       GLN  48  24.068  29.229 -11.978
 1062   1HE2  GLN  48          1HE2      GLN  48  23.934  28.478  -8.560
 1063   2HE2  GLN  48          2HE2      GLN  48  25.099  27.203  -8.599
 1064    H    LEU  49           H        LEU  49  24.740  32.847  -7.303
 1065    HA   LEU  49           HA       LEU  49  27.104  31.327  -6.422
 1066   1HB   LEU  49          2HB       LEU  49  26.977  34.004  -7.341
 1067   2HB   LEU  49          3HB       LEU  49  27.305  34.049  -5.611
 1068    HG   LEU  49           HG       LEU  49  28.963  32.194  -7.207
 1069   1HD1  LEU  49          1HD1      LEU  49  30.468  34.276  -7.663
 1070   2HD1  LEU  49          2HD1      LEU  49  28.936  35.149  -7.620
 1071   3HD1  LEU  49          3HD1      LEU  49  29.177  33.850  -8.788
 1072   1HD2  LEU  49          1HD2      LEU  49  30.171  32.293  -5.351
 1073   2HD2  LEU  49          2HD2      LEU  49  28.986  33.400  -4.658
 1074   3HD2  LEU  49          3HD2      LEU  49  30.375  34.035  -5.540
 1075    H    CYS  50           H        CYS  50  24.303  33.378  -5.494
 1076    HA   CYS  50           HA       CYS  50  24.599  32.241  -2.816
 1077   1HB   CYS  50          2HB       CYS  50  24.110  34.273  -1.743
 1078   2HB   CYS  50          3HB       CYS  50  25.294  34.697  -2.963
 1079    H    ASN  51           H        ASN  51  23.060  31.871  -5.466
 1080    HA   ASN  51           HA       ASN  51  20.996  31.203  -6.148
 1081   1HB   ASN  51          2HB       ASN  51  20.956  30.718  -3.212
 1082   2HB   ASN  51          3HB       ASN  51  19.415  30.648  -4.064
 1083   1HD2  ASN  51          1HD2      ASN  51  21.682  28.753  -2.894
 1084   2HD2  ASN  51          2HD2      ASN  51  21.673  27.462  -4.044
 1085    H    GLY  52           H        GLY  52  21.582  34.081  -5.346
 1086   1HA   GLY  52          1HA       GLY  52  19.192  35.239  -4.368
 1087   2HA   GLY  52          2HA       GLY  52  20.462  36.083  -5.241
 1088    H    MET  53           H        MET  53  17.676  36.574  -5.508
 1089    HA   MET  53           HA       MET  53  17.289  35.768  -8.315
 1090   1HB   MET  53          2HB       MET  53  15.699  34.773  -6.521
 1091   2HB   MET  53          3HB       MET  53  14.989  36.382  -6.485
 1092   1HG   MET  53          2HG       MET  53  15.155  35.730  -9.185
 1093   2HG   MET  53          3HG       MET  53  14.627  34.252  -8.386
 1094   1HE   MET  53          1HE       MET  53  11.973  35.063 -10.118
 1095   2HE   MET  53          2HE       MET  53  11.894  36.824 -10.115
 1096   3HE   MET  53          3HE       MET  53  13.402  36.010 -10.535
 1097    H    GLY  54           H        GLY  54  18.035  37.592  -9.301
 1098   1HA   GLY  54          1HA       GLY  54  16.603  39.695  -9.989
 1099   2HA   GLY  54          2HA       GLY  54  17.083  40.198  -8.375
 1100    H    HIS  55           H        HIS  55  19.613  39.669  -8.072
 1101    HA   HIS  55           HA       HIS  55  20.906  41.356 -10.044
 1102   1HB   HIS  55          2HB       HIS  55  22.832  41.288  -8.490
 1103   2HB   HIS  55          3HB       HIS  55  21.346  41.802  -7.696
 1104    HD1  HIS  55           HD1      HIS  55  20.125  39.875  -6.243
 1105    HD2  HIS  55           HD2      HIS  55  24.080  39.177  -7.306
 1106    HE1  HIS  55           HE1      HIS  55  20.922  38.052  -4.706
 1107    H    ASN  56           H        ASN  56  23.449  40.555 -10.184
 1108    HA   ASN  56           HA       ASN  56  23.291  37.861 -11.369
 1109   1HB   ASN  56          2HB       ASN  56  24.279  40.402 -12.436
 1110   2HB   ASN  56          3HB       ASN  56  25.432  39.082 -12.607
 1111   1HD2  ASN  56          1HD2      ASN  56  22.734  40.578 -13.897
 1112   2HD2  ASN  56          2HD2      ASN  56  22.282  39.361 -15.037
 1113    H    ALA  57           H        ALA  57  25.118  36.509 -11.195
 1114    HA   ALA  57           HA       ALA  57  26.412  36.513  -8.725
 1115   1HB   ALA  57          1HB       ALA  57  28.034  34.903 -10.041
 1116   2HB   ALA  57          2HB       ALA  57  26.380  34.426  -9.656
 1117   3HB   ALA  57          3HB       ALA  57  26.774  35.017 -11.270
 1118    H    LYS  58           H        LYS  58  27.446  37.763 -11.853
 1119    HA   LYS  58           HA       LYS  58  30.133  38.271 -11.214
 1120   1HB   LYS  58          2HB       LYS  58  28.606  38.522 -13.458
 1121   2HB   LYS  58          3HB       LYS  58  28.828  40.209 -13.014
 1122   1HG   LYS  58          2HG       LYS  58  30.716  40.055 -14.193
 1123   2HG   LYS  58          3HG       LYS  58  31.360  39.245 -12.762
 1124   1HD   LYS  58          2HD       LYS  58  29.974  37.298 -14.273
 1125   2HD   LYS  58          3HD       LYS  58  30.985  38.210 -15.398
 1126   1HE   LYS  58          2HE       LYS  58  32.745  37.863 -13.411
 1127   2HE   LYS  58          3HE       LYS  58  31.748  36.431 -13.159
 1128   1HZ   LYS  58          1HZ       LYS  58  32.554  36.961 -15.900
 1129   2HZ   LYS  58          2HZ       LYS  58  32.457  35.495 -15.063
 1130   3HZ   LYS  58          3HZ       LYS  58  33.795  36.506 -14.843
 1131    H    GLN  59           H        GLN  59  27.232  39.858 -10.273
 1132    HA   GLN  59           HA       GLN  59  28.794  42.104  -9.180
 1133   1HB   GLN  59          2HB       GLN  59  26.814  42.429 -10.898
 1134   2HB   GLN  59          3HB       GLN  59  25.824  42.246  -9.456
 1135   1HG   GLN  59          2HG       GLN  59  26.070  44.477  -9.361
 1136   2HG   GLN  59          3HG       GLN  59  27.577  44.051  -8.552
 1137   1HE2  GLN  59          1HE2      GLN  59  28.965  45.568  -9.167
 1138   2HE2  GLN  59          2HE2      GLN  59  29.319  45.998 -10.803
 1139    H    CYS  60           H        CYS  60  27.923  39.217  -8.131
 1140    HA   CYS  60           HA       CYS  60  26.437  40.076  -5.801
 1141   1HB   CYS  60          2HB       CYS  60  25.809  37.977  -6.960
 1142   2HB   CYS  60          3HB       CYS  60  27.386  37.305  -6.600
 1143    H    ARG  61           H        ARG  61  27.333  40.145  -3.781
 1144    HA   ARG  61           HA       ARG  61  28.903  40.353  -2.148
 1145   1HB   ARG  61          2HB       ARG  61  29.361  37.890  -3.287
 1146   2HB   ARG  61          3HB       ARG  61  30.943  38.651  -3.377
 1147   1HG   ARG  61          2HG       ARG  61  31.271  38.523  -1.165
 1148   2HG   ARG  61          3HG       ARG  61  29.599  38.945  -0.792
 1149   1HD   ARG  61          2HD       ARG  61  29.967  36.712  -0.038
 1150   2HD   ARG  61          3HD       ARG  61  28.948  36.631  -1.475
 1151    HE   ARG  61           HE       ARG  61  31.689  36.372  -2.159
 1152   1HH1  ARG  61          2HH1      ARG  61  29.013  34.633  -0.767
 1153   2HH1  ARG  61          1HH1      ARG  61  29.608  33.076  -1.243
 1154   1HH2  ARG  61          2HH2      ARG  61  32.483  34.329  -2.790
 1155   2HH2  ARG  61          1HH2      ARG  61  31.583  32.905  -2.393
 1156    H    LYS  62           H        LYS  62  31.128  41.141  -1.701
 1157    HA   LYS  62           HA       LYS  62  31.767  43.331  -3.334
 1158   1HB   LYS  62          2HB       LYS  62  33.686  43.648  -1.893
 1159   2HB   LYS  62          3HB       LYS  62  32.297  43.181  -0.918
 1160   1HG   LYS  62          2HG       LYS  62  33.334  41.374  -0.148
 1161   2HG   LYS  62          3HG       LYS  62  33.840  40.882  -1.767
 1162   1HD   LYS  62          2HD       LYS  62  35.902  41.704  -1.478
 1163   2HD   LYS  62          3HD       LYS  62  35.293  43.206  -0.778
 1164   1HE   LYS  62          2HE       LYS  62  34.913  41.951   1.355
 1165   2HE   LYS  62          3HE       LYS  62  35.744  40.578   0.627
 1166   1HZ   LYS  62          1HZ       LYS  62  37.555  41.513   1.513
 1167   2HZ   LYS  62          2HZ       LYS  62  36.827  43.029   1.699
 1168   3HZ   LYS  62          3HZ       LYS  62  37.484  42.584   0.205
 1169    H    ARG  63           H        ARG  63  34.137  43.670  -4.096
 1170    HA   ARG  63           HA       ARG  63  35.761  43.188  -5.613
 1171   1HB   ARG  63          2HB       ARG  63  36.213  41.375  -3.869
 1172   2HB   ARG  63          3HB       ARG  63  35.363  40.276  -4.948
 1173   1HG   ARG  63          2HG       ARG  63  37.415  39.891  -5.762
 1174   2HG   ARG  63          3HG       ARG  63  37.130  41.381  -6.664
 1175   1HD   ARG  63          2HD       ARG  63  39.124  41.940  -5.740
 1176   2HD   ARG  63          3HD       ARG  63  38.081  42.439  -4.408
 1177    HE   ARG  63           HE       ARG  63  39.050  40.819  -3.135
 1178   1HH1  ARG  63          2HH1      ARG  63  39.484  39.991  -6.489
 1179   2HH1  ARG  63          1HH1      ARG  63  40.466  38.603  -6.154
 1180   1HH2  ARG  63          2HH2      ARG  63  40.340  38.994  -2.682
 1181   2HH2  ARG  63          1HH2      ARG  63  40.951  38.036  -3.988
 1182    H    ASP  64           H        ASP  64  34.891  43.714  -7.545
 1183    HA   ASP  64           HA       ASP  64  32.938  42.027  -8.836
 1184   1HB   ASP  64          2HB       ASP  64  32.858  43.705 -10.549
 1185   2HB   ASP  64          3HB       ASP  64  32.930  44.534  -8.996
  Start of MODEL   10
    1   1H5*    C 160          1H5*        C 160   5.695  34.033 -12.772
    2   2H5*    C 160          2H5*        C 160   6.322  32.397 -12.568
    3    H4*    C 160           H4*        C 160   3.970  32.321 -13.091
    4    H3*    C 160           H3*        C 160   5.847  31.247 -15.172
    5    H2*    C 160           H2*        C 160   3.998  30.567 -16.507
    6   2HO*    C 160          2HO*        C 160   2.153  31.647 -14.660
    7    H1*    C 160           H1*        C 160   2.716  33.059 -16.261
    8   1H4     C 160          1H4         C 160   5.902  33.220 -21.817
    9   2H4     C 160          2H4         C 160   7.263  33.914 -20.965
   10    H5     C 160           H5         C 160   7.360  34.157 -18.618
   11    H6     C 160           H6         C 160   6.164  33.790 -16.489
   12   1H5*    U 161          1H5*        U 161   3.128  27.825 -14.195
   13   2H5*    U 161          2H5*        U 161   4.115  26.368 -14.300
   14    H4*    U 161           H4*        U 161   2.153  26.296 -15.775
   15    H3*    U 161           H3*        U 161   4.901  26.159 -16.983
   16    H2*    U 161           H2*        U 161   3.939  25.795 -19.129
   17   2HO*    U 161          2HO*        U 161   1.894  24.977 -19.152
   18    H1*    U 161           H1*        U 161   2.128  27.928 -18.843
   19    H3     U 161           H3         U 161   5.242  28.993 -22.069
   20    H5     U 161           H5         U 161   6.921  30.195 -18.426
   21    H6     U 161           H6         U 161   5.087  29.015 -17.304
   22   1H5*    G 162          1H5*        G 162   2.679  22.808 -18.360
   23   2H5*    G 162          2H5*        G 162   3.580  21.309 -18.128
   24    H4*    G 162           H4*        G 162   2.831  21.298 -20.363
   25    H3*    G 162           H3*        G 162   5.758  21.931 -20.116
   26    H2*    G 162           H2*        G 162   5.954  21.935 -22.490
   27   2HO*    G 162          2HO*        G 162   3.823  21.405 -23.607
   28    H1*    G 162           H1*        G 162   3.774  23.643 -22.836
   29    H8     G 162           H8         G 162   5.607  24.692 -19.779
   30    H1     G 162           H1         G 162   8.341  26.822 -25.244
   31   1H2     G 162          1H2         G 162   7.470  25.885 -26.861
   32   2H2     G 162          2H2         G 162   6.190  24.698 -26.752
   33   1H5*    C 163          1H5*        C 163   5.355  18.942 -22.896
   34   2H5*    C 163          2H5*        C 163   6.455  17.581 -22.672
   35    H4*    C 163           H4*        C 163   6.722  18.321 -24.901
   36    H3*    C 163           H3*        C 163   8.999  19.088 -23.101
   37    H2*    C 163           H2*        C 163  10.153  20.053 -24.936
   38   2HO*    C 163          2HO*        C 163   9.663  19.206 -26.891
   39    H1*    C 163           H1*        C 163   7.837  21.413 -25.844
   40   1H4     C 163          1H4         C 163  11.144  25.860 -22.679
   41   2H4     C 163          2H4         C 163  10.574  25.197 -21.164
   42    H5     C 163           H5         C 163   9.278  23.231 -20.993
   43    H6     C 163           H6         C 163   8.196  21.399 -22.247
   44   1H5*    C 164          1H5*        C 164  10.882  16.779 -26.406
   45   2H5*    C 164          2H5*        C 164  12.198  15.849 -25.690
   46    H4*    C 164           H4*        C 164  13.002  17.281 -27.484
   47    H3*    C 164           H3*        C 164  13.972  17.867 -24.698
   48    H2*    C 164           H2*        C 164  15.433  19.528 -25.561
   49   2HO*    C 164          2HO*        C 164  16.149  18.928 -27.519
   50    H1*    C 164           H1*        C 164  13.421  20.664 -27.184
   51   1H4     C 164          1H4         C 164  13.569  24.345 -21.967
   52   2H4     C 164          2H4         C 164  12.569  23.177 -21.131
   53    H5     C 164           H5         C 164  11.936  21.094 -22.046
   54    H6     C 164           H6         C 164  12.108  19.602 -24.006
   55   1H5*    C 165          1H5*        C 165  17.410  17.128 -27.162
   56   2H5*    C 165          2H5*        C 165  18.688  16.277 -26.295
   57    H4*    C 165           H4*        C 165  19.534  18.352 -27.184
   58    H3*    C 165           H3*        C 165  19.330  18.157 -24.194
   59    H2*    C 165           H2*        C 165  20.353  20.291 -23.974
   60   2HO*    C 165          2HO*        C 165  20.693  21.061 -26.503
   61    H1*    C 165           H1*        C 165  18.679  21.445 -25.937
   62   1H4     C 165          1H4         C 165  16.044  23.038 -20.335
   63   2H4     C 165          2H4         C 165  15.214  21.498 -20.313
   64    H5     C 165           H5         C 165  15.564  19.793 -21.910
   65    H6     C 165           H6         C 165  16.808  19.139 -23.940
   66   1H5*    U 166          1H5*        U 166  23.341  19.480 -24.901
   67   2H5*    U 166          2H5*        U 166  24.412  18.380 -24.031
   68    H4*    U 166           H4*        U 166  25.007  20.590 -23.410
   69    H3*    U 166           H3*        U 166  23.526  19.092 -21.263
   70    H2*    U 166           H2*        U 166  23.856  20.915 -19.773
   71   2HO*    U 166          2HO*        U 166  25.201  22.723 -20.790
   72    H1*    U 166           H1*        U 166  23.026  22.817 -21.675
   73    H3     U 166           H3         U 166  19.833  22.717 -18.393
   74    H5     U 166           H5         U 166  18.889  19.521 -20.928
   75    H6     U 166           H6         U 166  21.027  19.917 -22.062
   76   1H5*    C 167          1H5*        C 167  27.234  20.322 -19.625
   77   2H5*    C 167          2H5*        C 167  27.901  19.201 -18.437
   78    H4*    C 167           H4*        C 167  27.525  21.359 -17.424
   79    H3*    C 167           H3*        C 167  25.774  19.111 -16.462
   80    H2*    C 167           H2*        C 167  24.832  20.545 -14.826
   81   2HO*    C 167          2HO*        C 167  26.027  22.325 -14.240
   82    H1*    C 167           H1*        C 167  24.516  22.663 -16.700
   83   1H4     C 167          1H4         C 167  18.707  20.070 -16.089
   84   2H4     C 167          2H4         C 167  19.156  18.842 -17.251
   85    H5     C 167           H5         C 167  21.329  18.611 -18.148
   86    H6     C 167           H6         C 167  23.629  19.510 -18.148
   87   1H5*    A 168          1H5*        A 168  28.481  19.804 -11.348
   88   2H5*    A 168          2H5*        A 168  27.441  20.759 -12.404
   89    H4*    A 168           H4*        A 168  29.420  21.875 -13.346
   90    H3*    A 168           H3*        A 168  30.952  20.052 -11.494
   91    H2*    A 168           H2*        A 168  32.612  21.730 -11.284
   92   2HO*    A 168          2HO*        A 168  32.711  22.477 -13.367
   93    H1*    A 168           H1*        A 168  30.682  23.784 -10.949
   94    H8     A 168           H8         A 168  31.156  20.323  -9.340
   95   1H6     A 168          1H6         A 168  32.185  23.493  -4.063
   96   2H6     A 168          2H6         A 168  32.106  21.891  -4.762
   97    H2     A 168           H2         A 168  31.319  26.416  -7.295
   98   1H5*    U 169          1H5*        U 169  35.525  20.414 -12.196
   99   2H5*    U 169          2H5*        U 169  35.004  20.282 -13.876
  100    H4*    U 169           H4*        U 169  35.151  17.808 -12.192
  101    H3*    U 169           H3*        U 169  37.520  19.370 -13.144
  102    H2*    U 169           H2*        U 169  38.625  17.375 -13.824
  103   2HO*    U 169          2HO*        U 169  36.548  15.646 -13.235
  104    H1*    U 169           H1*        U 169  36.466  16.423 -15.280
  105    H3     U 169           H3         U 169  39.187  17.862 -18.587
  106    H5     U 169           H5         U 169  37.712  21.410 -16.921
  107    H6     U 169           H6         U 169  36.659  20.041 -15.182
  108   1H5*    C 170          1H5*        C 170  37.315  21.479 -11.875
  109   2H5*    C 170          2H5*        C 170  38.987  21.799 -11.419
  110    H4*    C 170           H4*        C 170  37.855  23.679 -10.675
  111    H3*    C 170           H3*        C 170  38.268  21.759  -8.402
  112    H2*    C 170           H2*        C 170  37.259  23.304  -6.902
  113   2HO*    C 170          2HO*        C 170  36.744  25.137  -8.989
  114    H1*    C 170           H1*        C 170  35.044  23.745  -8.541
  115   1H4     C 170          1H4         C 170  33.426  19.041  -4.490
  116   2H4     C 170          2H4         C 170  33.846  17.896  -5.744
  117    H5     C 170           H5         C 170  34.865  18.499  -7.787
  118    H6     C 170           H6         C 170  35.741  20.368  -9.143
  119   1H5*    C 171          1H5*        C 171  42.499  21.778  -6.707
  120   2H5*    C 171          2H5*        C 171  41.346  21.007  -5.617
  121    H4*    C 171           H4*        C 171  42.029  23.831  -5.953
  122    H3*    C 171           H3*        C 171  40.886  22.104  -3.765
  123    H2*    C 171           H2*        C 171  40.232  24.070  -2.599
  124   2HO*    C 171          2HO*        C 171  42.051  25.306  -3.078
  125    H1*    C 171           H1*        C 171  39.111  25.238  -4.908
  126   1H4     C 171          1H4         C 171  34.257  22.575  -1.681
  127   2H4     C 171          2H4         C 171  34.490  21.121  -2.626
  128    H5     C 171           H5         C 171  36.284  20.802  -4.130
  129    H6     C 171           H6         C 171  38.314  21.809  -5.109
  130   1H5*    G 172          1H5*        G 172  44.928  23.094  -1.306
  131   2H5*    G 172          2H5*        G 172  45.178  21.421  -0.810
  132    H4*    G 172           H4*        G 172  44.904  22.884   1.114
  133    H3*    G 172           H3*        G 172  42.818  20.776   0.643
  134    H2*    G 172           H2*        G 172  41.750  21.371   2.688
  135   2HO*    G 172          2HO*        G 172  43.463  23.502   3.236
  136    H1*    G 172           H1*        G 172  41.711  24.093   2.074
  137    H8     G 172           H8         G 172  41.104  22.307  -1.100
  138    H1     G 172           H1         G 172  35.850  22.553   2.671
  139   1H2     G 172          1H2         G 172  36.384  23.202   4.554
  140   2H2     G 172          2H2         G 172  38.012  23.616   5.040
  141   1H5*    U 173          1H5*        U 173  44.098  20.421   4.620
  142   2H5*    U 173          2H5*        U 173  44.565  18.766   5.007
  143    H4*    U 173           H4*        U 173  43.066  19.523   6.695
  144    H3*    U 173           H3*        U 173  41.893  17.496   4.811
  145    H2*    U 173           H2*        U 173  39.902  17.444   6.111
  146   2HO*    U 173          2HO*        U 173  41.028  17.627   8.104
  147    H1*    U 173           H1*        U 173  39.671  20.230   6.190
  148    H3     U 173           H3         U 173  36.367  18.550   3.466
  149    H5     U 173           H5         U 173  39.710  19.060   0.996
  150    H6     U 173           H6         U 173  41.017  19.503   3.023
  151   1H5*    C 174          1H5*        C 174  41.156  15.504   8.737
  152   2H5*    C 174          2H5*        C 174  41.915  13.933   8.476
  153    H4*    C 174           H4*        C 174  39.699  13.567   9.271
  154    H3*    C 174           H3*        C 174  40.129  12.894   6.376
  155    H2*    C 174           H2*        C 174  37.898  12.087   6.218
  156   2HO*    C 174          2HO*        C 174  37.106  11.322   8.094
  157    H1*    C 174           H1*        C 174  36.845  14.372   7.511
  158   1H4     C 174          1H4         C 174  36.010  15.393   1.251
  159   2H4     C 174          2H4         C 174  37.624  16.066   1.176
  160    H5     C 174           H5         C 174  39.139  16.056   2.986
  161    H6     C 174           H6         C 174  39.483  15.391   5.340
  162   1H5*    U 175          1H5*        U 175  41.440  10.608   9.656
  163   2H5*    U 175          2H5*        U 175  42.779   9.508   9.326
  164    H4*    U 175           H4*        U 175  41.825   7.771  10.451
  165    H3*    U 175           H3*        U 175  39.125   8.876   9.663
  166    H2*    U 175           H2*        U 175  38.153   7.572  11.374
  167   2HO*    U 175          2HO*        U 175  40.255   6.255  12.384
  168    H1*    U 175           H1*        U 175  40.333   8.183  13.164
  169    H3     U 175           H3         U 175  36.735   9.671  15.485
  170    H5     U 175           H5         U 175  37.094  12.398  12.329
  171    H6     U 175           H6         U 175  38.835  10.943  11.399
  172   1H5*    C 176          1H5*        C 176  37.296   8.798   7.886
  173   2H5*    C 176          2H5*        C 176  36.672   9.174   9.492
  174    H4*    C 176           H4*        C 176  34.783   7.597   9.066
  175    H3*    C 176           H3*        C 176  36.172   7.233   6.446
  176    H2*    C 176           H2*        C 176  34.110   7.215   5.266
  177   2HO*    C 176          2HO*        C 176  32.273   6.779   6.447
  178    H1*    C 176           H1*        C 176  33.155   9.529   6.503
  179   1H4     C 176          1H4         C 176  35.913  11.658   1.154
  180   2H4     C 176          2H4         C 176  37.475  11.580   1.938
  181    H5     C 176           H5         C 176  37.819  10.701   4.102
  182    H6     C 176           H6         C 176  36.738   9.670   6.069
  183   1H5*    G 177          1H5*        G 177  32.812   4.542   6.485
  184   2H5*    G 177          2H5*        G 177  33.435   2.927   6.150
  185    H4*    G 177           H4*        G 177  31.577   3.288   4.719
  186    H3*    G 177           H3*        G 177  34.234   3.369   3.323
  187    H2*    G 177           H2*        G 177  33.131   3.613   1.225
  188   2HO*    G 177          2HO*        G 177  30.558   3.789   2.024
  189    H1*    G 177           H1*        G 177  31.519   5.706   2.121
  190    H8     G 177           H8         G 177  34.878   6.031   3.689
  191    H1     G 177           H1         G 177  34.647   8.328  -2.356
  192   1H2     G 177          1H2         G 177  32.868   7.771  -3.237
  193   2H2     G 177          2H2         G 177  31.624   6.822  -2.455
  194   1H5*    C 178          1H5*        C 178  31.775   0.728   1.287
  195   2H5*    C 178          2H5*        C 178  32.551  -0.777   0.795
  196    H4*    C 178           H4*        C 178  31.615   0.222  -1.146
  197    H3*    C 178           H3*        C 178  34.615   0.406  -1.012
  198    H2*    C 178           H2*        C 178  34.644   1.350  -3.191
  199   2HO*    C 178          2HO*        C 178  33.038   0.523  -4.391
  200    H1*    C 178           H1*        C 178  32.595   3.184  -2.605
  201   1H4     C 178          1H4         C 178  37.976   6.501  -1.716
  202   2H4     C 178          2H4         C 178  38.156   5.771  -0.137
  203    H5     C 178           H5         C 178  36.740   4.074   0.697
  204    H6     C 178           H6         C 178  34.783   2.648   0.218
  205   1H5*    U 179          1H5*        U 179  33.816  -1.877  -4.691
  206   2H5*    U 179          2H5*        U 179  35.081  -3.093  -4.867
  207    H4*    U 179           H4*        U 179  34.969  -1.604  -6.799
  208    H3*    U 179           H3*        U 179  37.478  -1.584  -5.141
  209    H2*    U 179           H2*        U 179  38.495  -0.124  -6.711
  210   2HO*    U 179          2HO*        U 179  36.196   0.007  -8.322
  211    H1*    U 179           H1*        U 179  36.275   1.593  -6.815
  212    H3     U 179           H3         U 179  39.730   3.787  -4.719
  213    H5     U 179           H5         U 179  37.785   1.621  -1.708
  214    H6     U 179           H6         U 179  36.503   0.506  -3.476
  215   1H5*    U 180          1H5*        U 180  38.534  -2.212  -8.885
  216   2H5*    U 180          2H5*        U 180  39.714  -3.464  -9.273
  217    H4*    U 180           H4*        U 180  40.559  -1.416 -10.114
  218    H3*    U 180           H3*        U 180  41.972  -2.421  -7.671
  219    H2*    U 180           H2*        U 180  43.471  -0.585  -7.729
  220   2HO*    U 180          2HO*        U 180  42.711   0.863  -9.787
  221    H1*    U 180           H1*        U 180  41.375   1.280  -8.161
  222    H3     U 180           H3         U 180  42.835   2.510  -4.065
  223    H5     U 180           H5         U 180  40.957  -1.169  -3.376
  224    H6     U 180           H6         U 180  40.702  -1.382  -5.806
  225   1H5*    A 181          1H5*        A 181  45.042  -4.377 -10.902
  226   2H5*    A 181          2H5*        A 181  45.706  -5.590  -9.807
  227    H4*    A 181           H4*        A 181  47.264  -3.731 -10.513
  228    H3*    A 181           H3*        A 181  46.795  -4.451  -7.629
  229    H2*    A 181           H2*        A 181  48.474  -2.900  -6.982
  230   2HO*    A 181          2HO*        A 181  49.978  -2.376  -8.515
  231    H1*    A 181           H1*        A 181  47.462  -0.850  -8.603
  232    H8     A 181           H8         A 181  44.726  -2.867  -7.016
  233   1H6     A 181          1H6         A 181  45.125   1.043  -2.167
  234   2H6     A 181          2H6         A 181  44.190  -0.263  -2.862
  235    H2     A 181           H2         A 181  48.509   1.890  -4.919
  236   1H5*    U 182          1H5*        U 182  48.501  -8.965  -7.723
  237   2H5*    U 182          2H5*        U 182  47.837  -8.065  -9.085
  238    H4*    U 182           H4*        U 182  45.629  -8.081  -7.695
  239    H3*    U 182           H3*        U 182  47.217 -10.236  -6.303
  240    H2*    U 182           H2*        U 182  45.221 -11.468  -6.020
  241   2HO*    U 182          2HO*        U 182  43.288 -10.024  -6.975
  242    H1*    U 182           H1*        U 182  44.350 -10.823  -8.684
  243    H3     U 182           H3         U 182  44.758 -15.419  -7.785
  244    H5     U 182           H5         U 182  48.281 -14.143  -9.657
  245    H6     U 182           H6         U 182  47.517 -11.840  -9.305
  246   1H5*    U 183          1H5*        U 183  44.208  -8.602  -1.613
  247   2H5*    U 183          2H5*        U 183  44.255  -9.736  -2.962
  248    H4*    U 183           H4*        U 183  44.052  -7.319  -4.254
  249    H3*    U 183           H3*        U 183  42.585  -7.079  -1.625
  250    H2*    U 183           H2*        U 183  40.898  -5.853  -2.729
  251   2HO*    U 183          2HO*        U 183  41.437  -4.887  -4.718
  252    H1*    U 183           H1*        U 183  41.020  -7.603  -5.018
  253    H3     U 183           H3         U 183  36.695  -8.126  -3.846
  254    H5     U 183           H5         U 183  38.782  -9.816  -0.632
  255    H6     U 183           H6         U 183  40.848  -9.012  -1.680
  256   1H5*    C 184          1H5*        C 184  43.645  -3.931   1.153
  257   2H5*    C 184          2H5*        C 184  44.826  -2.682   0.756
  258    H4*    C 184           H4*        C 184  45.319  -5.464   1.804
  259    H3*    C 184           H3*        C 184  45.796  -2.688   2.858
  260    H2*    C 184           H2*        C 184  47.756  -3.366   3.895
  261   2HO*    C 184          2HO*        C 184  46.838  -6.061   3.495
  262    H1*    C 184           H1*        C 184  48.123  -5.464   1.827
  263   1H4     C 184          1H4         C 184  53.575  -2.129   1.713
  264   2H4     C 184          2H4         C 184  52.743  -0.839   0.874
  265    H5     C 184           H5         C 184  50.416  -0.819   0.466
  266    H6     C 184           H6         C 184  48.295  -2.046   0.764
  267   1H5*    G 185          1H5*        G 185  45.052  -0.384   5.336
  268   2H5*    G 185          2H5*        G 185  44.136  -1.127   6.646
  269    H4*    G 185           H4*        G 185  43.152   0.555   4.361
  270    H3*    G 185           H3*        G 185  43.039   0.727   7.357
  271    H2*    G 185           H2*        G 185  40.993   1.941   7.215
  272   2HO*    G 185          2HO*        G 185  40.294   2.368   4.908
  273    H1*    G 185           H1*        G 185  39.817   0.093   5.487
  274    H8     G 185           H8         G 185  42.130  -0.857   8.397
  275    H1     G 185           H1         G 185  35.803  -1.675   9.479
  276   1H2     G 185          1H2         G 185  34.733  -1.015   7.844
  277   2H2     G 185          2H2         G 185  35.445  -0.340   6.396
  278   1H5*    G 186          1H5*        G 186  45.924   4.903   6.209
  279   2H5*    G 186          2H5*        G 186  47.390   4.031   6.652
  280    H4*    G 186           H4*        G 186  45.519   5.547   8.475
  281    H3*    G 186           H3*        G 186  48.312   6.027   7.485
  282    H2*    G 186           H2*        G 186  48.869   7.086   9.545
  283   2HO*    G 186          2HO*        G 186  46.644   6.773  10.984
  284    H1*    G 186           H1*        G 186  47.858   4.994  11.091
  285    H8     G 186           H8         G 186  49.329   3.130   8.375
  286    H1     G 186           H1         G 186  53.900   5.809  12.092
  287   1H2     G 186          1H2         G 186  53.047   7.233  13.315
  288   2H2     G 186          2H2         G 186  51.345   7.640  13.332
  289   1H5*    G 187          1H5*        G 187  47.429   9.763   4.429
  290   2H5*    G 187          2H5*        G 187  46.413   8.571   3.620
  291    H4*    G 187           H4*        G 187  49.315   9.116   3.338
  292    H3*    G 187           H3*        G 187  47.011   8.523   1.525
  293    H2*    G 187           H2*        G 187  48.473   7.594  -0.111
  294   2HO*    G 187          2HO*        G 187  50.833   7.690   1.184
  295    H1*    G 187           H1*        G 187  49.742   5.919   1.724
  296    H8     G 187           H8         G 187  46.217   5.967   2.763
  297    H1     G 187           H1         G 187  47.196   2.256  -2.446
  298   1H2     G 187          1H2         G 187  49.081   2.612  -3.202
  299   2H2     G 187          2H2         G 187  50.227   3.748  -2.524
  300   1H5*    G 188          1H5*        G 188  50.002   9.583  -1.148
  301   2H5*    G 188          2H5*        G 188  49.498  11.153  -1.771
  302    H4*    G 188           H4*        G 188  50.096   9.999  -3.683
  303    H3*    G 188           H3*        G 188  47.119   9.829  -3.304
  304    H2*    G 188           H2*        G 188  46.931   8.664  -5.374
  305   2HO*    G 188          2HO*        G 188  49.468   8.374  -6.130
  306    H1*    G 188           H1*        G 188  48.942   6.837  -4.715
  307    H8     G 188           H8         G 188  47.114   7.414  -1.581
  308    H1     G 188           H1         G 188  43.874   3.554  -5.640
  309   1H2     G 188          1H2         G 188  44.752   3.623  -7.505
  310   2H2     G 188          2H2         G 188  46.156   4.584  -7.909
  311   1H5*    A 189          1H5*        A 189  47.060  11.424  -7.701
  312   2H5*    A 189          2H5*        A 189  45.717  12.532  -7.420
  313    H4*    A 189           H4*        A 189  45.368  10.770  -9.192
  314    H3*    A 189           H3*        A 189  43.434  11.169  -6.917
  315    H2*    A 189           H2*        A 189  41.965   9.596  -7.922
  316   2HO*    A 189          2HO*        A 189  42.484   8.935 -10.106
  317    H1*    A 189           H1*        A 189  44.017   7.732  -8.394
  318    H8     A 189           H8         A 189  44.379   9.419  -5.067
  319   1H6     A 189          1H6         A 189  40.686   4.941  -2.773
  320   2H6     A 189          2H6         A 189  41.718   6.285  -2.342
  321    H2     A 189           H2         A 189  40.710   4.589  -7.202
  322   1H5*    G 190          1H5*        G 190  41.395  11.260 -10.555
  323   2H5*    G 190          2H5*        G 190  40.417  12.718 -10.733
  324    H4*    G 190           H4*        G 190  38.989  10.980 -11.342
  325    H3*    G 190           H3*        G 190  38.454  11.866  -8.520
  326    H2*    G 190           H2*        G 190  36.620  10.350  -8.395
  327   2HO*    G 190          2HO*        G 190  37.008   9.222 -10.900
  328    H1*    G 190           H1*        G 190  38.116   8.193  -9.343
  329    H8     G 190           H8         G 190  40.264  10.335  -7.172
  330    H1     G 190           H1         G 190  36.531   6.225  -3.847
  331   1H2     G 190          1H2         G 190  35.155   5.361  -5.118
  332   2H2     G 190          2H2         G 190  35.031   5.701  -6.829
  333   1H5*    C 191          1H5*        C 191  34.760  11.862 -10.603
  334   2H5*    C 191          2H5*        C 191  33.755  13.242 -10.162
  335    H4*    C 191           H4*        C 191  32.533  11.211  -9.779
  336    H3*    C 191           H3*        C 191  33.350  12.727  -7.318
  337    H2*    C 191           H2*        C 191  32.148  11.186  -5.964
  338   2HO*    C 191          2HO*        C 191  31.404   9.656  -8.223
  339    H1*    C 191           H1*        C 191  33.262   8.950  -7.275
  340   1H4     C 191          1H4         C 191  36.811   9.689  -2.016
  341   2H4     C 191          2H4         C 191  37.746  10.919  -2.836
  342    H5     C 191           H5         C 191  37.235  11.741  -4.991
  343    H6     C 191           H6         C 191  35.686  11.583  -6.908
  344   1H5*    G 192          1H5*        G 192  29.356  11.777  -7.117
  345   2H5*    G 192          2H5*        G 192  28.315  13.192  -6.956
  346    H4*    G 192           H4*        G 192  27.478  11.720  -5.373
  347    H3*    G 192           H3*        G 192  29.308  13.710  -4.065
  348    H2*    G 192           H2*        G 192  28.820  12.763  -1.933
  349   2HO*    G 192          2HO*        G 192  27.157  10.846  -3.240
  350    H1*    G 192           H1*        G 192  29.333  10.156  -2.782
  351    H8     G 192           H8         G 192  31.730  12.456  -4.462
  352    H1     G 192           H1         G 192  33.474  10.905   1.575
  353   1H2     G 192          1H2         G 192  31.913   9.940   2.516
  354   2H2     G 192          2H2         G 192  30.363   9.601   1.779
  355   1H5*    G 193          1H5*        G 193  25.849  13.530  -1.694
  356   2H5*    G 193          2H5*        G 193  25.270  15.156  -1.334
  357    H4*    G 193           H4*        G 193  25.496  14.007   0.728
  358    H3*    G 193           H3*        G 193  27.614  16.083   0.249
  359    H2*    G 193           H2*        G 193  28.492  15.690   2.430
  360   2HO*    G 193          2HO*        G 193  27.221  14.373   3.844
  361    H1*    G 193           H1*        G 193  28.590  12.926   2.083
  362    H8     G 193           H8         G 193  29.442  14.561  -1.149
  363    H1     G 193           H1         G 193  34.420  14.307   2.978
  364   1H2     G 193          1H2         G 193  33.744  13.722   4.837
  365   2H2     G 193          2H2         G 193  32.077  13.356   5.220
  366   1H5*    A 194          1H5*        A 194  26.102  16.544   3.953
  367   2H5*    A 194          2H5*        A 194  25.375  18.117   4.277
  368    H4*    A 194           H4*        A 194  26.705  17.732   6.139
  369    H3*    A 194           H3*        A 194  28.121  19.530   4.197
  370    H2*    A 194           H2*        A 194  29.960  19.727   5.691
  371   2HO*    A 194          2HO*        A 194  29.405  18.250   7.753
  372    H1*    A 194           H1*        A 194  30.177  16.985   6.115
  373    H8     A 194           H8         A 194  29.179  17.573   2.574
  374   1H6     A 194          1H6         A 194  35.245  18.287   1.293
  375   2H6     A 194          2H6         A 194  33.656  18.118   0.581
  376    H2     A 194           H2         A 194  34.763  18.153   5.708
  377   1H5*    C 195          1H5*        C 195  28.746  21.374   7.725
  378   2H5*    C 195          2H5*        C 195  27.965  22.956   7.758
  379    H4*    C 195           H4*        C 195  30.112  23.404   8.501
  380    H3*    C 195           H3*        C 195  29.919  24.021   5.563
  381    H2*    C 195           H2*        C 195  32.148  24.850   5.604
  382   2HO*    C 195          2HO*        C 195  32.994  25.402   7.597
  383    H1*    C 195           H1*        C 195  33.107  22.602   7.009
  384   1H4     C 195          1H4         C 195  34.383  21.442   0.849
  385   2H4     C 195          2H4         C 195  32.783  20.756   0.677
  386    H5     C 195           H5         C 195  31.144  20.795   2.376
  387    H6     C 195           H6         C 195  30.631  21.511   4.684
  388   1H5*    G 196          1H5*        G 196  31.523  27.756   7.058
  389   2H5*    G 196          2H5*        G 196  30.287  28.938   6.630
  390    H4*    G 196           H4*        G 196  32.284  29.862   5.853
  391    H3*    G 196           H3*        G 196  30.724  28.597   3.620
  392    H2*    G 196           H2*        G 196  32.356  29.338   2.051
  393   2HO*    G 196          2HO*        G 196  34.213  30.471   3.568
  394    H1*    G 196           H1*        G 196  34.493  28.326   3.535
  395    H8     G 196           H8         G 196  31.334  26.235   3.581
  396    H1     G 196           H1         G 196  35.445  24.795  -1.205
  397   1H2     G 196          1H2         G 196  36.973  26.181  -1.239
  398   2H2     G 196          2H2         G 196  37.118  27.530  -0.137
  399   1H5*    A 197          1H5*        A 197  28.767  33.538   4.003
  400   2H5*    A 197          2H5*        A 197  27.290  32.699   4.474
  401    H4*    A 197           H4*        A 197  26.517  34.072   2.810
  402    H3*    A 197           H3*        A 197  27.279  31.476   1.460
  403    H2*    A 197           H2*        A 197  26.472  32.331  -0.549
  404   2HO*    A 197          2HO*        A 197  24.476  32.985   0.211
  405    H1*    A 197           H1*        A 197  27.205  35.061   0.290
  406    H8     A 197           H8         A 197  28.478  31.790  -1.197
  407   1H6     A 197          1H6         A 197  31.781  35.379  -5.091
  408   2H6     A 197          2H6         A 197  31.340  33.729  -4.714
  409    H2     A 197           H2         A 197  29.771  38.018  -2.134
  410   1H5*    U 198          1H5*        U 198  22.816  30.801   5.072
  411   2H5*    U 198          2H5*        U 198  24.215  29.738   5.226
  412    H4*    U 198           H4*        U 198  22.526  28.379   3.477
  413    H3*    U 198           H3*        U 198  20.882  29.875   5.503
  414    H2*    U 198           H2*        U 198  19.588  27.982   5.913
  415   2HO*    U 198          2HO*        U 198  19.272  27.644   3.658
  416    H1*    U 198           H1*        U 198  21.909  26.246   5.393
  417    H3     U 198           H3         U 198  21.887  24.441   9.480
  418    H5     U 198           H5         U 198  20.079  28.161  10.141
  419    H6     U 198           H6         U 198  20.472  28.662   7.773
  420   1H5*    G 199          1H5*        G 199  19.715  32.575   0.298
  421   2H5*    G 199          2H5*        G 199  19.476  33.240   1.913
  422    H4*    G 199           H4*        G 199  17.411  33.474   0.832
  423    H3*    G 199           H3*        G 199  17.416  31.143   2.728
  424    H2*    G 199           H2*        G 199  15.104  30.782   2.282
  425   2HO*    G 199          2HO*        G 199  14.156  32.697   1.898
  426    H1*    G 199           H1*        G 199  15.450  30.857  -0.487
  427    H8     G 199           H8         G 199  18.434  29.143   0.805
  428    H1     G 199           H1         G 199  13.210  25.322   0.794
  429   1H2     G 199          1H2         G 199  11.525  26.461   0.461
  430   2H2     G 199          2H2         G 199  11.526  28.194   0.221
  431   1H5*    A 200          1H5*        A 200  16.223  34.261   6.678
  432   2H5*    A 200          2H5*        A 200  17.905  33.931   7.091
  433    H4*    A 200           H4*        A 200  16.088  33.117   8.696
  434    H3*    A 200           H3*        A 200  18.360  31.403   7.712
  435    H2*    A 200           H2*        A 200  17.659  29.670   9.177
  436   2HO*    A 200          2HO*        A 200  15.457  31.088  10.155
  437    H1*    A 200           H1*        A 200  14.964  29.880   8.420
  438    H8     A 200           H8         A 200  17.272  30.299   5.497
  439   1H6     A 200          1H6         A 200  17.081  24.091   4.887
  440   2H6     A 200          2H6         A 200  17.622  25.574   4.132
  441    H2     A 200           H2         A 200  15.076  25.175   8.701
  442   1H5*    C 201          1H5*        C 201  20.272  31.323  12.267
  443   2H5*    C 201          2H5*        C 201  20.447  29.586  12.016
  444    H4*    C 201           H4*        C 201  17.983  31.224  12.398
  445    H3*    C 201           H3*        C 201  19.087  28.662  13.515
  446    H2*    C 201           H2*        C 201  16.919  27.879  13.955
  447   2HO*    C 201          2HO*        C 201  15.753  29.539  14.731
  448    H1*    C 201           H1*        C 201  15.947  29.078  11.480
  449   1H4     C 201          1H4         C 201  15.347  22.794  10.538
  450   2H4     C 201          2H4         C 201  17.083  22.660  10.364
  451    H5     C 201           H5         C 201  18.581  24.455  10.695
  452    H6     C 201           H6         C 201  18.785  26.845  11.282
  453   1H5*    C 202          1H5*        C 202  16.969  30.454  17.200
  454   2H5*    C 202          2H5*        C 202  17.779  29.663  18.551
  455    H4*    C 202           H4*        C 202  15.327  29.183  18.320
  456    H3*    C 202           H3*        C 202  17.339  26.932  18.380
  457    H2*    C 202           H2*        C 202  15.541  25.401  18.527
  458   2HO*    C 202          2HO*        C 202  13.783  27.661  18.651
  459    H1*    C 202           H1*        C 202  14.030  26.824  16.558
  460   1H4     C 202          1H4         C 202  16.356  21.608  13.655
  461   2H4     C 202          2H4         C 202  17.787  22.529  13.245
  462    H5     C 202           H5         C 202  18.213  24.716  14.027
  463    H6     C 202           H6         C 202  17.362  26.578  15.409
  464   1H5*    C 203          1H5*        C 203  15.110  26.528  22.451
  465   2H5*    C 203          2H5*        C 203  16.210  25.542  23.416
  466    H4*    C 203           H4*        C 203  13.909  24.585  22.974
  467    H3*    C 203           H3*        C 203  16.442  23.059  22.409
  468    H2*    C 203           H2*        C 203  15.145  21.141  21.880
  469   2HO*    C 203          2HO*        C 203  12.749  21.463  22.258
  470    H1*    C 203           H1*        C 203  13.377  22.579  20.238
  471   1H4     C 203          1H4         C 203  17.761  20.040  16.320
  472   2H4     C 203          2H4         C 203  18.712  21.498  16.506
  473    H5     C 203           H5         C 203  18.172  23.238  18.009
  474    H6     C 203           H6         C 203  16.572  24.015  19.722
  475   1H5*    U 204          1H5*        U 204  13.961  20.928  24.721
  476   2H5*    U 204          2H5*        U 204  14.584  20.146  26.173
  477    H4*    U 204           H4*        U 204  13.413  18.503  24.926
  478    H3*    U 204           H3*        U 204  16.401  18.201  24.832
  479    H2*    U 204           H2*        U 204  16.159  16.180  23.595
  480   2HO*    U 204          2HO*        U 204  13.637  15.816  23.198
  481    H1*    U 204           H1*        U 204  14.407  17.310  21.743
  482    H3     U 204           H3         U 204  18.500  16.633  19.742
  483    H5     U 204           H5         U 204  18.698  20.442  21.470
  484    H6     U 204           H6         U 204  16.575  19.937  22.589
  485   1H5*    A 205          1H5*        A 205  15.565  15.164  28.370
  486   2H5*    A 205          2H5*        A 205  17.185  15.003  29.047
  487    H4*    A 205           H4*        A 205  16.296  13.078  27.634
  488    H3*    A 205           H3*        A 205  19.001  14.336  27.224
  489    H2*    A 205           H2*        A 205  19.502  12.679  25.599
  490   2HO*    A 205          2HO*        A 205  18.170  10.829  25.546
  491    H1*    A 205           H1*        A 205  17.045  12.978  24.277
  492    H8     A 205           H8         A 205  18.133  16.363  25.245
  493   1H6     A 205          1H6         A 205  21.782  16.402  20.182
  494   2H6     A 205          2H6         A 205  21.121  17.396  21.461
  495    H2     A 205           H2         A 205  20.277  12.264  20.779
  496   1H5*    G 206          1H5*        G 206  21.456  12.272  25.741
  497   2H5*    G 206          2H5*        G 206  22.382  11.637  27.101
  498    H4*    G 206           H4*        G 206  22.611  14.399  25.887
  499    H3*    G 206           H3*        G 206  24.219  11.907  25.586
  500    H2*    G 206           H2*        G 206  26.271  13.117  25.649
  501   2HO*    G 206          2HO*        G 206  25.609  15.602  26.112
  502    H1*    G 206           H1*        G 206  25.601  14.473  27.992
  503    H8     G 206           H8         G 206  24.641  10.814  27.377
  504    H1     G 206           H1         G 206  29.855  11.736  31.099
  505   1H2     G 206          1H2         G 206  30.280  13.751  31.203
  506   2H2     G 206          2H2         G 206  29.359  15.004  30.401
  507   1H5*    U 207          1H5*        U 207  23.936  13.962  20.747
  508   2H5*    U 207          2H5*        U 207  25.556  13.573  20.167
  509    H4*    U 207           H4*        U 207  24.682  15.928  19.743
  510    H3*    U 207           H3*        U 207  27.379  15.333  20.936
  511    H2*    U 207           H2*        U 207  27.900  17.650  20.888
  512   2HO*    U 207          2HO*        U 207  26.939  18.668  19.231
  513    H1*    U 207           H1*        U 207  25.468  18.415  22.040
  514    H3     U 207           H3         U 207  28.130  19.162  25.581
  515    H5     U 207           H5         U 207  28.319  15.003  25.130
  516    H6     U 207           H6         U 207  26.978  15.262  23.094
  517   1H5*    A 208          1H5*        A 208  30.284  16.576  16.598
  518   2H5*    A 208          2H5*        A 208  29.181  16.936  15.271
  519    H4*    A 208           H4*        A 208  30.670  15.207  14.570
  520    H3*    A 208           H3*        A 208  27.821  14.413  14.981
  521    H2*    A 208           H2*        A 208  28.281  12.154  14.402
  522   2HO*    A 208          2HO*        A 208  29.786  12.516  12.788
  523    H1*    A 208           H1*        A 208  30.474  11.967  16.130
  524    H8     A 208           H8         A 208  27.257  13.857  17.009
  525   1H6     A 208          1H6         A 208  25.814   8.821  20.402
  526   2H6     A 208          2H6         A 208  25.289  10.430  19.960
  527    H2     A 208           H2         A 208  29.647   8.029  18.298
  528   1H5*    G 209          1H5*        G 209  27.743  13.619  11.339
  529   2H5*    G 209          2H5*        G 209  26.234  13.908  10.474
  530    H4*    G 209           H4*        G 209  26.317  11.736  11.666
  531    H3*    G 209           H3*        G 209  24.167  13.739  12.287
  532    H2*    G 209           H2*        G 209  23.131  12.175  13.754
  533   2HO*    G 209          2HO*        G 209  24.041  10.004  13.754
  534    H1*    G 209           H1*        G 209  25.513  11.616  15.105
  535    H8     G 209           H8         G 209  25.437  15.237  14.252
  536    H1     G 209           H1         G 209  21.997  13.788  19.539
  537   1H2     G 209          1H2         G 209  21.812  11.741  19.699
  538   2H2     G 209          2H2         G 209  22.487  10.588  18.570
  539   1H5*    A 210          1H5*        A 210  22.089   9.772  12.146
  540   2H5*    A 210          2H5*        A 210  20.728  10.168  11.096
  541    H4*    A 210           H4*        A 210  19.978   9.192  13.196
  542    H3*    A 210           H3*        A 210  19.221  12.057  12.659
  543    H2*    A 210           H2*        A 210  17.856  12.035  14.603
  544   2HO*    A 210          2HO*        A 210  17.043  10.075  15.085
  545    H1*    A 210           H1*        A 210  19.849  10.838  16.189
  546    H8     A 210           H8         A 210  21.294  13.397  13.875
  547   1H6     A 210          1H6         A 210  20.042  17.626  18.290
  548   2H6     A 210          2H6         A 210  20.856  17.370  16.763
  549    H2     A 210           H2         A 210  18.138  13.787  19.463
  550   1H5*    G 211          1H5*        G 211  15.183   9.800  13.160
  551   2H5*    G 211          2H5*        G 211  14.165  10.707  12.041
  552    H4*    G 211           H4*        G 211  13.311  10.564  14.389
  553    H3*    G 211           H3*        G 211  13.724  13.204  13.015
  554    H2*    G 211           H2*        G 211  12.766  14.324  14.887
  555   2HO*    G 211          2HO*        G 211  12.455  12.026  16.427
  556    H1*    G 211           H1*        G 211  14.384  12.989  16.729
  557    H8     G 211           H8         G 211  16.545  13.568  13.812
  558    H1     G 211           H1         G 211  15.663  18.932  17.325
  559   1H2     G 211          1H2         G 211  14.131  18.630  18.672
  560   2H2     G 211          2H2         G 211  13.222  17.143  18.827
  561   1H5*    G 212          1H5*        G 212   9.126  13.266  14.186
  562   2H5*    G 212          2H5*        G 212   8.544  14.109  12.751
  563    H4*    G 212           H4*        G 212   7.911  15.152  14.936
  564    H3*    G 212           H3*        G 212   9.362  16.698  12.805
  565    H2*    G 212           H2*        G 212   9.175  18.677  14.119
  566   2HO*    G 212          2HO*        G 212   7.648  18.677  15.743
  567    H1*    G 212           H1*        G 212  10.159  17.448  16.422
  568    H8     G 212           H8         G 212  12.073  15.991  13.634
  569    H1     G 212           H1         G 212  14.077  21.950  15.167
  570   1H2     G 212          1H2         G 212  12.709  22.833  16.433
  571   2H2     G 212          2H2         G 212  11.238  22.071  16.994
  572   1H5*    G 213          1H5*        G 213   5.959  18.991  13.848
  573   2H5*    G 213          2H5*        G 213   4.973  19.260  12.410
  574    H4*    G 213           H4*        G 213   5.182  21.348  13.493
  575    H3*    G 213           H3*        G 213   6.807  21.094  10.996
  576    H2*    G 213           H2*        G 213   7.625  23.319  11.234
  577   2HO*    G 213          2HO*        G 213   5.648  24.125  12.070
  578    H1*    G 213           H1*        G 213   8.369  22.920  13.909
  579    H8     G 213           H8         G 213   9.123  19.840  11.968
  580    H1     G 213           H1         G 213  13.628  24.438  11.302
  581   1H2     G 213          1H2         G 213  12.934  26.205  12.106
  582   2H2     G 213          2H2         G 213  11.364  26.410  12.850
  583   1H5*    G 214          1H5*        G 214   6.813  24.974  10.086
  584   2H5*    G 214          2H5*        G 214   5.639  24.958   8.770
  585    H4*    G 214           H4*        G 214   7.705  25.845   7.952
  586    H3*    G 214           H3*        G 214   6.980  23.120   6.918
  587    H2*    G 214           H2*        G 214   8.873  23.165   5.473
  588   2HO*    G 214          2HO*        G 214  10.126  25.382   5.953
  589    H1*    G 214           H1*        G 214  10.631  23.898   7.511
  590    H8     G 214           H8         G 214   7.887  21.520   8.569
  591    H1     G 214           H1         G 214  13.232  18.626   6.347
  592   1H2     G 214          1H2         G 214  14.510  20.044   5.568
  593   2H2     G 214          2H2         G 214  14.184  21.762   5.525
  594   1H5*    G 215          1H5*        G 215   8.265  24.770   3.583
  595   2H5*    G 215          2H5*        G 215   6.934  24.901   2.433
  596    H4*    G 215           H4*        G 215   8.557  23.837   1.191
  597    H3*    G 215           H3*        G 215   6.738  21.745   2.364
  598    H2*    G 215           H2*        G 215   7.923  20.073   1.151
  599   2HO*    G 215          2HO*        G 215   8.163  21.592  -0.643
  600    H1*    G 215           H1*        G 215  10.427  21.036   1.987
  601    H8     G 215           H8         G 215   7.674  21.075   4.585
  602    H1     G 215           H1         G 215  11.119  15.600   4.400
  603   1H2     G 215          1H2         G 215  12.389  15.639   2.777
  604   2H2     G 215          2H2         G 215  12.503  16.959   1.634
  605   1H5*    C 216          1H5*        C 216   4.961  21.993  -1.849
  606   2H5*    C 216          2H5*        C 216   3.412  21.159  -1.739
  607    H4*    C 216           H4*        C 216   5.418  19.853  -2.632
  608    H3*    C 216           H3*        C 216   3.623  18.797  -0.441
  609    H2*    C 216           H2*        C 216   4.727  16.719  -0.623
  610   2HO*    C 216          2HO*        C 216   6.335  17.581  -2.768
  611    H1*    C 216           H1*        C 216   7.286  17.996  -0.931
  612   1H4     C 216          1H4         C 216   7.215  15.505   4.966
  613   2H4     C 216          2H4         C 216   6.455  16.973   5.536
  614    H5     C 216           H5         C 216   5.724  18.712   4.115
  615    H6     C 216           H6         C 216   5.539  19.476   1.774
  616   1H5*    U 217          1H5*        U 217   1.726  15.531  -3.504
  617   2H5*    U 217          2H5*        U 217   0.784  14.924  -2.144
  618    H4*    U 217           H4*        U 217   2.934  13.673  -3.245
  619    H3*    U 217           H3*        U 217   1.659  13.441  -0.532
  620    H2*    U 217           H2*        U 217   3.300  11.833   0.093
  621   2HO*    U 217          2HO*        U 217   4.510  10.892  -1.562
  622    H1*    U 217           H1*        U 217   5.437  13.401  -0.731
  623    H3     U 217           H3         U 217   5.370  13.509   3.846
  624    H5     U 217           H5         U 217   2.693  16.499   2.646
  625    H6     U 217           H6         U 217   2.924  15.648   0.357
  626   1H5*    G 218          1H5*        G 218  -1.584   9.523  -1.224
  627   2H5*    G 218          2H5*        G 218   0.026  10.033  -0.719
  628    H4*    G 218           H4*        G 218  -0.710   7.714  -2.147
  629    H3*    G 218           H3*        G 218   1.915   8.897  -1.253
  630    H2*    G 218           H2*        G 218   3.052   7.170  -2.409
  631   2HO*    G 218          2HO*        G 218   1.851   5.325  -2.978
  632    H1*    G 218           H1*        G 218   1.339   7.432  -4.683
  633    H8     G 218           H8         G 218   2.413  10.801  -3.725
  634    H1     G 218           H1         G 218   7.063   7.559  -6.847
  635   1H2     G 218          1H2         G 218   6.552   5.565  -6.965
  636   2H2     G 218          2H2         G 218   5.082   4.874  -6.316
  637   1H5*    C 219          1H5*        C 219   3.168   5.030   2.411
  638   2H5*    C 219          2H5*        C 219   1.711   4.825   3.382
  639    H4*    C 219           H4*        C 219   3.726   6.605   3.883
  640    H3*    C 219           H3*        C 219   1.087   6.096   4.975
  641    H2*    C 219           H2*        C 219   0.366   8.260   4.562
  642   2HO*    C 219          2HO*        C 219   1.587   9.546   6.377
  643    H1*    C 219           H1*        C 219   3.277   9.190   4.579
  644   1H4     C 219          1H4         C 219   0.113  14.295   2.273
  645   2H4     C 219          2H4         C 219   0.224  13.542   0.698
  646    H5     C 219           H5         C 219   1.027  11.351   0.340
  647    H6     C 219           H6         C 219   1.932   9.321   1.416
  648   1H5*    G 220          1H5*        G 220   5.859   5.285   6.802
  649   2H5*    G 220          2H5*        G 220   5.050   6.261   5.576
  650    H4*    G 220           H4*        G 220   6.412   3.602   5.083
  651    H3*    G 220           H3*        G 220   7.389   6.428   4.770
  652    H2*    G 220           H2*        G 220   8.470   5.883   2.781
  653   2HO*    G 220          2HO*        G 220   9.569   4.056   3.226
  654    H1*    G 220           H1*        G 220   6.389   3.862   2.208
  655    H8     G 220           H8         G 220   6.228   4.402  -0.240
  656    H1     G 220           H1         G 220   5.952  10.777   0.842
  657   1H2     G 220          1H2         G 220   6.173  11.142   2.860
  658   2H2     G 220          2H2         G 220   6.399   9.907   4.077
  659   1H5*    G 221          1H5*        G 221  10.649   4.920   4.916
  660   2H5*    G 221          2H5*        G 221  12.047   5.676   5.680
  661    H4*    G 221           H4*        G 221  11.686   6.081   3.188
  662    H3*    G 221           H3*        G 221  12.223   8.276   5.178
  663    H2*    G 221           H2*        G 221  12.352   9.834   3.389
  664   2HO*    G 221          2HO*        G 221  12.496   8.969   1.256
  665    H1*    G 221           H1*        G 221   9.992   8.897   2.187
  666    H8     G 221           H8         G 221  10.154   9.169   5.981
  667    H1     G 221           H1         G 221   7.681  14.340   2.975
  668   1H2     G 221          1H2         G 221   7.865  14.104   0.935
  669   2H2     G 221          2H2         G 221   8.584  12.712   0.155
  670   1H5*    C 222          1H5*        C 222  16.227   7.851   3.385
  671   2H5*    C 222          2H5*        C 222  17.453   8.479   4.487
  672    H4*    C 222           H4*        C 222  16.752  10.040   2.659
  673    H3*    C 222           H3*        C 222  16.495  10.889   5.549
  674    H2*    C 222           H2*        C 222  15.978  13.057   4.809
  675   2HO*    C 222          2HO*        C 222  16.407  12.500   2.100
  676    H1*    C 222           H1*        C 222  14.464  12.000   2.566
  677   1H4     C 222          1H4         C 222  10.148  14.725   6.418
  678   2H4     C 222          2H4         C 222  10.171  13.290   7.418
  679    H5     C 222           H5         C 222  11.658  11.484   7.093
  680    H6     C 222           H6         C 222  13.506  10.602   5.713
  681   1H5*    U 223          1H5*        U 223  20.171  13.342   4.434
  682   2H5*    U 223          2H5*        U 223  20.586  14.161   5.939
  683    H4*    U 223           H4*        U 223  19.288  15.379   3.982
  684    H3*    U 223           H3*        U 223  18.872  15.750   6.953
  685    H2*    U 223           H2*        U 223  17.377  17.504   6.468
  686   2HO*    U 223          2HO*        U 223  18.341  18.622   4.857
  687    H1*    U 223           H1*        U 223  16.216  16.104   4.262
  688    H3     U 223           H3         U 223  12.928  16.920   7.377
  689    H5     U 223           H5         U 223  14.843  13.420   8.647
  690    H6     U 223           H6         U 223  16.545  13.847   6.934
  691   1H5*    U 224          1H5*        U 224  20.769  15.906   1.855
  692   2H5*    U 224          2H5*        U 224  20.674  17.628   1.482
  693    H4*    U 224           H4*        U 224  18.922  15.584   0.680
  694    H3*    U 224           H3*        U 224  18.839  18.597   0.431
  695    H2*    U 224           H2*        U 224  16.760  18.377  -0.668
  696   2HO*    U 224          2HO*        U 224  16.177  16.138  -1.302
  697    H1*    U 224           H1*        U 224  15.892  16.338   1.152
  698    H3     U 224           H3         U 224  12.859  19.713   1.615
  699    H5     U 224           H5         U 224  16.232  21.029   3.720
  700    H6     U 224           H6         U 224  17.435  19.100   2.802
  701   1H5*    A 225          1H5*        A 225  19.954  17.906  -4.114
  702   2H5*    A 225          2H5*        A 225  19.786  19.578  -4.647
  703    H4*    A 225           H4*        A 225  17.852  17.763  -4.918
  704    H3*    A 225           H3*        A 225  17.576  20.729  -4.417
  705    H2*    A 225           H2*        A 225  15.233  20.493  -4.665
  706   2HO*    A 225          2HO*        A 225  14.471  18.512  -5.602
  707    H1*    A 225           H1*        A 225  15.158  18.141  -3.080
  708    H8     A 225           H8         A 225  17.333  20.767  -1.567
  709   1H6     A 225          1H6         A 225  12.190  23.039   1.139
  710   2H6     A 225          2H6         A 225  13.934  23.152   1.093
  711    H2     A 225           H2         A 225  10.962  19.942  -1.801
  712   1H5*    G 226          1H5*        G 226  15.660  19.639  -8.268
  713   2H5*    G 226          2H5*        G 226  15.247  21.066  -9.218
  714    H4*    G 226           H4*        G 226  13.311  19.680  -8.393
  715    H3*    G 226           H3*        G 226  13.510  22.639  -7.890
  716    H2*    G 226           H2*        G 226  11.333  22.608  -6.923
  717   2HO*    G 226          2HO*        G 226  10.143  21.100  -7.937
  718    H1*    G 226           H1*        G 226  11.925  20.440  -5.257
  719    H8     G 226           H8         G 226  14.972  22.518  -5.384
  720    H1     G 226           H1         G 226  10.446  24.973  -1.464
  721   1H2     G 226          1H2         G 226   8.662  23.982  -1.766
  722   2H2     G 226          2H2         G 226   8.428  22.679  -2.911
  723   1H5*    G 227          1H5*        G 227  12.944  24.589  -8.059
  724   2H5*    G 227          2H5*        G 227  12.532  25.927  -9.131
  725    H4*    G 227           H4*        G 227  14.786  26.162  -8.247
  726    H3*    G 227           H3*        G 227  14.462  25.769 -11.204
  727    H2*    G 227           H2*        G 227  16.811  26.034 -11.511
  728   2HO*    G 227          2HO*        G 227  17.702  27.309  -9.999
  729    H1*    G 227           H1*        G 227  17.450  24.178  -9.525
  730    H8     G 227           H8         G 227  14.457  22.836 -11.195
  731    H1     G 227           H1         G 227  19.836  21.967 -14.688
  732   1H2     G 227          1H2         G 227  21.366  23.096 -13.889
  733   2H2     G 227          2H2         G 227  21.214  24.124 -12.482
  734   1H5*    A 228          1H5*        A 228  16.677  29.531 -10.675
  735   2H5*    A 228          2H5*        A 228  16.155  30.688 -11.899
  736    H4*    A 228           H4*        A 228  18.549  30.364 -12.007
  737    H3*    A 228           H3*        A 228  16.941  29.384 -14.350
  738    H2*    A 228           H2*        A 228  18.955  28.847 -15.501
  739   2HO*    A 228          2HO*        A 228  20.772  29.902 -14.837
  740    H1*    A 228           H1*        A 228  20.028  27.451 -13.335
  741    H8     A 228           H8         A 228  16.364  26.817 -13.462
  742   1H6     A 228          1H6         A 228  17.578  22.293 -17.585
  743   2H6     A 228          2H6         A 228  16.333  22.997 -16.579
  744    H2     A 228           H2         A 228  21.304  24.631 -16.949
  745   1H5*    G 229          1H5*        G 229  20.197  32.246 -16.221
  746   2H5*    G 229          2H5*        G 229  19.108  33.110 -17.305
  747    H4*    G 229           H4*        G 229  21.085  32.246 -18.465
  748    H3*    G 229           H3*        G 229  18.370  31.253 -19.275
  749    H2*    G 229           H2*        G 229  19.348  29.998 -21.048
  750   2HO*    G 229          2HO*        G 229  21.947  30.788 -20.247
  751    H1*    G 229           H1*        G 229  21.257  28.818 -19.388
  752    H8     G 229           H8         G 229  18.202  29.045 -17.348
  753    H1     G 229           H1         G 229  17.946  24.218 -21.652
  754   1H2     G 229          1H2         G 229  19.487  24.421 -23.006
  755   2H2     G 229          2H2         G 229  20.672  25.706 -22.980
  756   1H5*    G 230          1H5*        G 230  20.435  32.691 -22.930
  757   2H5*    G 230          2H5*        G 230  19.231  33.579 -23.863
  758    H4*    G 230           H4*        G 230  20.319  31.891 -25.227
  759    H3*    G 230           H3*        G 230  17.388  31.550 -24.669
  760    H2*    G 230           H2*        G 230  17.329  29.656 -26.113
  761   2HO*    G 230          2HO*        G 230  19.921  29.411 -26.783
  762    H1*    G 230           H1*        G 230  19.531  28.446 -24.902
  763    H8     G 230           H8         G 230  17.675  30.065 -22.164
  764    H1     G 230           H1         G 230  14.887  24.566 -24.131
  765   1H2     G 230          1H2         G 230  15.742  23.957 -25.906
  766   2H2     G 230          2H2         G 230  17.024  24.808 -26.737
  767   1H5*    G 231          1H5*        G 231  17.797  31.344 -29.032
  768   2H5*    G 231          2H5*        G 231  16.618  32.484 -29.678
  769    H4*    G 231           H4*        G 231  16.326  30.417 -30.814
  770    H3*    G 231           H3*        G 231  14.150  31.084 -28.858
  771    H2*    G 231           H2*        G 231  12.953  29.125 -29.498
  772   2HO*    G 231          2HO*        G 231  13.959  27.886 -31.297
  773    H1*    G 231           H1*        G 231  15.167  27.458 -29.188
  774    H8     G 231           H8         G 231  15.323  30.037 -26.526
  775    H1     G 231           H1         G 231  11.185  25.247 -25.173
  776   1H2     G 231          1H2         G 231  10.895  24.092 -26.856
  777   2H2     G 231          2H2         G 231  11.660  24.378 -28.404
  778   1H5*    C 232          1H5*        C 232  12.392  30.149 -32.421
  779   2H5*    C 232          2H5*        C 232  11.121  31.234 -32.981
  780    H4*    C 232           H4*        C 232  10.186  29.069 -32.938
  781    H3*    C 232           H3*        C 232   9.259  30.798 -30.663
  782    H2*    C 232           H2*        C 232   7.801  29.072 -29.930
  783   2HO*    C 232          2HO*        C 232   7.275  27.480 -31.409
  784    H1*    C 232           H1*        C 232   9.816  27.097 -30.152
  785   1H4     C 232          1H4         C 232   9.698  28.628 -23.951
  786   2H4     C 232          2H4         C 232  10.699  30.022 -24.291
  787    H5     C 232           H5         C 232  11.320  30.695 -26.468
  788    H6     C 232           H6         C 232  11.133  30.191 -28.878
  789   1H5*    A 233          1H5*        A 233   5.949  29.131 -32.584
  790   2H5*    A 233          2H5*        A 233   4.749  30.329 -33.066
  791    H4*    A 233           H4*        A 233   3.518  28.674 -31.980
  792    H3*    A 233           H3*        A 233   4.015  31.012 -30.160
  793    H2*    A 233           H2*        A 233   2.701  29.982 -28.467
  794   2HO*    A 233          2HO*        A 233   1.458  28.131 -29.091
  795    H1*    A 233           H1*        A 233   4.008  27.526 -28.682
  796    H8     A 233           H8         A 233   6.416  30.351 -29.162
  797   1H6     A 233          1H6         A 233   7.083  30.405 -22.957
  798   2H6     A 233          2H6         A 233   7.711  31.052 -24.456
  799    H2     A 233           H2         A 233   3.723  27.681 -23.970
  800   1H5*    G 234          1H5*        G 234  -0.270  30.352 -30.013
  801   2H5*    G 234          2H5*        G 234  -1.020  31.880 -30.474
  802    H4*    G 234           H4*        G 234  -2.125  31.241 -28.520
  803    H3*    G 234           H3*        G 234  -0.050  33.339 -27.961
  804    H2*    G 234           H2*        G 234  -0.731  33.404 -25.678
  805   2HO*    G 234          2HO*        G 234  -2.585  31.358 -25.848
  806    H1*    G 234           H1*        G 234  -0.600  30.632 -25.381
  807    H8     G 234           H8         G 234   2.139  31.855 -27.622
  808    H1     G 234           H1         G 234   3.532  32.321 -21.319
  809   1H2     G 234          1H2         G 234   1.837  31.936 -20.209
  810   2H2     G 234          2H2         G 234   0.272  31.545 -20.885
  811   1H    GLY  15          1H        GLY  15   2.305  -1.757   0.000
  812   1HA   GLY  15          1HA       GLY  15   4.516  -2.525  -1.780
  813   2HA   GLY  15          2HA       GLY  15   3.107  -1.730  -2.465
  814    H    ARG  16           H        ARG  16   6.161  -1.237  -1.310
  815    HA   ARG  16           HA       ARG  16   5.657   1.435  -0.256
  816   1HB   ARG  16          2HB       ARG  16   8.230  -0.125  -0.561
  817   2HB   ARG  16          3HB       ARG  16   8.094   1.458   0.191
  818   1HG   ARG  16          2HG       ARG  16   7.113   0.635   2.078
  819   2HG   ARG  16          3HG       ARG  16   6.392  -0.738   1.236
  820   1HD   ARG  16          2HD       ARG  16   9.359  -0.484   1.630
  821   2HD   ARG  16          3HD       ARG  16   8.315  -1.218   2.847
  822    HE   ARG  16           HE       ARG  16   7.870  -2.384   0.301
  823   1HH1  ARG  16          2HH1      ARG  16  10.128  -2.327   2.950
  824   2HH1  ARG  16          1HH1      ARG  16  10.720  -3.928   2.651
  825   1HH2  ARG  16          2HH2      ARG  16   8.640  -4.493  -0.103
  826   2HH2  ARG  16          1HH2      ARG  16   9.873  -5.158   0.914
  827    H    ALA  17           H        ALA  17   7.676  -0.041  -2.800
  828    HA   ALA  17           HA       ALA  17   8.383   0.733  -4.820
  829   1HB   ALA  17          1HB       ALA  17   6.573   1.347  -5.945
  830   2HB   ALA  17          2HB       ALA  17   5.767   1.846  -4.459
  831   3HB   ALA  17          3HB       ALA  17   6.790   2.986  -5.333
  832    H    ARG  18           H        ARG  18   9.117   2.051  -2.118
  833    HA   ARG  18           HA       ARG  18   9.717   4.724  -2.399
  834   1HB   ARG  18          2HB       ARG  18  10.096   3.099  -0.405
  835   2HB   ARG  18          3HB       ARG  18  11.682   2.848  -1.122
  836   1HG   ARG  18          2HG       ARG  18  10.643   5.587  -0.471
  837   2HG   ARG  18          3HG       ARG  18  11.497   4.591   0.711
  838   1HD   ARG  18          2HD       ARG  18  13.060   4.487  -1.598
  839   2HD   ARG  18          3HD       ARG  18  12.543   6.169  -1.468
  840    HE   ARG  18           HE       ARG  18  13.888   6.404   0.369
  841   1HH1  ARG  18          2HH1      ARG  18  13.456   3.016  -0.305
  842   2HH1  ARG  18          1HH1      ARG  18  14.632   2.502   0.859
  843   1HH2  ARG  18          2HH2      ARG  18  15.439   5.739   1.904
  844   2HH2  ARG  18          1HH2      ARG  18  15.758   4.051   2.115
  845    H    GLY  19           H        GLY  19  11.097   5.895  -3.586
  846   1HA   GLY  19          1HA       GLY  19  13.267   6.226  -4.580
  847   2HA   GLY  19          2HA       GLY  19  13.323   4.503  -4.922
  848    H    LEU  20           H        LEU  20  10.516   4.518  -5.880
  849    HA   LEU  20           HA       LEU  20  11.107   5.424  -8.588
  850   1HB   LEU  20          2HB       LEU  20   9.246   3.475  -7.354
  851   2HB   LEU  20          3HB       LEU  20   8.728   4.243  -8.853
  852    HG   LEU  20           HG       LEU  20  11.435   3.196  -9.028
  853   1HD1  LEU  20          1HD1      LEU  20   9.310   1.102  -8.790
  854   2HD1  LEU  20          2HD1      LEU  20  10.233   1.618  -7.379
  855   3HD1  LEU  20          3HD1      LEU  20  11.065   0.923  -8.769
  856   1HD2  LEU  20          1HD2      LEU  20  10.117   1.951 -10.944
  857   2HD2  LEU  20          2HD2      LEU  20  10.517   3.663 -11.067
  858   3HD2  LEU  20          3HD2      LEU  20   8.897   3.170 -10.577
  859    H    CYS  21           H        CYS  21  10.538   7.496  -9.150
  860    HA   CYS  21           HA       CYS  21   8.606   8.894  -7.638
  861   1HB   CYS  21          2HB       CYS  21  10.566   9.957  -8.764
  862   2HB   CYS  21          3HB       CYS  21   9.819   9.643 -10.318
  863    H    TYR  22           H        TYR  22   6.544   9.538  -8.330
  864    HA   TYR  22           HA       TYR  22   5.351   7.870 -10.444
  865   1HB   TYR  22          2HB       TYR  22   4.194   7.214  -8.567
  866   2HB   TYR  22          3HB       TYR  22   4.364   8.781  -7.781
  867    HD1  TYR  22           HD1      TYR  22   2.714   7.304 -10.798
  868    HD2  TYR  22           HD2      TYR  22   2.463  10.066  -7.571
  869    HE1  TYR  22           HE1      TYR  22   0.424   7.887 -11.482
  870    HE2  TYR  22           HE2      TYR  22   0.173  10.656  -8.246
  871    HH   TYR  22           HH       TYR  22  -1.144  10.554 -10.568
  872    H    THR  23           H        THR  23   5.865  11.087  -9.299
  873    HA   THR  23           HA       THR  23   3.828  12.416 -10.736
  874    HB   THR  23           HB       THR  23   6.521  13.457  -9.834
  875    HG1  THR  23           HG1      THR  23   3.985  13.881  -8.627
  876   1HG2  THR  23          1HG2      THR  23   5.127  15.662  -9.892
  877   2HG2  THR  23          2HG2      THR  23   4.137  14.786 -11.059
  878   3HG2  THR  23          3HG2      THR  23   5.852  15.047 -11.377
  879    H    CYS  24           H        CYS  24   7.231  11.541 -11.588
  880    HA   CYS  24           HA       CYS  24   6.610  12.495 -14.287
  881   1HB   CYS  24          2HB       CYS  24   9.017  12.746 -14.637
  882   2HB   CYS  24          3HB       CYS  24   8.484  13.698 -13.266
  883    H    GLY  25           H        GLY  25   7.925   9.945 -12.242
  884   1HA   GLY  25          1HA       GLY  25   7.518   7.630 -12.680
  885   2HA   GLY  25          2HA       GLY  25   7.446   8.001 -14.396
  886    H    SER  26           H        SER  26   9.922   9.044 -12.104
  887    HA   SER  26           HA       SER  26  11.850   7.297 -13.483
  888   1HB   SER  26          2HB       SER  26  11.839  10.221 -13.261
  889   2HB   SER  26          3HB       SER  26  13.358   9.484 -12.751
  890    HG   SER  26           HG       SER  26  13.175   8.277 -14.821
  891    HA   PRO  27           HA       PRO  27  12.754   6.029  -9.335
  892   1HB   PRO  27          2HB       PRO  27  14.938   4.528  -9.924
  893   2HB   PRO  27          3HB       PRO  27  13.287   3.989 -10.251
  894   1HG   PRO  27          2HG       PRO  27  15.288   5.203 -12.117
  895   2HG   PRO  27          3HG       PRO  27  14.194   3.834 -12.386
  896   1HD   PRO  27          2HD       PRO  27  13.671   6.321 -13.320
  897   2HD   PRO  27          3HD       PRO  27  12.389   5.199 -12.821
  898    H    GLY  28           H        GLY  28  14.673   6.011  -7.852
  899   1HA   GLY  28          1HA       GLY  28  16.768   6.864  -7.166
  900   2HA   GLY  28          2HA       GLY  28  16.774   7.914  -8.575
  901    H    HIS  29           H        HIS  29  13.859   8.560  -7.799
  902    HA   HIS  29           HA       HIS  29  14.192  10.097  -5.372
  903   1HB   HIS  29          2HB       HIS  29  13.932  12.260  -6.306
  904   2HB   HIS  29          3HB       HIS  29  15.193  11.481  -7.257
  905    HD1  HIS  29           HD1      HIS  29  14.824  11.327  -9.730
  906    HD2  HIS  29           HD2      HIS  29  11.375  12.385  -7.669
  907    HE1  HIS  29           HE1      HIS  29  13.140  11.925 -11.499
  908    H    TYR  30           H        TYR  30  12.146  11.465  -4.991
  909    HA   TYR  30           HA       TYR  30   9.800  10.020  -6.035
  910   1HB   TYR  30          2HB       TYR  30  10.734  10.135  -3.353
  911   2HB   TYR  30          3HB       TYR  30   9.246  11.073  -3.434
  912    HD1  TYR  30           HD1      TYR  30  10.521   7.830  -4.807
  913    HD2  TYR  30           HD2      TYR  30   7.330   9.915  -2.919
  914    HE1  TYR  30           HE1      TYR  30   9.213   5.749  -4.736
  915    HE2  TYR  30           HE2      TYR  30   6.012   7.839  -2.841
  916    HH   TYR  30           HH       TYR  30   6.333   5.451  -2.906
  917    H    GLN  31           H        GLN  31   7.731  11.362  -5.267
  918    HA   GLN  31           HA       GLN  31   7.557  13.609  -6.833
  919   1HB   GLN  31          2HB       GLN  31   5.565  12.542  -6.032
  920   2HB   GLN  31          3HB       GLN  31   5.992  12.874  -4.359
  921   1HG   GLN  31          2HG       GLN  31   5.083  14.901  -4.419
  922   2HG   GLN  31          3HG       GLN  31   5.833  15.285  -5.967
  923   1HE2  GLN  31          1HE2      GLN  31   3.538  12.747  -5.063
  924   2HE2  GLN  31          2HE2      GLN  31   2.305  13.222  -6.175
  925    H    ALA  32           H        ALA  32   8.332  13.439  -3.380
  926    HA   ALA  32           HA       ALA  32   8.392  16.167  -2.821
  927   1HB   ALA  32          1HB       ALA  32   8.632  14.102  -1.262
  928   2HB   ALA  32          2HB       ALA  32  10.359  14.311  -1.552
  929   3HB   ALA  32          3HB       ALA  32   9.422  15.618  -0.829
  930    H    GLN  33           H        GLN  33  10.738  14.120  -4.413
  931    HA   GLN  33           HA       GLN  33  12.503  16.459  -4.727
  932   1HB   GLN  33          2HB       GLN  33  13.131  13.536  -4.440
  933   2HB   GLN  33          3HB       GLN  33  14.268  14.629  -5.216
  934   1HG   GLN  33          2HG       GLN  33  14.788  15.696  -3.279
  935   2HG   GLN  33          3HG       GLN  33  13.202  15.410  -2.565
  936   1HE2  GLN  33          1HE2      GLN  33  12.852  12.809  -2.556
  937   2HE2  GLN  33          2HE2      GLN  33  14.096  11.987  -1.681
  938    H    CYS  34           H        CYS  34  10.140  15.707  -6.425
  939    HA   CYS  34           HA       CYS  34  11.263  14.569  -8.783
  940   1HB   CYS  34          2HB       CYS  34   8.864  14.306  -8.100
  941   2HB   CYS  34          3HB       CYS  34   8.610  16.005  -8.447
  942    HA   PRO  35           HA       PRO  35  13.053  18.426 -10.133
  943   1HB   PRO  35          2HB       PRO  35  13.776  17.561 -12.604
  944   2HB   PRO  35          3HB       PRO  35  14.658  17.124 -11.136
  945   1HG   PRO  35          2HG       PRO  35  12.616  15.550 -12.658
  946   2HG   PRO  35          3HG       PRO  35  14.148  15.005 -11.949
  947   1HD   PRO  35          2HD       PRO  35  11.756  14.588 -10.749
  948   2HD   PRO  35          3HD       PRO  35  13.253  14.843  -9.831
  949    H    LYS  36           H        LYS  36  10.286  16.892 -11.383
  950    HA   LYS  36           HA       LYS  36   9.784  19.039 -13.317
  951   1HB   LYS  36          2HB       LYS  36   9.407  16.367 -13.580
  952   2HB   LYS  36          3HB       LYS  36   7.814  16.855 -13.019
  953   1HG   LYS  36          2HG       LYS  36   7.524  18.321 -14.866
  954   2HG   LYS  36          3HG       LYS  36   9.209  18.136 -15.355
  955   1HD   LYS  36          2HD       LYS  36   8.329  15.547 -15.333
  956   2HD   LYS  36          3HD       LYS  36   6.894  16.420 -15.877
  957   1HE   LYS  36          2HE       LYS  36   8.040  17.336 -17.729
  958   2HE   LYS  36          3HE       LYS  36   9.611  16.860 -17.089
  959   1HZ   LYS  36          1HZ       LYS  36   8.316  15.479 -18.943
  960   2HZ   LYS  36          2HZ       LYS  36   7.713  14.710 -17.563
  961   3HZ   LYS  36          3HZ       LYS  36   9.380  14.763 -17.839
  962    H    LYS  37           H        LYS  37   9.315  18.519 -10.139
  963    HA   LYS  37           HA       LYS  37   6.616  19.053  -9.657
  964   1HB   LYS  37          2HB       LYS  37   9.141  19.321  -8.120
  965   2HB   LYS  37          3HB       LYS  37   7.762  20.240  -7.531
  966   1HG   LYS  37          2HG       LYS  37   6.946  17.564  -8.145
  967   2HG   LYS  37          3HG       LYS  37   8.353  17.538  -7.079
  968   1HD   LYS  37          2HD       LYS  37   6.697  17.696  -5.514
  969   2HD   LYS  37          3HD       LYS  37   6.975  19.413  -5.815
  970   1HE   LYS  37          2HE       LYS  37   5.084  18.334  -7.703
  971   2HE   LYS  37          3HE       LYS  37   4.566  18.011  -6.049
  972   1HZ   LYS  37          1HZ       LYS  37   5.034  20.609  -7.364
  973   2HZ   LYS  37          2HZ       LYS  37   5.103  20.478  -5.679
  974   3HZ   LYS  37          3HZ       LYS  37   3.677  20.084  -6.499
  975    H    ARG  38           H        ARG  38   5.633  20.660 -10.759
  976    HA   ARG  38           HA       ARG  38   6.750  23.105 -11.502
  977   1HB   ARG  38          2HB       ARG  38   4.471  23.847 -11.925
  978   2HB   ARG  38          3HB       ARG  38   4.681  22.190 -12.474
  979   1HG   ARG  38          2HG       ARG  38   3.741  21.610 -10.100
  980   2HG   ARG  38          3HG       ARG  38   3.089  23.247 -10.195
  981   1HD   ARG  38          2HD       ARG  38   2.707  21.547 -12.578
  982   2HD   ARG  38          3HD       ARG  38   1.813  21.071 -11.135
  983    HE   ARG  38           HE       ARG  38   1.251  23.276 -12.827
  984   1HH1  ARG  38          2HH1      ARG  38   1.212  22.277  -9.492
  985   2HH1  ARG  38          1HH1      ARG  38  -0.059  23.366  -9.045
  986   1HH2  ARG  38          2HH2      ARG  38  -0.423  24.715 -12.250
  987   2HH2  ARG  38          1HH2      ARG  38  -0.988  24.752 -10.614
  988    H    LYS  39           H        LYS  39   6.427  25.232 -10.685
  989    HA   LYS  39           HA       LYS  39   5.236  25.768  -8.175
  990   1HB   LYS  39          2HB       LYS  39   7.955  24.787  -8.127
  991   2HB   LYS  39          3HB       LYS  39   7.878  26.427  -7.497
  992   1HG   LYS  39          2HG       LYS  39   5.837  24.536  -6.504
  993   2HG   LYS  39          3HG       LYS  39   7.502  24.257  -5.988
  994   1HD   LYS  39          2HD       LYS  39   7.653  26.431  -5.031
  995   2HD   LYS  39          3HD       LYS  39   6.129  26.930  -5.766
  996   1HE   LYS  39          2HE       LYS  39   5.075  25.032  -4.404
  997   2HE   LYS  39          3HE       LYS  39   6.584  25.021  -3.493
  998   1HZ   LYS  39          1HZ       LYS  39   4.389  26.793  -3.276
  999   2HZ   LYS  39          2HZ       LYS  39   5.791  27.665  -3.645
 1000   3HZ   LYS  39          3HZ       LYS  39   5.752  26.661  -2.282
 1001    H    SER  40           H        SER  40   7.944  26.766 -10.259
 1002    HA   SER  40           HA       SER  40   6.701  29.194 -11.010
 1003   1HB   SER  40          2HB       SER  40   8.352  29.234  -8.589
 1004   2HB   SER  40          3HB       SER  40   8.860  30.409  -9.803
 1005    HG   SER  40           HG       SER  40   7.134  31.009  -8.206
 1006    H    GLY  41           H        GLY  41   8.181  30.590 -12.305
 1007   1HA   GLY  41          1HA       GLY  41  10.216  28.900 -13.610
 1008   2HA   GLY  41          2HA       GLY  41   9.300  30.165 -14.414
 1009    H    ASN  42           H        ASN  42   9.584  32.383 -13.160
 1010    HA   ASN  42           HA       ASN  42  10.974  34.132 -12.735
 1011   1HB   ASN  42          2HB       ASN  42  11.837  32.000 -11.041
 1012   2HB   ASN  42          3HB       ASN  42  13.260  32.872 -11.603
 1013   1HD2  ASN  42          1HD2      ASN  42  13.858  34.463 -10.342
 1014   2HD2  ASN  42          2HD2      ASN  42  12.825  35.420  -9.340
 1015    H    SER  43           H        SER  43  13.482  34.768 -12.948
 1016    HA   SER  43           HA       SER  43  14.896  33.408 -15.037
 1017   1HB   SER  43          2HB       SER  43  14.795  35.654 -16.450
 1018   2HB   SER  43          3HB       SER  43  13.583  34.390 -16.655
 1019    HG   SER  43           HG       SER  43  13.323  36.926 -15.650
 1020    H    ARG  44           H        ARG  44  16.241  33.597 -13.031
 1021    HA   ARG  44           HA       ARG  44  18.045  35.847 -13.333
 1022   1HB   ARG  44          2HB       ARG  44  16.208  35.554 -11.060
 1023   2HB   ARG  44          3HB       ARG  44  17.890  35.780 -10.598
 1024   1HG   ARG  44          2HG       ARG  44  17.827  37.758 -12.266
 1025   2HG   ARG  44          3HG       ARG  44  16.077  37.625 -12.089
 1026   1HD   ARG  44          2HD       ARG  44  16.118  38.569 -10.067
 1027   2HD   ARG  44          3HD       ARG  44  17.449  37.544  -9.534
 1028    HE   ARG  44           HE       ARG  44  18.869  39.283  -9.925
 1029   1HH1  ARG  44          2HH1      ARG  44  15.942  39.809 -11.735
 1030   2HH1  ARG  44          1HH1      ARG  44  16.410  41.385 -12.284
 1031   1HH2  ARG  44          2HH2      ARG  44  19.496  41.356 -10.640
 1032   2HH2  ARG  44          1HH2      ARG  44  18.431  42.263 -11.661
 1033    H    GLU  45           H        GLU  45  20.131  35.423 -12.627
 1034    HA   GLU  45           HA       GLU  45  20.988  32.772 -12.661
 1035   1HB   GLU  45          2HB       GLU  45  22.256  35.364 -11.887
 1036   2HB   GLU  45          3HB       GLU  45  23.099  33.867 -11.517
 1037   1HG   GLU  45          2HG       GLU  45  23.962  34.491 -13.574
 1038   2HG   GLU  45          3HG       GLU  45  22.747  33.280 -13.982
 1039    H    ARG  46           H        ARG  46  20.503  31.262 -11.213
 1040    HA   ARG  46           HA       ARG  46  20.306  32.003  -8.381
 1041   1HB   ARG  46          2HB       ARG  46  18.496  30.676  -9.758
 1042   2HB   ARG  46          3HB       ARG  46  19.543  29.305  -9.416
 1043   1HG   ARG  46          2HG       ARG  46  19.173  29.427  -7.130
 1044   2HG   ARG  46          3HG       ARG  46  18.619  31.100  -7.212
 1045   1HD   ARG  46          2HD       ARG  46  16.693  30.146  -8.646
 1046   2HD   ARG  46          3HD       ARG  46  17.170  28.590  -7.969
 1047    HE   ARG  46           HE       ARG  46  15.759  30.689  -6.634
 1048   1HH1  ARG  46          2HH1      ARG  46  17.956  28.027  -6.176
 1049   2HH1  ARG  46          1HH1      ARG  46  17.507  27.770  -4.522
 1050   1HH2  ARG  46          2HH2      ARG  46  15.158  30.360  -4.458
 1051   2HH2  ARG  46          1HH2      ARG  46  15.914  29.097  -3.547
 1052    H    CYS  47           H        CYS  47  20.998  30.062  -6.813
 1053    HA   CYS  47           HA       CYS  47  23.551  29.058  -7.846
 1054   1HB   CYS  47          2HB       CYS  47  23.923  30.932  -6.279
 1055   2HB   CYS  47          3HB       CYS  47  23.015  30.088  -5.040
 1056    H    GLN  48           H        GLN  48  23.464  26.917  -7.906
 1057    HA   GLN  48           HA       GLN  48  21.508  25.462  -6.296
 1058   1HB   GLN  48          2HB       GLN  48  22.354  25.202  -8.928
 1059   2HB   GLN  48          3HB       GLN  48  23.129  23.855  -8.104
 1060   1HG   GLN  48          2HG       GLN  48  21.095  23.005  -8.865
 1061   2HG   GLN  48          3HG       GLN  48  20.838  23.320  -7.149
 1062   1HE2  GLN  48          1HE2      GLN  48  19.111  24.449  -6.606
 1063   2HE2  GLN  48          2HE2      GLN  48  18.161  25.421  -7.671
 1064    H    LEU  49           H        LEU  49  23.969  26.585  -5.140
 1065    HA   LEU  49           HA       LEU  49  25.142  24.072  -4.146
 1066   1HB   LEU  49          2HB       LEU  49  26.440  26.215  -5.469
 1067   2HB   LEU  49          3HB       LEU  49  26.957  26.239  -3.784
 1068    HG   LEU  49           HG       LEU  49  27.046  23.611  -5.131
 1069   1HD1  LEU  49          1HD1      LEU  49  29.186  24.137  -6.225
 1070   2HD1  LEU  49          2HD1      LEU  49  28.942  25.843  -5.848
 1071   3HD1  LEU  49          3HD1      LEU  49  27.831  25.013  -6.939
 1072   1HD2  LEU  49          1HD2      LEU  49  27.796  24.183  -2.773
 1073   2HD2  LEU  49          2HD2      LEU  49  29.150  25.031  -3.521
 1074   3HD2  LEU  49          3HD2      LEU  49  28.944  23.298  -3.777
 1075    H    CYS  50           H        CYS  50  24.159  27.452  -3.416
 1076    HA   CYS  50           HA       CYS  50  24.104  26.628  -0.610
 1077   1HB   CYS  50          2HB       CYS  50  24.994  28.665   0.150
 1078   2HB   CYS  50          3HB       CYS  50  26.040  28.199  -1.178
 1079    H    ASN  51           H        ASN  51  22.292  26.949  -3.088
 1080    HA   ASN  51           HA       ASN  51  20.145  27.537  -3.555
 1081   1HB   ASN  51          2HB       ASN  51  19.825  28.111  -0.609
 1082   2HB   ASN  51          3HB       ASN  51  18.585  27.607  -1.754
 1083   1HD2  ASN  51          1HD2      ASN  51  20.181  26.553   0.782
 1084   2HD2  ASN  51          2HD2      ASN  51  20.333  24.871   0.414
 1085    H    GLY  52           H        GLY  52  22.350  29.607  -3.251
 1086   1HA   GLY  52          1HA       GLY  52  21.195  32.023  -2.337
 1087   2HA   GLY  52          2HA       GLY  52  22.583  31.887  -3.406
 1088    H    MET  53           H        MET  53  20.555  33.870  -3.588
 1089    HA   MET  53           HA       MET  53  19.392  33.163  -6.200
 1090   1HB   MET  53          2HB       MET  53  17.576  34.844  -5.606
 1091   2HB   MET  53          3HB       MET  53  17.538  33.312  -4.744
 1092   1HG   MET  53          2HG       MET  53  18.006  34.261  -2.753
 1093   2HG   MET  53          3HG       MET  53  19.053  35.490  -3.461
 1094   1HE   MET  53          1HE       MET  53  17.225  38.378  -2.612
 1095   2HE   MET  53          2HE       MET  53  18.710  37.491  -2.957
 1096   3HE   MET  53          3HE       MET  53  17.763  38.173  -4.279
 1097    H    GLY  54           H        GLY  54  20.892  34.105  -7.514
 1098   1HA   GLY  54          1HA       GLY  54  20.826  36.563  -8.456
 1099   2HA   GLY  54          2HA       GLY  54  21.721  36.858  -6.973
 1100    H    HIS  55           H        HIS  55  23.513  34.975  -6.724
 1101    HA   HIS  55           HA       HIS  55  25.248  35.389  -9.015
 1102   1HB   HIS  55          2HB       HIS  55  26.996  34.402  -7.572
 1103   2HB   HIS  55          3HB       HIS  55  26.177  35.752  -6.794
 1104    HD1  HIS  55           HD1      HIS  55  24.298  35.031  -4.985
 1105    HD2  HIS  55           HD2      HIS  55  27.011  32.097  -6.122
 1106    HE1  HIS  55           HE1      HIS  55  24.148  33.253  -3.213
 1107    H    ASN  56           H        ASN  56  26.848  33.254  -9.138
 1108    HA   ASN  56           HA       ASN  56  25.039  31.032  -9.828
 1109   1HB   ASN  56          2HB       ASN  56  27.533  31.993 -11.239
 1110   2HB   ASN  56          3HB       ASN  56  26.741  30.463 -11.600
 1111   1HD2  ASN  56          1HD2      ASN  56  25.357  30.502 -13.207
 1112   2HD2  ASN  56          2HD2      ASN  56  24.499  31.887 -13.782
 1113    H    ALA  57           H        ALA  57  25.823  28.902  -9.549
 1114    HA   ALA  57           HA       ALA  57  27.243  28.436  -7.192
 1115   1HB   ALA  57          1HB       ALA  57  27.499  26.115  -8.736
 1116   2HB   ALA  57          2HB       ALA  57  26.260  26.475  -7.533
 1117   3HB   ALA  57          3HB       ALA  57  25.977  26.857  -9.232
 1118    H    LYS  58           H        LYS  58  28.326  28.603 -10.530
 1119    HA   LYS  58           HA       LYS  58  30.894  27.514 -10.183
 1120   1HB   LYS  58          2HB       LYS  58  29.540  29.192 -12.214
 1121   2HB   LYS  58          3HB       LYS  58  31.298  29.258 -12.202
 1122   1HG   LYS  58          2HG       LYS  58  29.992  26.590 -12.150
 1123   2HG   LYS  58          3HG       LYS  58  29.988  27.502 -13.661
 1124   1HD   LYS  58          2HD       LYS  58  31.961  26.376 -13.905
 1125   2HD   LYS  58          3HD       LYS  58  32.549  27.808 -13.057
 1126   1HE   LYS  58          2HE       LYS  58  31.682  25.928 -11.114
 1127   2HE   LYS  58          3HE       LYS  58  32.707  25.079 -12.269
 1128   1HZ   LYS  58          1HZ       LYS  58  34.489  26.025 -11.391
 1129   2HZ   LYS  58          2HZ       LYS  58  33.517  26.710 -10.188
 1130   3HZ   LYS  58          3HZ       LYS  58  33.851  27.577 -11.601
 1131    H    GLN  59           H        GLN  59  29.560  30.554  -9.282
 1132    HA   GLN  59           HA       GLN  59  32.253  31.558  -8.638
 1133   1HB   GLN  59          2HB       GLN  59  30.611  32.827 -10.268
 1134   2HB   GLN  59          3HB       GLN  59  29.887  33.377  -8.763
 1135   1HG   GLN  59          2HG       GLN  59  31.409  35.045  -9.344
 1136   2HG   GLN  59          3HG       GLN  59  32.220  34.113  -8.086
 1137   1HE2  GLN  59          1HE2      GLN  59  32.996  35.768 -10.593
 1138   2HE2  GLN  59          2HE2      GLN  59  34.213  34.791 -11.331
 1139    H    CYS  60           H        CYS  60  30.080  29.810  -7.112
 1140    HA   CYS  60           HA       CYS  60  29.658  31.578  -4.858
 1141   1HB   CYS  60          2HB       CYS  60  27.806  30.130  -5.660
 1142   2HB   CYS  60          3HB       CYS  60  28.756  28.709  -5.273
 1143    H    ARG  61           H        ARG  61  30.751  31.346  -2.965
 1144    HA   ARG  61           HA       ARG  61  32.496  30.866  -1.579
 1145   1HB   ARG  61          2HB       ARG  61  31.655  28.124  -2.499
 1146   2HB   ARG  61          3HB       ARG  61  32.923  28.357  -1.303
 1147   1HG   ARG  61          2HG       ARG  61  31.388  29.429   0.199
 1148   2HG   ARG  61          3HG       ARG  61  30.114  29.398  -1.021
 1149   1HD   ARG  61          2HD       ARG  61  30.344  26.881  -1.010
 1150   2HD   ARG  61          3HD       ARG  61  31.361  27.068   0.419
 1151    HE   ARG  61           HE       ARG  61  29.077  28.440   1.015
 1152   1HH1  ARG  61          2HH1      ARG  61  29.812  25.185   0.026
 1153   2HH1  ARG  61          1HH1      ARG  61  28.465  24.487   0.863
 1154   1HH2  ARG  61          2HH2      ARG  61  27.299  27.534   2.120
 1155   2HH2  ARG  61          1HH2      ARG  61  27.035  25.825   2.053
 1156    H    LYS  62           H        LYS  62  33.639  31.973  -3.560
 1157    HA   LYS  62           HA       LYS  62  35.961  30.294  -4.178
 1158   1HB   LYS  62          2HB       LYS  62  34.150  30.634  -6.098
 1159   2HB   LYS  62          3HB       LYS  62  35.006  32.156  -6.299
 1160   1HG   LYS  62          2HG       LYS  62  36.138  30.816  -7.768
 1161   2HG   LYS  62          3HG       LYS  62  37.124  30.627  -6.316
 1162   1HD   LYS  62          2HD       LYS  62  36.518  28.463  -6.029
 1163   2HD   LYS  62          3HD       LYS  62  34.876  28.734  -6.620
 1164   1HE   LYS  62          2HE       LYS  62  36.174  27.274  -8.112
 1165   2HE   LYS  62          3HE       LYS  62  35.674  28.765  -8.908
 1166   1HZ   LYS  62          1HZ       LYS  62  37.826  29.619  -8.815
 1167   2HZ   LYS  62          2HZ       LYS  62  38.056  28.000  -9.247
 1168   3HZ   LYS  62          3HZ       LYS  62  38.338  28.499  -7.654
 1169    H    ARG  63           H        ARG  63  37.897  31.482  -4.629
 1170    HA   ARG  63           HA       ARG  63  37.861  34.351  -4.152
 1171   1HB   ARG  63          2HB       ARG  63  38.844  32.351  -2.210
 1172   2HB   ARG  63          3HB       ARG  63  39.913  33.716  -2.504
 1173   1HG   ARG  63          2HG       ARG  63  37.852  35.175  -2.074
 1174   2HG   ARG  63          3HG       ARG  63  37.134  33.715  -1.390
 1175   1HD   ARG  63          2HD       ARG  63  38.089  34.846   0.435
 1176   2HD   ARG  63          3HD       ARG  63  39.220  33.550   0.051
 1177    HE   ARG  63           HE       ARG  63  39.974  35.881  -1.329
 1178   1HH1  ARG  63          2HH1      ARG  63  39.854  34.583   1.900
 1179   2HH1  ARG  63          1HH1      ARG  63  41.192  35.526   2.469
 1180   1HH2  ARG  63          2HH2      ARG  63  41.735  37.128  -0.592
 1181   2HH2  ARG  63          1HH2      ARG  63  42.260  36.974   1.052
 1182    H    ASP  64           H        ASP  64  38.647  34.598  -6.239
 1183    HA   ASP  64           HA       ASP  64  40.197  34.754  -7.898
 1184   1HB   ASP  64          2HB       ASP  64  42.164  34.336  -5.636
 1185   2HB   ASP  64          3HB       ASP  64  42.532  35.011  -7.221
  Start of MODEL   11
    1   1H5*    C 160          1H5*        C 160  18.102   9.235 -13.245
    2   2H5*    C 160          2H5*        C 160  17.598  10.774 -12.547
    3    H4*    C 160           H4*        C 160  18.566   9.621 -10.769
    4    H3*    C 160           H3*        C 160  20.462  11.639 -11.919
    5    H2*    C 160           H2*        C 160  22.098  11.074 -10.289
    6   2HO*    C 160          2HO*        C 160  21.407   9.887  -8.491
    7    H1*    C 160           H1*        C 160  21.801   8.308 -10.746
    8   1H4     C 160          1H4         C 160  26.882  10.072 -14.206
    9   2H4     C 160          2H4         C 160  25.806  10.502 -15.516
   10    H5     C 160           H5         C 160  23.450  10.474 -15.347
   11    H6     C 160           H6         C 160  21.529  10.022 -13.864
   12   1H5*    U 161          1H5*        U 161  20.352  12.718  -7.530
   13   2H5*    U 161          2H5*        U 161  20.293  14.480  -7.559
   14    H4*    U 161           H4*        U 161  22.154  13.654  -6.211
   15    H3*    U 161           H3*        U 161  22.801  15.239  -8.684
   16    H2*    U 161           H2*        U 161  25.102  15.212  -8.082
   17   2HO*    U 161          2HO*        U 161  25.519  14.137  -5.925
   18    H1*    U 161           H1*        U 161  25.098  12.449  -7.572
   19    H3     U 161           H3         U 161  27.595  13.262 -11.351
   20    H5     U 161           H5         U 161  23.640  12.880 -12.673
   21    H6     U 161           H6         U 161  22.954  12.911 -10.319
   22   1H5*    G 162          1H5*        G 162  24.721  16.858  -5.348
   23   2H5*    G 162          2H5*        G 162  24.322  18.558  -5.100
   24    H4*    G 162           H4*        G 162  26.629  18.471  -4.819
   25    H3*    G 162           H3*        G 162  25.893  19.485  -7.535
   26    H2*    G 162           H2*        G 162  28.189  19.730  -8.124
   27   2HO*    G 162          2HO*        G 162  29.530  18.787  -6.080
   28    H1*    G 162           H1*        G 162  28.847  17.135  -7.335
   29    H8     G 162           H8         G 162  25.456  17.035  -8.842
   30    H1     G 162           H1         G 162  30.188  17.163 -13.256
   31   1H2     G 162          1H2         G 162  31.980  17.597 -12.331
   32   2H2     G 162          2H2         G 162  32.172  17.882 -10.617
   33   1H5*    C 163          1H5*        C 163  28.780  21.782  -5.977
   34   2H5*    C 163          2H5*        C 163  28.545  23.529  -5.947
   35    H4*    C 163           H4*        C 163  30.633  23.219  -6.948
   36    H3*    C 163           H3*        C 163  28.511  23.774  -9.006
   37    H2*    C 163           H2*        C 163  30.168  23.782 -10.708
   38   2HO*    C 163          2HO*        C 163  32.169  23.220  -8.768
   39    H1*    C 163           H1*        C 163  31.338  21.392  -9.825
   40   1H4     C 163          1H4         C 163  27.278  19.520 -14.378
   41   2H4     C 163          2H4         C 163  25.952  19.659 -13.247
   42    H5     C 163           H5         C 163  26.175  20.502 -11.053
   43    H6     C 163           H6         C 163  27.743  21.429  -9.385
   44   1H5*    C 164          1H5*        C 164  31.471  26.910  -9.668
   45   2H5*    C 164          2H5*        C 164  30.613  28.407 -10.032
   46    H4*    C 164           H4*        C 164  32.148  27.820 -11.820
   47    H3*    C 164           H3*        C 164  29.209  27.799 -12.449
   48    H2*    C 164           H2*        C 164  29.698  27.351 -14.731
   49   2HO*    C 164          2HO*        C 164  32.376  27.139 -14.691
   50    H1*    C 164           H1*        C 164  31.522  25.297 -14.083
   51   1H4     C 164          1H4         C 164  26.080  22.235 -15.417
   52   2H4     C 164          2H4         C 164  25.490  22.605 -13.812
   53    H5     C 164           H5         C 164  26.640  23.974 -12.269
   54    H6     C 164           H6         C 164  28.662  25.338 -11.882
   55   1H5*    C 165          1H5*        C 165  30.962  30.598 -15.206
   56   2H5*    C 165          2H5*        C 165  29.885  31.963 -15.501
   57    H4*    C 165           H4*        C 165  30.405  30.810 -17.569
   58    H3*    C 165           H3*        C 165  27.552  30.705 -16.622
   59    H2*    C 165           H2*        C 165  26.931  29.594 -18.626
   60   2HO*    C 165          2HO*        C 165  28.201  30.034 -20.346
   61    H1*    C 165           H1*        C 165  29.118  27.796 -18.451
   62   1H4     C 165          1H4         C 165  24.082  24.530 -16.254
   63   2H4     C 165          2H4         C 165  24.316  25.267 -14.684
   64    H5     C 165           H5         C 165  25.904  26.959 -14.247
   65    H6     C 165           H6         C 165  27.678  28.375 -15.219
   66   1H5*    U 166          1H5*        U 166  27.396  32.652 -20.676
   67   2H5*    U 166          2H5*        U 166  26.163  33.906 -20.543
   68    H4*    U 166           H4*        U 166  25.724  32.375 -22.398
   69    H3*    U 166           H3*        U 166  23.740  32.500 -20.143
   70    H2*    U 166           H2*        U 166  22.299  31.028 -21.328
   71   2HO*    U 166          2HO*        U 166  23.265  30.424 -23.556
   72    H1*    U 166           H1*        U 166  24.375  29.226 -21.929
   73    H3     U 166           H3         U 166  21.518  27.191 -18.963
   74    H5     U 166           H5         U 166  24.167  29.420 -16.606
   75    H6     U 166           H6         U 166  24.997  30.438 -18.678
   76   1H5*    C 167          1H5*        C 167  21.338  33.564 -23.787
   77   2H5*    C 167          2H5*        C 167  20.443  35.000 -23.294
   78    H4*    C 167           H4*        C 167  18.903  33.417 -24.204
   79    H3*    C 167           H3*        C 167  18.712  33.793 -21.226
   80    H2*    C 167           H2*        C 167  16.798  32.379 -21.183
   81   2HO*    C 167          2HO*        C 167  16.870  31.769 -23.898
   82    H1*    C 167           H1*        C 167  18.031  30.382 -22.706
   83   1H4     C 167          1H4         C 167  18.966  28.705 -16.603
   84   2H4     C 167          2H4         C 167  20.445  29.638 -16.606
   85    H5     C 167           H5         C 167  21.132  31.006 -18.405
   86    H6     C 167           H6         C 167  20.563  31.822 -20.665
   87   1H5*    A 168          1H5*        A 168  16.580  34.197 -20.102
   88   2H5*    A 168          2H5*        A 168  15.473  34.947 -21.251
   89    H4*    A 168           H4*        A 168  14.286  34.946 -19.255
   90    H3*    A 168           H3*        A 168  15.521  37.635 -19.751
   91    H2*    A 168           H2*        A 168  14.542  38.482 -17.761
   92   2HO*    A 168          2HO*        A 168  12.887  37.242 -16.797
   93    H1*    A 168           H1*        A 168  15.393  36.344 -16.187
   94    H8     A 168           H8         A 168  16.700  38.864 -18.702
   95   1H6     A 168          1H6         A 168  21.431  39.747 -14.729
   96   2H6     A 168          2H6         A 168  20.697  40.321 -16.211
   97    H2     A 168           H2         A 168  18.972  36.363 -13.233
   98   1H5*    U 169          1H5*        U 169  14.032  41.209 -20.990
   99   2H5*    U 169          2H5*        U 169  15.473  40.440 -20.323
  100    H4*    U 169           H4*        U 169  14.168  41.288 -18.056
  101    H3*    U 169           H3*        U 169  13.414  43.147 -20.276
  102    H2*    U 169           H2*        U 169  13.837  45.044 -18.906
  103   2HO*    U 169          2HO*        U 169  13.300  44.508 -16.867
  104    H1*    U 169           H1*        U 169  16.354  44.189 -18.121
  105    H3     U 169           H3         U 169  16.856  47.567 -21.199
  106    H5     U 169           H5         U 169  16.594  44.040 -23.442
  107    H6     U 169           H6         U 169  15.967  42.886 -21.370
  108   1H5*    C 170          1H5*        C 170  10.307  41.344 -20.025
  109   2H5*    C 170          2H5*        C 170   8.614  41.314 -19.532
  110    H4*    C 170           H4*        C 170  10.014  39.437 -18.654
  111    H3*    C 170           H3*        C 170   8.475  41.235 -16.795
  112    H2*    C 170           H2*        C 170   9.079  39.829 -14.974
  113   2HO*    C 170          2HO*        C 170  10.607  37.968 -15.982
  114    H1*    C 170           H1*        C 170  11.789  39.777 -15.717
  115   1H4     C 170          1H4         C 170  11.483  44.402 -11.331
  116   2H4     C 170          2H4         C 170  10.831  45.493 -12.533
  117    H5     C 170           H5         C 170  10.275  44.848 -14.734
  118    H6     C 170           H6         C 170  10.208  42.974 -16.343
  119   1H5*    C 171          1H5*        C 171   4.808  37.968 -17.339
  120   2H5*    C 171          2H5*        C 171   3.598  39.251 -17.358
  121    H4*    C 171           H4*        C 171   3.385  37.572 -15.501
  122    H3*    C 171           H3*        C 171   3.590  40.526 -14.910
  123    H2*    C 171           H2*        C 171   3.093  40.055 -12.644
  124   2HO*    C 171          2HO*        C 171   2.759  37.323 -13.457
  125    H1*    C 171           H1*        C 171   4.852  37.813 -12.600
  126   1H4     C 171          1H4         C 171   7.900  42.603  -9.627
  127   2H4     C 171          2H4         C 171   8.579  43.065 -11.171
  128    H5     C 171           H5         C 171   7.961  42.081 -13.228
  129    H6     C 171           H6         C 171   6.525  40.396 -14.319
  130   1H5*    G 172          1H5*        G 172  -0.413  39.083 -13.344
  131   2H5*    G 172          2H5*        G 172  -1.539  40.344 -13.848
  132    H4*    G 172           H4*        G 172  -1.897  39.918 -11.533
  133    H3*    G 172           H3*        G 172  -0.564  42.538 -12.136
  134    H2*    G 172           H2*        G 172  -0.608  43.110  -9.824
  135   2HO*    G 172          2HO*        G 172  -1.705  41.441  -8.432
  136    H1*    G 172           H1*        G 172   0.513  40.681  -9.027
  137    H8     G 172           H8         G 172   2.069  41.738 -12.242
  138    H1     G 172           H1         G 172   4.633  44.664  -7.069
  139   1H2     G 172          1H2         G 172   3.467  44.280  -5.412
  140   2H2     G 172          2H2         G 172   2.011  43.309  -5.422
  141   1H5*    U 173          1H5*        U 173  -3.479  43.405  -9.375
  142   2H5*    U 173          2H5*        U 173  -4.619  44.575 -10.037
  143    H4*    U 173           H4*        U 173  -4.057  45.444  -7.953
  144    H3*    U 173           H3*        U 173  -2.482  46.808 -10.120
  145    H2*    U 173           H2*        U 173  -1.525  48.265  -8.506
  146   2HO*    U 173          2HO*        U 173  -2.566  47.381  -6.214
  147    H1*    U 173           H1*        U 173  -0.851  46.196  -6.754
  148    H3     U 173           H3         U 173   3.126  47.577  -8.483
  149    H5     U 173           H5         U 173   1.478  45.157 -11.477
  150    H6     U 173           H6         U 173  -0.582  45.084 -10.146
  151   1H5*    C 174          1H5*        C 174  -3.994  49.745  -7.901
  152   2H5*    C 174          2H5*        C 174  -4.954  50.944  -8.768
  153    H4*    C 174           H4*        C 174  -3.407  52.232  -7.625
  154    H3*    C 174           H3*        C 174  -2.437  51.789 -10.440
  155    H2*    C 174           H2*        C 174  -0.598  53.235 -10.011
  156   2HO*    C 174          2HO*        C 174  -0.690  54.503  -8.092
  157    H1*    C 174           H1*        C 174   0.036  51.969  -7.585
  158   1H4     C 174          1H4         C 174   3.900  49.114 -11.772
  159   2H4     C 174          2H4         C 174   2.548  48.213 -12.419
  160    H5     C 174           H5         C 174   0.311  48.518 -11.725
  161    H6     C 174           H6         C 174  -1.194  49.775 -10.224
  162   1H5*    U 175          1H5*        U 175  -6.212  54.891  -9.830
  163   2H5*    U 175          2H5*        U 175  -6.420  54.448 -11.524
  164    H4*    U 175           H4*        U 175  -6.792  56.623 -12.198
  165    H3*    U 175           H3*        U 175  -5.245  57.526  -9.765
  166    H2*    U 175           H2*        U 175  -6.295  59.631  -9.949
  167   2HO*    U 175          2HO*        U 175  -6.374  60.105 -12.072
  168    H1*    U 175           H1*        U 175  -8.816  58.401 -10.617
  169    H3     U 175           H3         U 175  -9.989  60.681  -6.903
  170    H5     U 175           H5         U 175  -7.335  57.779  -5.463
  171    H6     U 175           H6         U 175  -6.906  57.155  -7.795
  172   1H5*    C 176          1H5*        C 176  -1.626  56.110 -10.505
  173   2H5*    C 176          2H5*        C 176  -2.353  57.338  -9.469
  174    H4*    C 176           H4*        C 176  -0.442  58.550  -9.311
  175    H3*    C 176           H3*        C 176   0.050  57.830 -12.168
  176    H2*    C 176           H2*        C 176   2.394  58.103 -11.918
  177   2HO*    C 176          2HO*        C 176   3.129  59.111  -9.968
  178    H1*    C 176           H1*        C 176   2.577  56.533  -9.644
  179   1H4     C 176          1H4         C 176   3.436  52.454 -14.492
  180   2H4     C 176          2H4         C 176   1.704  52.228 -14.577
  181    H5     C 176           H5         C 176   0.150  53.459 -13.293
  182    H6     C 176           H6         C 176  -0.126  55.229 -11.594
  183   1H5*    G 177          1H5*        G 177   2.250  61.508 -11.691
  184   2H5*    G 177          2H5*        G 177   1.680  62.626 -12.930
  185    H4*    G 177           H4*        G 177   4.034  62.576 -13.094
  186    H3*    G 177           H3*        G 177   2.627  61.112 -15.293
  187    H2*    G 177           H2*        G 177   4.705  60.553 -16.318
  188   2HO*    G 177          2HO*        G 177   6.546  61.464 -14.693
  189    H1*    G 177           H1*        G 177   5.796  59.550 -13.953
  190    H8     G 177           H8         G 177   2.254  58.562 -13.870
  191    H1     G 177           H1         G 177   5.744  54.889 -17.897
  192   1H2     G 177          1H2         G 177   7.591  55.758 -18.197
  193   2H2     G 177          2H2         G 177   8.114  57.259 -17.467
  194   1H5*    C 178          1H5*        C 178   5.232  63.841 -17.669
  195   2H5*    C 178          2H5*        C 178   4.137  64.482 -18.894
  196    H4*    C 178           H4*        C 178   6.080  63.427 -19.908
  197    H3*    C 178           H3*        C 178   3.392  62.179 -20.404
  198    H2*    C 178           H2*        C 178   4.385  60.616 -21.893
  199   2HO*    C 178          2HO*        C 178   6.945  61.139 -21.873
  200    H1*    C 178           H1*        C 178   6.467  60.007 -20.087
  201   1H4     C 178          1H4         C 178   2.182  55.344 -19.254
  202   2H4     C 178          2H4         C 178   1.258  56.399 -18.208
  203    H5     C 178           H5         C 178   1.783  58.671 -17.834
  204    H6     C 178           H6         C 178   3.339  60.510 -18.378
  205   1H5*    U 179          1H5*        U 179   5.038  63.205 -24.317
  206   2H5*    U 179          2H5*        U 179   3.745  63.598 -25.450
  207    H4*    U 179           H4*        U 179   5.138  61.693 -26.172
  208    H3*    U 179           H3*        U 179   2.191  61.286 -25.721
  209    H2*    U 179           H2*        U 179   2.381  59.076 -26.566
  210   2HO*    U 179          2HO*        U 179   4.705  58.586 -27.325
  211    H1*    U 179           H1*        U 179   4.652  58.498 -25.010
  212    H3     U 179           H3         U 179   1.039  56.029 -23.529
  213    H5     U 179           H5         U 179   0.919  59.641 -21.414
  214    H6     U 179           H6         U 179   2.661  60.471 -22.926
  215   1H5*    U 180          1H5*        U 180   3.041  60.024 -29.369
  216   2H5*    U 180          2H5*        U 180   1.985  60.447 -30.716
  217    H4*    U 180           H4*        U 180   2.116  58.075 -30.609
  218    H3*    U 180           H3*        U 180  -0.511  59.231 -29.743
  219    H2*    U 180           H2*        U 180  -1.393  57.062 -29.371
  220   2HO*    U 180          2HO*        U 180   0.392  55.331 -29.959
  221    H1*    U 180           H1*        U 180   0.938  56.211 -27.990
  222    H3     U 180           H3         U 180  -2.197  56.082 -24.728
  223    H5     U 180           H5         U 180  -1.586  60.176 -25.358
  224    H6     U 180           H6         U 180  -0.167  59.571 -27.265
  225   1H5*    A 181          1H5*        A 181  -1.800  58.431 -34.377
  226   2H5*    A 181          2H5*        A 181  -3.139  59.579 -34.379
  227    H4*    A 181           H4*        A 181  -3.743  57.131 -34.550
  228    H3*    A 181           H3*        A 181  -4.958  58.967 -32.499
  229    H2*    A 181           H2*        A 181  -6.410  57.218 -31.810
  230   2HO*    A 181          2HO*        A 181  -6.827  55.669 -33.310
  231    H1*    A 181           H1*        A 181  -4.354  55.323 -31.654
  232    H8     A 181           H8         A 181  -3.235  58.701 -30.471
  233   1H6     A 181          1H6         A 181  -5.325  57.038 -24.829
  234   2H6     A 181          2H6         A 181  -4.425  58.256 -25.706
  235    H2     A 181           H2         A 181  -6.610  53.949 -27.755
  236   1H5*    U 182          1H5*        U 182  -8.664  57.325 -33.044
  237   2H5*    U 182          2H5*        U 182  -9.315  56.599 -34.514
  238    H4*    U 182           H4*        U 182 -10.341  59.282 -34.163
  239    H3*    U 182           H3*        U 182 -10.582  57.441 -31.784
  240    H2*    U 182           H2*        U 182 -12.778  58.120 -31.485
  241   2HO*    U 182          2HO*        U 182 -13.152  60.268 -32.898
  242    H1*    U 182           H1*        U 182 -13.005  58.676 -34.390
  243    H3     U 182           H3         U 182 -14.314  54.040 -32.103
  244    H5     U 182           H5         U 182 -16.942  56.307 -34.448
  245    H6     U 182           H6         U 182 -15.150  57.966 -34.674
  246   1H5*    U 183          1H5*        U 183  -9.196  62.473 -29.772
  247   2H5*    U 183          2H5*        U 183  -9.381  61.757 -31.373
  248    H4*    U 183           H4*        U 183  -6.679  61.372 -30.621
  249    H3*    U 183           H3*        U 183  -7.715  64.015 -29.705
  250    H2*    U 183           H2*        U 183  -5.877  65.174 -30.663
  251   2HO*    U 183          2HO*        U 183  -4.160  63.791 -31.566
  252    H1*    U 183           H1*        U 183  -6.110  63.996 -33.148
  253    H3     U 183           H3         U 183  -7.824  68.221 -33.531
  254    H5     U 183           H5         U 183 -10.999  65.891 -32.105
  255    H6     U 183           H6         U 183  -9.391  64.067 -31.795
  256   1H5*    C 184          1H5*        C 184  -6.251  62.341 -24.560
  257   2H5*    C 184          2H5*        C 184  -6.669  63.993 -25.014
  258    H4*    C 184           H4*        C 184  -4.113  62.885 -23.970
  259    H3*    C 184           H3*        C 184  -5.785  65.341 -23.477
  260    H2*    C 184           H2*        C 184  -3.885  66.450 -22.618
  261   2HO*    C 184          2HO*        C 184  -1.936  64.988 -22.367
  262    H1*    C 184           H1*        C 184  -2.217  65.385 -24.704
  263   1H4     C 184          1H4         C 184  -3.114  71.590 -26.035
  264   2H4     C 184          2H4         C 184  -4.540  71.139 -26.942
  265    H5     C 184           H5         C 184  -5.424  68.950 -26.999
  266    H6     C 184           H6         C 184  -5.156  66.632 -26.192
  267   1H5*    G 185          1H5*        G 185  -7.950  61.936 -19.937
  268   2H5*    G 185          2H5*        G 185  -8.613  63.419 -19.251
  269    H4*    G 185           H4*        G 185  -6.086  62.584 -18.014
  270    H3*    G 185           H3*        G 185  -8.388  60.657 -18.073
  271    H2*    G 185           H2*        G 185  -7.974  60.089 -15.797
  272   2HO*    G 185          2HO*        G 185  -5.792  60.184 -15.606
  273    H1*    G 185           H1*        G 185  -7.892  62.752 -14.968
  274    H8     G 185           H8         G 185  -9.867  61.762 -13.574
  275    H1     G 185           H1         G 185 -13.621  61.686 -18.845
  276   1H2     G 185          1H2         G 185 -12.469  62.047 -20.516
  277   2H2     G 185          2H2         G 185 -10.743  62.328 -20.493
  278   1H5*    G 186          1H5*        G 186  -7.812  56.261 -17.014
  279   2H5*    G 186          2H5*        G 186  -8.929  56.790 -18.273
  280    H4*    G 186           H4*        G 186  -9.278  57.386 -15.327
  281    H3*    G 186           H3*        G 186 -10.233  55.055 -16.960
  282    H2*    G 186           H2*        G 186 -12.292  55.046 -15.762
  283   2HO*    G 186          2HO*        G 186 -12.409  56.626 -13.960
  284    H1*    G 186           H1*        G 186 -12.720  57.778 -16.134
  285    H8     G 186           H8         G 186 -11.461  57.218 -19.374
  286    H1     G 186           H1         G 186 -16.961  53.894 -18.617
  287   1H2     G 186          1H2         G 186 -17.419  53.767 -16.611
  288   2H2     G 186          2H2         G 186 -16.455  54.457 -15.324
  289   1H5*    G 187          1H5*        G 187  -8.700  51.223 -16.129
  290   2H5*    G 187          2H5*        G 187  -8.101  52.624 -17.018
  291    H4*    G 187           H4*        G 187 -10.141  50.582 -17.877
  292    H3*    G 187           H3*        G 187  -7.404  51.360 -18.789
  293    H2*    G 187           H2*        G 187  -7.972  50.948 -21.066
  294   2HO*    G 187          2HO*        G 187 -10.462  50.293 -21.140
  295    H1*    G 187           H1*        G 187 -10.284  52.505 -20.952
  296    H8     G 187           H8         G 187  -7.843  54.275 -18.849
  297    H1     G 187           H1         G 187  -6.700  55.091 -25.166
  298   1H2     G 187          1H2         G 187  -7.833  53.751 -26.249
  299   2H2     G 187          2H2         G 187  -8.930  52.582 -25.551
  300   1H5*    G 188          1H5*        G 188  -8.334  48.245 -21.397
  301   2H5*    G 188          2H5*        G 188  -7.286  46.925 -20.879
  302    H4*    G 188           H4*        G 188  -7.016  46.939 -23.175
  303    H3*    G 188           H3*        G 188  -4.766  48.468 -21.895
  304    H2*    G 188           H2*        G 188  -3.762  48.765 -24.035
  305   2HO*    G 188          2HO*        G 188  -4.336  47.310 -25.579
  306    H1*    G 188           H1*        G 188  -6.132  49.677 -25.203
  307    H8     G 188           H8         G 188  -6.124  51.104 -21.818
  308    H1     G 188           H1         G 188  -2.073  54.203 -25.801
  309   1H2     G 188          1H2         G 188  -1.823  53.099 -27.524
  310   2H2     G 188          2H2         G 188  -2.597  51.563 -27.844
  311   1H5*    A 189          1H5*        A 189  -2.365  45.646 -24.701
  312   2H5*    A 189          2H5*        A 189  -1.034  45.353 -23.581
  313    H4*    A 189           H4*        A 189  -0.433  46.384 -25.807
  314    H3*    A 189           H3*        A 189   0.411  47.594 -23.183
  315    H2*    A 189           H2*        A 189   1.713  49.194 -24.361
  316   2HO*    A 189          2HO*        A 189   0.975  48.249 -26.888
  317    H1*    A 189           H1*        A 189  -0.353  49.803 -26.163
  318    H8     A 189           H8         A 189  -1.707  49.306 -22.718
  319   1H6     A 189          1H6         A 189  -0.454  55.334 -21.694
  320   2H6     A 189          2H6         A 189  -1.249  53.920 -21.038
  321    H2     A 189           H2         A 189   1.372  54.175 -25.575
  322   1H5*    G 190          1H5*        G 190   4.130  46.747 -25.662
  323   2H5*    G 190          2H5*        G 190   5.341  46.233 -24.488
  324    H4*    G 190           H4*        G 190   6.154  48.041 -25.921
  325    H3*    G 190           H3*        G 190   5.919  48.534 -22.969
  326    H2*    G 190           H2*        G 190   6.903  50.687 -23.243
  327   2HO*    G 190          2HO*        G 190   7.556  51.158 -25.550
  328    H1*    G 190           H1*        G 190   5.176  51.402 -25.316
  329    H8     G 190           H8         G 190   3.133  49.432 -22.968
  330    H1     G 190           H1         G 190   4.187  55.464 -20.873
  331   1H2     G 190          1H2         G 190   5.655  56.346 -22.021
  332   2H2     G 190          2H2         G 190   6.478  55.567 -23.354
  333   1H5*    C 191          1H5*        C 191  10.508  49.216 -23.320
  334   2H5*    C 191          2H5*        C 191  10.955  48.534 -21.756
  335    H4*    C 191           H4*        C 191  11.542  50.961 -22.143
  336    H3*    C 191           H3*        C 191   9.994  50.037 -19.730
  337    H2*    C 191           H2*        C 191  10.119  52.234 -18.839
  338   2HO*    C 191          2HO*        C 191  11.560  53.130 -21.109
  339    H1*    C 191           H1*        C 191   9.357  53.440 -21.264
  340   1H4     C 191          1H4         C 191   3.953  53.017 -17.883
  341   2H4     C 191          2H4         C 191   3.763  51.364 -18.423
  342    H5     C 191           H5         C 191   5.375  50.206 -19.702
  343    H6     C 191           H6         C 191   7.587  50.349 -20.789
  344   1H5*    G 192          1H5*        G 192  13.930  52.036 -17.801
  345   2H5*    G 192          2H5*        G 192  14.022  50.918 -16.441
  346    H4*    G 192           H4*        G 192  13.960  53.342 -15.828
  347    H3*    G 192           H3*        G 192  11.967  51.383 -14.727
  348    H2*    G 192           H2*        G 192  11.057  53.092 -13.339
  349   2HO*    G 192          2HO*        G 192  12.527  54.593 -12.799
  350    H1*    G 192           H1*        G 192  10.806  54.906 -15.444
  351    H8     G 192           H8         G 192  10.005  51.625 -16.901
  352    H1     G 192           H1         G 192   5.150  53.993 -13.335
  353   1H2     G 192          1H2         G 192   5.825  55.602 -12.237
  354   2H2     G 192          2H2         G 192   7.461  56.218 -12.275
  355   1H5*    G 193          1H5*        G 193  13.863  53.412 -11.587
  356   2H5*    G 193          2H5*        G 193  14.243  52.435 -10.169
  357    H4*    G 193           H4*        G 193  12.906  54.376  -9.571
  358    H3*    G 193           H3*        G 193  11.705  51.656  -9.166
  359    H2*    G 193           H2*        G 193   9.774  52.638  -8.173
  360   2HO*    G 193          2HO*        G 193  10.439  55.271  -8.559
  361    H1*    G 193           H1*        G 193   9.412  54.453 -10.262
  362    H8     G 193           H8         G 193  10.574  51.353 -11.865
  363    H1     G 193           H1         G 193   4.353  51.039 -10.107
  364   1H2     G 193          1H2         G 193   3.908  52.625  -8.865
  365   2H2     G 193          2H2         G 193   5.050  53.855  -8.374
  366   1H5*    A 194          1H5*        A 194  11.706  53.112  -4.642
  367   2H5*    A 194          2H5*        A 194  12.148  51.545  -3.961
  368    H4*    A 194           H4*        A 194  10.013  52.546  -3.099
  369    H3*    A 194           H3*        A 194  10.124  49.779  -4.270
  370    H2*    A 194           H2*        A 194   7.838  49.448  -3.713
  371   2HO*    A 194          2HO*        A 194   7.023  51.662  -2.611
  372    H1*    A 194           H1*        A 194   7.025  51.900  -4.791
  373    H8     A 194           H8         A 194   9.698  50.349  -6.897
  374   1H6     A 194          1H6         A 194   5.138  47.273  -9.847
  375   2H6     A 194          2H6         A 194   6.847  47.650  -9.881
  376    H2     A 194           H2         A 194   3.385  49.283  -6.292
  377   1H5*    C 195          1H5*        C 195   8.530  48.964  -0.196
  378   2H5*    C 195          2H5*        C 195   9.404  47.527   0.329
  379    H4*    C 195           H4*        C 195   7.005  47.169   0.417
  380    H3*    C 195           H3*        C 195   8.584  45.532  -1.544
  381    H2*    C 195           H2*        C 195   6.626  44.333  -2.146
  382   2HO*    C 195          2HO*        C 195   4.906  45.746  -0.484
  383    H1*    C 195           H1*        C 195   5.081  46.689  -2.382
  384   1H4     C 195          1H4         C 195   6.760  45.287  -8.378
  385   2H4     C 195          2H4         C 195   8.340  45.980  -8.089
  386    H5     C 195           H5         C 195   9.068  46.767  -5.984
  387    H6     C 195           H6         C 195   8.453  47.085  -3.615
  388   1H5*    G 196          1H5*        G 196   6.881  41.779   1.330
  389   2H5*    G 196          2H5*        G 196   8.445  41.000   1.095
  390    H4*    G 196           H4*        G 196   6.462  39.614   0.467
  391    H3*    G 196           H3*        G 196   8.674  40.173  -1.490
  392    H2*    G 196           H2*        G 196   7.641  38.712  -3.063
  393   2HO*    G 196          2HO*        G 196   6.950  37.231  -1.447
  394    H1*    G 196           H1*        G 196   5.136  39.915  -2.790
  395    H8     G 196           H8         G 196   7.808  42.513  -2.583
  396    H1     G 196           H1         G 196   6.269  40.877  -8.652
  397   1H2     G 196          1H2         G 196   5.056  39.209  -8.630
  398   2H2     G 196          2H2         G 196   4.534  38.377  -7.182
  399   1H5*    A 197          1H5*        A 197  12.274  36.956   1.267
  400   2H5*    A 197          2H5*        A 197  12.502  37.792  -0.269
  401    H4*    A 197           H4*        A 197  12.152  34.861   0.266
  402    H3*    A 197           H3*        A 197  14.252  36.582  -0.938
  403    H2*    A 197           H2*        A 197  14.751  35.024  -2.655
  404   2HO*    A 197          2HO*        A 197  12.734  33.247  -1.805
  405    H1*    A 197           H1*        A 197  12.131  34.686  -3.462
  406    H8     A 197           H8         A 197  14.814  36.079  -4.463
  407   1H6     A 197          1H6         A 197  12.355  41.628  -5.913
  408   2H6     A 197          2H6         A 197  13.729  40.575  -6.171
  409    H2     A 197           H2         A 197   9.551  39.538  -3.174
  410   1H5*    U 198          1H5*        U 198  13.639  35.058   3.178
  411   2H5*    U 198          2H5*        U 198  14.772  34.416   4.367
  412    H4*    U 198           H4*        U 198  14.263  32.675   2.031
  413    H3*    U 198           H3*        U 198  12.045  33.395   3.952
  414    H2*    U 198           H2*        U 198  11.398  31.187   4.011
  415   2HO*    U 198          2HO*        U 198  11.990  29.940   1.971
  416    H1*    U 198           H1*        U 198  14.132  30.373   3.099
  417    H3     U 198           H3         U 198  13.592  26.882   5.874
  418    H5     U 198           H5         U 198  12.924  30.175   8.374
  419    H6     U 198           H6         U 198  13.114  31.597   6.386
  420   1H5*    G 199          1H5*        G 199   8.483  31.460   2.610
  421   2H5*    G 199          2H5*        G 199   8.425  30.575   1.084
  422    H4*    G 199           H4*        G 199   7.742  33.298   0.557
  423    H3*    G 199           H3*        G 199   6.442  32.189   3.030
  424    H2*    G 199           H2*        G 199   4.375  33.179   2.380
  425   2HO*    G 199          2HO*        G 199   5.651  34.147   0.017
  426    H1*    G 199           H1*        G 199   4.500  32.146  -0.213
  427    H8     G 199           H8         G 199   5.813  29.894   2.540
  428    H1     G 199           H1         G 199  -0.484  29.173   1.238
  429   1H2     G 199          1H2         G 199  -1.085  30.631  -0.092
  430   2H2     G 199          2H2         G 199  -0.037  31.865  -0.755
  431   1H5*    A 200          1H5*        A 200   7.403  36.276   6.134
  432   2H5*    A 200          2H5*        A 200   9.121  36.411   5.759
  433    H4*    A 200           H4*        A 200   8.489  35.596   8.083
  434    H3*    A 200           H3*        A 200  10.471  34.200   6.305
  435    H2*    A 200           H2*        A 200  10.950  32.660   8.050
  436   2HO*    A 200          2HO*        A 200   9.064  33.825   9.785
  437    H1*    A 200           H1*        A 200   8.261  32.135   8.589
  438    H8     A 200           H8         A 200   8.521  32.527   4.928
  439   1H6     A 200          1H6         A 200  10.438  26.594   4.659
  440   2H6     A 200          2H6         A 200   9.899  27.955   3.700
  441    H2     A 200           H2         A 200  10.439  27.864   8.917
  442   1H5*    C 201          1H5*        C 201  14.031  35.896  10.918
  443   2H5*    C 201          2H5*        C 201  14.261  34.544   9.809
  444    H4*    C 201           H4*        C 201  11.576  35.161  11.035
  445    H3*    C 201           H3*        C 201  13.847  33.585  12.252
  446    H2*    C 201           H2*        C 201  12.247  32.181  13.280
  447   2HO*    C 201          2HO*        C 201  10.577  33.412  13.922
  448    H1*    C 201           H1*        C 201  10.641  32.152  10.889
  449   1H4     C 201          1H4         C 201  13.240  26.337  10.984
  450   2H4     C 201          2H4         C 201  14.817  27.022  10.664
  451    H5     C 201           H5         C 201  15.241  29.342  10.533
  452    H6     C 201           H6         C 201  14.245  31.597  10.678
  453   1H5*    C 202          1H5*        C 202  11.621  35.104  16.008
  454   2H5*    C 202          2H5*        C 202  12.877  35.049  17.245
  455    H4*    C 202           H4*        C 202  10.914  33.603  17.717
  456    H3*    C 202           H3*        C 202  13.661  32.374  17.505
  457    H2*    C 202           H2*        C 202  12.751  30.319  18.274
  458   2HO*    C 202          2HO*        C 202  10.328  30.547  18.823
  459    H1*    C 202           H1*        C 202  10.523  30.524  16.522
  460   1H4     C 202          1H4         C 202  14.551  26.429  13.711
  461   2H4     C 202          2H4         C 202  15.401  27.788  13.011
  462    H5     C 202           H5         C 202  14.922  30.044  13.521
  463    H6     C 202           H6         C 202  13.494  31.565  14.841
  464   1H5*    C 203          1H5*        C 203  12.785  31.856  22.051
  465   2H5*    C 203          2H5*        C 203  14.418  31.738  22.707
  466    H4*    C 203           H4*        C 203  12.968  29.737  23.090
  467    H3*    C 203           H3*        C 203  15.632  29.493  21.711
  468    H2*    C 203           H2*        C 203  15.402  27.125  21.735
  469   2HO*    C 203          2HO*        C 203  13.935  26.261  23.177
  470    H1*    C 203           H1*        C 203  12.781  27.220  20.728
  471   1H4     C 203          1H4         C 203  16.525  26.268  15.629
  472   2H4     C 203          2H4         C 203  16.721  28.001  15.486
  473    H5     C 203           H5         C 203  15.891  29.555  17.060
  474    H6     C 203           H6         C 203  14.658  29.830  19.180
  475   1H5*    U 204          1H5*        U 204  15.279  27.038  24.854
  476   2H5*    U 204          2H5*        U 204  16.606  26.796  25.991
  477    H4*    U 204           H4*        U 204  15.879  24.665  25.173
  478    H3*    U 204           H3*        U 204  18.584  25.559  24.218
  479    H2*    U 204           H2*        U 204  18.893  23.463  23.132
  480   2HO*    U 204          2HO*        U 204  16.629  22.174  23.524
  481    H1*    U 204           H1*        U 204  16.415  23.554  21.856
  482    H3     U 204           H3         U 204  19.804  24.276  18.803
  483    H5     U 204           H5         U 204  18.728  28.055  20.253
  484    H6     U 204           H6         U 204  17.379  26.911  21.950
  485   1H5*    A 205          1H5*        A 205  20.112  23.066  28.048
  486   2H5*    A 205          2H5*        A 205  21.780  23.640  28.068
  487    H4*    A 205           H4*        A 205  21.272  21.260  27.207
  488    H3*    A 205           H3*        A 205  23.125  23.235  25.894
  489    H2*    A 205           H2*        A 205  23.728  21.589  24.292
  490   2HO*    A 205          2HO*        A 205  23.363  19.462  24.840
  491    H1*    A 205           H1*        A 205  21.086  20.861  23.752
  492    H8     A 205           H8         A 205  20.987  24.501  24.221
  493   1H6     A 205          1H6         A 205  23.030  25.115  18.356
  494   2H6     A 205          2H6         A 205  22.354  25.979  19.720
  495    H2     A 205           H2         A 205  23.447  20.852  19.534
  496   1H5*    G 206          1H5*        G 206  25.212  24.361  25.767
  497   2H5*    G 206          2H5*        G 206  24.864  23.733  24.156
  498    H4*    G 206           H4*        G 206  26.974  25.087  24.385
  499    H3*    G 206           H3*        G 206  26.940  22.328  23.195
  500    H2*    G 206           H2*        G 206  29.256  22.527  22.669
  501   2HO*    G 206          2HO*        G 206  29.879  24.581  22.337
  502    H1*    G 206           H1*        G 206  29.953  23.352  25.238
  503    H8     G 206           H8         G 206  28.013  20.656  23.418
  504    H1     G 206           H1         G 206  31.658  18.509  28.316
  505   1H2     G 206          1H2         G 206  32.435  20.114  29.350
  506   2H2     G 206          2H2         G 206  32.144  21.792  28.951
  507   1H5*    U 207          1H5*        U 207  25.575  24.162  18.558
  508   2H5*    U 207          2H5*        U 207  27.078  24.491  17.697
  509    H4*    U 207           H4*        U 207  25.081  26.187  17.636
  510    H3*    U 207           H3*        U 207  28.016  26.821  17.787
  511    H2*    U 207           H2*        U 207  27.521  29.140  17.698
  512   2HO*    U 207          2HO*        U 207  25.633  29.674  16.719
  513    H1*    U 207           H1*        U 207  25.547  29.019  19.658
  514    H3     U 207           H3         U 207  28.778  30.921  22.130
  515    H5     U 207           H5         U 207  30.323  27.107  21.353
  516    H6     U 207           H6         U 207  28.374  26.717  19.918
  517   1H5*    A 208          1H5*        A 208  28.288  28.895  12.807
  518   2H5*    A 208          2H5*        A 208  26.909  28.323  11.869
  519    H4*    A 208           H4*        A 208  29.191  27.688  11.005
  520    H3*    A 208           H3*        A 208  27.075  25.600  11.536
  521    H2*    A 208           H2*        A 208  28.470  23.999  10.494
  522   2HO*    A 208          2HO*        A 208  30.541  25.119   9.568
  523    H1*    A 208           H1*        A 208  30.799  25.012  11.806
  524    H8     A 208           H8         A 208  27.998  24.579  14.200
  525   1H6     A 208          1H6         A 208  29.774  18.624  14.789
  526   2H6     A 208          2H6         A 208  28.734  19.865  15.450
  527    H2     A 208           H2         A 208  32.004  20.411  11.386
  528   1H5*    G 209          1H5*        G 209  27.589  23.241   8.437
  529   2H5*    G 209          2H5*        G 209  25.882  22.967   8.091
  530    H4*    G 209           H4*        G 209  27.097  21.090   9.251
  531    H3*    G 209           H3*        G 209  24.544  22.266  10.314
  532    H2*    G 209           H2*        G 209  24.504  20.613  12.028
  533   2HO*    G 209          2HO*        G 209  26.959  19.606  10.956
  534    H1*    G 209           H1*        G 209  27.149  21.084  12.783
  535    H8     G 209           H8         G 209  25.569  24.322  11.840
  536    H1     G 209           H1         G 209  24.134  22.429  17.861
  537   1H2     G 209          1H2         G 209  24.755  20.482  18.137
  538   2H2     G 209          2H2         G 209  25.546  19.508  16.919
  539   1H5*    A 210          1H5*        A 210  24.178  18.105  10.971
  540   2H5*    A 210          2H5*        A 210  22.604  17.668  10.306
  541    H4*    A 210           H4*        A 210  22.780  16.979  12.623
  542    H3*    A 210           H3*        A 210  20.792  19.168  12.032
  543    H2*    A 210           H2*        A 210  20.005  19.002  14.263
  544   2HO*    A 210          2HO*        A 210  20.607  17.136  15.451
  545    H1*    A 210           H1*        A 210  22.627  18.933  15.332
  546    H8     A 210           H8         A 210  22.318  21.483  12.627
  547   1H6     A 210          1H6         A 210  20.358  25.461  17.018
  548   2H6     A 210          2H6         A 210  20.866  25.330  15.349
  549    H2     A 210           H2         A 210  20.535  21.395  18.804
  550   1H5*    G 211          1H5*        G 211  18.797  15.740  13.934
  551   2H5*    G 211          2H5*        G 211  17.197  15.539  13.219
  552    H4*    G 211           H4*        G 211  17.084  15.648  15.650
  553    H3*    G 211           H3*        G 211  15.765  17.845  14.080
  554    H2*    G 211           H2*        G 211  14.889  18.754  16.101
  555   2HO*    G 211          2HO*        G 211  14.948  17.440  17.942
  556    H1*    G 211           H1*        G 211  17.364  18.705  17.394
  557    H8     G 211           H8         G 211  18.127  19.623  13.919
  558    H1     G 211           H1         G 211  15.610  24.555  17.270
  559   1H2     G 211          1H2         G 211  14.832  23.855  19.045
  560   2H2     G 211          2H2         G 211  14.857  22.181  19.552
  561   1H5*    G 212          1H5*        G 212  12.184  16.213  16.487
  562   2H5*    G 212          2H5*        G 212  11.067  15.965  15.145
  563    H4*    G 212           H4*        G 212   9.983  17.249  16.864
  564    H3*    G 212           H3*        G 212  10.588  18.717  14.313
  565    H2*    G 212           H2*        G 212   9.434  20.629  15.142
  566   2HO*    G 212          2HO*        G 212   8.915  19.541  17.651
  567    H1*    G 212           H1*        G 212  10.808  20.612  17.574
  568    H8     G 212           H8         G 212  13.052  19.603  14.749
  569    H1     G 212           H1         G 212  12.507  26.009  15.486
  570   1H2     G 212          1H2         G 212  11.008  26.421  16.840
  571   2H2     G 212          2H2         G 212  10.041  25.212  17.653
  572   1H5*    G 213          1H5*        G 213   5.974  18.852  14.517
  573   2H5*    G 213          2H5*        G 213   5.517  18.874  12.814
  574    H4*    G 213           H4*        G 213   4.694  20.817  14.138
  575    H3*    G 213           H3*        G 213   6.388  21.207  11.688
  576    H2*    G 213           H2*        G 213   6.110  23.567  11.871
  577   2HO*    G 213          2HO*        G 213   4.338  24.234  12.979
  578    H1*    G 213           H1*        G 213   6.823  23.612  14.570
  579    H8     G 213           H8         G 213   9.009  21.080  13.049
  580    H1     G 213           H1         G 213  10.901  27.112  11.669
  581   1H2     G 213          1H2         G 213   9.412  28.439  12.193
  582   2H2     G 213          2H2         G 213   7.878  27.983  12.902
  583   1H5*    G 214          1H5*        G 214   5.029  24.502  10.198
  584   2H5*    G 214          2H5*        G 214   4.662  23.927   8.571
  585    H4*    G 214           H4*        G 214   6.662  25.420   8.755
  586    H3*    G 214           H3*        G 214   6.853  22.679   7.528
  587    H2*    G 214           H2*        G 214   9.111  23.125   6.918
  588   2HO*    G 214          2HO*        G 214   9.170  25.248   6.408
  589    H1*    G 214           H1*        G 214   9.786  24.050   9.476
  590    H8     G 214           H8         G 214   7.540  21.209  10.057
  591    H1     G 214           H1         G 214  13.472  19.317   8.294
  592   1H2     G 214          1H2         G 214  14.530  20.938   7.582
  593   2H2     G 214          2H2         G 214  13.902  22.567   7.479
  594   1H5*    G 215          1H5*        G 215   8.108  25.177   3.189
  595   2H5*    G 215          2H5*        G 215   6.603  24.417   2.673
  596    H4*    G 215           H4*        G 215   8.556  23.969   1.193
  597    H3*    G 215           H3*        G 215   7.009  21.717   2.445
  598    H2*    G 215           H2*        G 215   8.308  20.146   1.212
  599   2HO*    G 215          2HO*        G 215   8.716  21.104  -0.708
  600    H1*    G 215           H1*        G 215  10.736  21.303   1.963
  601    H8     G 215           H8         G 215   8.422  21.507   4.860
  602    H1     G 215           H1         G 215  11.157  15.678   4.200
  603   1H2     G 215          1H2         G 215  12.110  15.567   2.375
  604   2H2     G 215          2H2         G 215  12.161  16.861   1.198
  605   1H5*    C 216          1H5*        C 216   4.829  21.860  -1.724
  606   2H5*    C 216          2H5*        C 216   3.469  20.771  -1.454
  607    H4*    C 216           H4*        C 216   5.561  19.880  -2.663
  608    H3*    C 216           H3*        C 216   4.116  18.447  -0.442
  609    H2*    C 216           H2*        C 216   5.535  16.574  -0.760
  610   2HO*    C 216          2HO*        C 216   6.880  17.927  -2.865
  611    H1*    C 216           H1*        C 216   7.872  18.128  -0.847
  612   1H4     C 216          1H4         C 216   7.399  16.103   5.203
  613   2H4     C 216          2H4         C 216   6.413  17.503   5.562
  614    H5     C 216           H5         C 216   5.659  19.036   3.932
  615    H6     C 216           H6         C 216   5.668  19.611   1.530
  616   1H5*    U 217          1H5*        U 217   4.434  16.059  -3.420
  617   2H5*    U 217          2H5*        U 217   3.065  15.216  -4.144
  618    H4*    U 217           H4*        U 217   4.566  13.514  -3.663
  619    H3*    U 217           H3*        U 217   2.501  13.693  -1.480
  620    H2*    U 217           H2*        U 217   3.451  11.793  -0.433
  621   2HO*    U 217          2HO*        U 217   5.076  10.621  -1.698
  622    H1*    U 217           H1*        U 217   6.081  12.709  -0.655
  623    H3     U 217           H3         U 217   5.489  13.328   3.760
  624    H5     U 217           H5         U 217   2.907  16.152   2.056
  625    H6     U 217           H6         U 217   3.473  15.202  -0.132
  626   1H5*    G 218          1H5*        G 218  -1.016  10.232  -2.541
  627   2H5*    G 218          2H5*        G 218  -0.626  10.091  -0.827
  628    H4*    G 218           H4*        G 218  -0.807   7.888  -1.533
  629    H3*    G 218           H3*        G 218   2.042   8.749  -1.342
  630    H2*    G 218           H2*        G 218   2.826   6.658  -2.155
  631   2HO*    G 218          2HO*        G 218   1.035   5.045  -2.559
  632    H1*    G 218           H1*        G 218   1.018   6.663  -4.323
  633    H8     G 218           H8         G 218   2.309  10.088  -4.071
  634    H1     G 218           H1         G 218   6.603   6.047  -6.737
  635   1H2     G 218          1H2         G 218   5.984   4.100  -6.455
  636   2H2     G 218          2H2         G 218   4.519   3.632  -5.620
  637   1H5*    C 219          1H5*        C 219   3.952   6.246   2.646
  638   2H5*    C 219          2H5*        C 219   2.631   6.012   3.791
  639    H4*    C 219           H4*        C 219   4.461   7.541   4.558
  640    H3*    C 219           H3*        C 219   1.592   8.458   4.481
  641    H2*    C 219           H2*        C 219   2.217  10.494   5.477
  642   2HO*    C 219          2HO*        C 219   4.878  10.017   5.875
  643    H1*    C 219           H1*        C 219   4.555  10.817   3.940
  644   1H4     C 219          1H4         C 219  -0.199  14.266   1.279
  645   2H4     C 219          2H4         C 219  -0.214  13.061   0.009
  646    H5     C 219           H5         C 219   1.023  11.050   0.088
  647    H6     C 219           H6         C 219   2.594   9.687   1.418
  648   1H5*    G 220          1H5*        G 220   4.025   3.641   6.037
  649   2H5*    G 220          2H5*        G 220   5.154   4.649   6.942
  650    H4*    G 220           H4*        G 220   6.075   3.205   5.041
  651    H3*    G 220           H3*        G 220   6.710   6.150   5.313
  652    H2*    G 220           H2*        G 220   8.132   5.976   3.503
  653   2HO*    G 220          2HO*        G 220   9.475   4.262   3.644
  654    H1*    G 220           H1*        G 220   6.609   3.611   2.523
  655    H8     G 220           H8         G 220   6.218   4.076   0.088
  656    H1     G 220           H1         G 220   6.485  10.488   0.918
  657   1H2     G 220          1H2         G 220   6.705  10.915   2.923
  658   2H2     G 220          2H2         G 220   6.804   9.713   4.191
  659   1H5*    G 221          1H5*        G 221  10.089   4.990   5.950
  660   2H5*    G 221          2H5*        G 221  11.211   6.092   6.747
  661    H4*    G 221           H4*        G 221  10.483   6.206   4.122
  662    H3*    G 221           H3*        G 221  11.577   8.345   5.954
  663    H2*    G 221           H2*        G 221  11.605   9.824   4.104
  664   2HO*    G 221          2HO*        G 221  12.247   8.606   2.408
  665    H1*    G 221           H1*        G 221   9.027   8.987   3.238
  666    H8     G 221           H8         G 221   9.023   9.535   6.903
  667    H1     G 221           H1         G 221   8.454  15.028   3.529
  668   1H2     G 221          1H2         G 221   8.852  14.658   1.540
  669   2H2     G 221          2H2         G 221   9.276  13.094   0.884
  670   1H5*    C 222          1H5*        C 222  15.376   7.528   3.679
  671   2H5*    C 222          2H5*        C 222  16.593   8.498   4.508
  672    H4*    C 222           H4*        C 222  15.307   9.444   2.437
  673    H3*    C 222           H3*        C 222  15.961  10.989   4.954
  674    H2*    C 222           H2*        C 222  15.183  12.936   3.883
  675   2HO*    C 222          2HO*        C 222  14.996  11.331   1.506
  676    H1*    C 222           H1*        C 222  13.016  11.493   2.637
  677   1H4     C 222          1H4         C 222  10.347  15.194   7.127
  678   2H4     C 222          2H4         C 222  10.675  13.941   8.302
  679    H5     C 222           H5         C 222  11.922  11.991   7.834
  680    H6     C 222           H6         C 222  13.174  10.751   6.105
  681   1H5*    U 223          1H5*        U 223  16.571  13.960   2.414
  682   2H5*    U 223          2H5*        U 223  18.265  14.397   2.636
  683    H4*    U 223           H4*        U 223  16.954  16.343   3.025
  684    H3*    U 223           H3*        U 223  18.136  15.140   5.513
  685    H2*    U 223           H2*        U 223  17.190  16.820   6.828
  686   2HO*    U 223          2HO*        U 223  17.863  18.538   5.550
  687    H1*    U 223           H1*        U 223  14.851  16.960   5.066
  688    H3     U 223           H3         U 223  13.027  16.739   9.235
  689    H5     U 223           H5         U 223  14.529  12.891   8.545
  690    H6     U 223           H6         U 223  15.579  13.774   6.512
  691   1H5*    U 224          1H5*        U 224  20.004  17.717   1.444
  692   2H5*    U 224          2H5*        U 224  18.537  17.355   2.355
  693    H4*    U 224           H4*        U 224  19.273  15.626   0.020
  694    H3*    U 224           H3*        U 224  18.486  18.475  -0.198
  695    H2*    U 224           H2*        U 224  16.727  18.057  -1.721
  696   2HO*    U 224          2HO*        U 224  17.424  15.283  -1.630
  697    H1*    U 224           H1*        U 224  15.558  16.025  -0.278
  698    H3     U 224           H3         U 224  12.692  19.166   1.106
  699    H5     U 224           H5         U 224  16.355  20.600   2.540
  700    H6     U 224           H6         U 224  17.426  18.698   1.424
  701   1H5*    A 225          1H5*        A 225  20.361  18.099  -4.497
  702   2H5*    A 225          2H5*        A 225  20.071  19.745  -5.063
  703    H4*    A 225           H4*        A 225  18.474  17.735  -5.699
  704    H3*    A 225           H3*        A 225  17.725  20.603  -5.161
  705    H2*    A 225           H2*        A 225  15.477  20.093  -5.721
  706   2HO*    A 225          2HO*        A 225  15.146  17.861  -6.583
  707    H1*    A 225           H1*        A 225  15.412  17.773  -4.149
  708    H8     A 225           H8         A 225  17.346  20.551  -2.524
  709   1H6     A 225          1H6         A 225  11.921  22.412  -0.061
  710   2H6     A 225          2H6         A 225  13.651  22.669  -0.036
  711    H2     A 225           H2         A 225  11.078  19.203  -3.016
  712   1H5*    G 226          1H5*        G 226  16.703  19.104  -8.995
  713   2H5*    G 226          2H5*        G 226  16.360  20.200 -10.334
  714    H4*    G 226           H4*        G 226  14.447  18.771  -9.775
  715    H3*    G 226           H3*        G 226  14.177  21.750  -9.516
  716    H2*    G 226           H2*        G 226  11.874  21.504  -8.956
  717   2HO*    G 226          2HO*        G 226  11.005  19.313  -9.130
  718    H1*    G 226           H1*        G 226  12.395  19.558  -7.009
  719    H8     G 226           H8         G 226  15.135  21.974  -6.683
  720    H1     G 226           H1         G 226   9.604  24.197  -4.163
  721   1H2     G 226          1H2         G 226   8.041  22.989  -4.757
  722   2H2     G 226          2H2         G 226   8.206  21.584  -5.785
  723   1H5*    G 227          1H5*        G 227  11.650  21.037 -13.499
  724   2H5*    G 227          2H5*        G 227  13.029  20.025 -13.928
  725    H4*    G 227           H4*        G 227  11.735  20.947 -15.861
  726    H3*    G 227           H3*        G 227  14.695  21.389 -15.585
  727    H2*    G 227           H2*        G 227  14.730  22.443 -17.722
  728   2HO*    G 227          2HO*        G 227  12.792  22.293 -18.990
  729    H1*    G 227           H1*        G 227  12.595  24.136 -17.111
  730    H8     G 227           H8         G 227  14.722  23.671 -14.082
  731    H1     G 227           H1         G 227  17.017  28.123 -18.181
  732   1H2     G 227          1H2         G 227  15.967  28.034 -19.953
  733   2H2     G 227          2H2         G 227  14.659  26.921 -20.280
  734   1H5*    A 228          1H5*        A 228  13.921  19.724 -19.341
  735   2H5*    A 228          2H5*        A 228  14.986  18.386 -19.769
  736    H4*    A 228           H4*        A 228  15.038  19.937 -21.562
  737    H3*    A 228           H3*        A 228  17.530  19.876 -19.899
  738    H2*    A 228           H2*        A 228  18.553  21.499 -21.300
  739   2HO*    A 228          2HO*        A 228  17.747  21.678 -23.346
  740    H1*    A 228           H1*        A 228  16.327  23.205 -21.247
  741    H8     A 228           H8         A 228  16.715  21.770 -17.859
  742   1H6     A 228          1H6         A 228  20.970  26.196 -16.739
  743   2H6     A 228          2H6         A 228  19.999  24.944 -15.998
  744    H2     A 228           H2         A 228  20.043  26.227 -21.084
  745   1H5*    G 229          1H5*        G 229  18.761  19.262 -24.098
  746   2H5*    G 229          2H5*        G 229  19.959  17.968 -24.119
  747    H4*    G 229           H4*        G 229  20.802  19.911 -25.281
  748    H3*    G 229           H3*        G 229  22.175  19.164 -22.716
  749    H2*    G 229           H2*        G 229  23.787  20.881 -23.076
  750   2HO*    G 229          2HO*        G 229  24.018  21.594 -25.153
  751    H1*    G 229           H1*        G 229  21.852  22.831 -23.566
  752    H8     G 229           H8         G 229  20.449  20.690 -20.918
  753    H1     G 229           H1         G 229  24.939  24.778 -18.678
  754   1H2     G 229          1H2         G 229  25.946  25.631 -20.264
  755   2H2     G 229          2H2         G 229  25.623  25.288 -21.948
  756   1H5*    G 230          1H5*        G 230  25.440  19.372 -25.910
  757   2H5*    G 230          2H5*        G 230  26.420  17.956 -25.531
  758    H4*    G 230           H4*        G 230  27.770  19.986 -25.698
  759    H3*    G 230           H3*        G 230  27.643  18.558 -23.059
  760    H2*    G 230           H2*        G 230  29.247  20.074 -22.158
  761   2HO*    G 230          2HO*        G 230  29.444  21.711 -24.368
  762    H1*    G 230           H1*        G 230  27.862  22.330 -23.037
  763    H8     G 230           H8         G 230  25.296  19.882 -22.015
  764    H1     G 230           H1         G 230  28.042  22.870 -16.973
  765   1H2     G 230          1H2         G 230  29.711  23.900 -17.608
  766   2H2     G 230          2H2         G 230  30.282  23.948 -19.261
  767   1H5*    G 231          1H5*        G 231  31.821  19.150 -24.021
  768   2H5*    G 231          2H5*        G 231  32.616  17.579 -23.913
  769    H4*    G 231           H4*        G 231  33.949  19.113 -22.704
  770    H3*    G 231           H3*        G 231  32.391  17.228 -20.970
  771    H2*    G 231           H2*        G 231  33.387  18.159 -19.017
  772   2HO*    G 231          2HO*        G 231  35.084  19.777 -19.414
  773    H1*    G 231           H1*        G 231  32.799  20.783 -19.758
  774    H8     G 231           H8         G 231  29.966  18.640 -20.832
  775    H1     G 231           H1         G 231  29.783  20.116 -14.533
  776   1H2     G 231          1H2         G 231  31.573  20.975 -13.975
  777   2H2     G 231          2H2         G 231  32.922  21.254 -15.052
  778   1H5*    C 232          1H5*        C 232  36.429  16.996 -19.724
  779   2H5*    C 232          2H5*        C 232  36.925  15.353 -19.318
  780    H4*    C 232           H4*        C 232  37.268  16.820 -17.432
  781    H3*    C 232           H3*        C 232  35.146  14.714 -17.130
  782    H2*    C 232           H2*        C 232  34.821  15.358 -14.867
  783   2HO*    C 232          2HO*        C 232  36.380  17.073 -14.109
  784    H1*    C 232           H1*        C 232  34.718  18.104 -15.508
  785   1H4     C 232          1H4         C 232  28.607  16.290 -15.100
  786   2H4     C 232          2H4         C 232  28.691  15.693 -16.743
  787    H5     C 232           H5         C 232  30.676  15.632 -18.021
  788    H6     C 232           H6         C 232  33.093  16.132 -18.037
  789   1H5*    A 233          1H5*        A 233  38.175  13.793 -13.767
  790   2H5*    A 233          2H5*        A 233  38.085  12.035 -13.651
  791    H4*    A 233           H4*        A 233  37.632  13.190 -11.515
  792    H3*    A 233           H3*        A 233  35.552  11.397 -12.731
  793    H2*    A 233           H2*        A 233  34.163  11.700 -10.822
  794   2HO*    A 233          2HO*        A 233  35.985  13.495  -9.636
  795    H1*    A 233           H1*        A 233  34.420  14.484 -10.861
  796    H8     A 233           H8         A 233  34.239  13.459 -14.391
  797   1H6     A 233          1H6         A 233  28.036  13.150 -13.766
  798   2H6     A 233          2H6         A 233  29.347  13.133 -14.925
  799    H2     A 233           H2         A 233  29.821  13.577  -9.720
  800   1H5*    G 234          1H5*        G 234  35.993  10.237  -8.606
  801   2H5*    G 234          2H5*        G 234  36.365   8.513  -8.596
  802    H4*    G 234           H4*        G 234  34.650   8.860  -7.004
  803    H3*    G 234           H3*        G 234  33.698   7.547  -9.531
  804    H2*    G 234           H2*        G 234  31.518   7.314  -8.597
  805   2HO*    G 234          2HO*        G 234  31.302   7.653  -6.360
  806    H1*    G 234           H1*        G 234  31.380   9.989  -7.815
  807    H8     G 234           H8         G 234  33.177   9.864 -11.056
  808    H1     G 234           H1         G 234  26.755   9.415 -11.709
  809   1H2     G 234          1H2         G 234  25.894   9.111  -9.860
  810   2H2     G 234          2H2         G 234  26.781   8.995  -8.356
  811   1H    GLY  15          1H        GLY  15   0.409   0.639  -2.341
  812   1HA   GLY  15          1HA       GLY  15   1.196  -1.135  -0.355
  813   2HA   GLY  15          2HA       GLY  15   1.936  -1.701  -1.845
  814    H    ARG  16           H        ARG  16   3.728  -1.121  -0.082
  815    HA   ARG  16           HA       ARG  16   4.511   1.486   0.399
  816   1HB   ARG  16          2HB       ARG  16   6.125  -1.030   0.021
  817   2HB   ARG  16          3HB       ARG  16   6.871   0.502   0.455
  818   1HG   ARG  16          2HG       ARG  16   4.767   0.193   2.253
  819   2HG   ARG  16          3HG       ARG  16   5.497  -1.407   2.114
  820   1HD   ARG  16          2HD       ARG  16   7.066   1.115   2.621
  821   2HD   ARG  16          3HD       ARG  16   6.475   0.056   3.901
  822    HE   ARG  16           HE       ARG  16   7.910  -1.524   2.124
  823   1HH1  ARG  16          2HH1      ARG  16   8.493   1.140   4.288
  824   2HH1  ARG  16          1HH1      ARG  16  10.138   0.694   4.603
  825   1HH2  ARG  16          2HH2      ARG  16  10.073  -2.122   2.531
  826   2HH2  ARG  16          1HH2      ARG  16  11.036  -1.161   3.602
  827    H    ALA  17           H        ALA  17   6.102  -0.557  -2.049
  828    HA   ALA  17           HA       ALA  17   6.954  -0.087  -4.108
  829   1HB   ALA  17          1HB       ALA  17   4.567   0.786  -4.391
  830   2HB   ALA  17          2HB       ALA  17   5.266   2.393  -4.195
  831   3HB   ALA  17          3HB       ALA  17   5.788   1.361  -5.527
  832    H    ARG  18           H        ARG  18   7.816   1.344  -1.486
  833    HA   ARG  18           HA       ARG  18   8.880   3.837  -1.999
  834   1HB   ARG  18          2HB       ARG  18   9.111   1.894   0.025
  835   2HB   ARG  18          3HB       ARG  18  10.755   2.284  -0.461
  836   1HG   ARG  18          2HG       ARG  18   8.867   4.523   0.039
  837   2HG   ARG  18          3HG       ARG  18   9.515   3.637   1.421
  838   1HD   ARG  18          2HD       ARG  18  11.707   4.252   0.945
  839   2HD   ARG  18          3HD       ARG  18  11.331   4.647  -0.732
  840    HE   ARG  18           HE       ARG  18  11.196   6.400   1.497
  841   1HH1  ARG  18          2HH1      ARG  18   9.648   5.641  -1.528
  842   2HH1  ARG  18          1HH1      ARG  18   9.047   7.247  -1.773
  843   1HH2  ARG  18          2HH2      ARG  18  10.409   8.518   1.186
  844   2HH2  ARG  18          1HH2      ARG  18   9.481   8.884  -0.229
  845    H    GLY  19           H        GLY  19  10.456   4.607  -3.258
  846   1HA   GLY  19          1HA       GLY  19  12.690   4.474  -4.151
  847   2HA   GLY  19          2HA       GLY  19  12.491   2.731  -4.265
  848    H    LEU  20           H        LEU  20   9.756   3.055  -5.387
  849    HA   LEU  20           HA       LEU  20  10.594   3.647  -8.137
  850   1HB   LEU  20          2HB       LEU  20   8.734   1.735  -6.894
  851   2HB   LEU  20          3HB       LEU  20   8.167   2.470  -8.393
  852    HG   LEU  20           HG       LEU  20  10.897   1.446  -8.567
  853   1HD1  LEU  20          1HD1      LEU  20  10.459  -0.388  -7.307
  854   2HD1  LEU  20          2HD1      LEU  20   9.747  -0.939  -8.823
  855   3HD1  LEU  20          3HD1      LEU  20   8.715  -0.281  -7.553
  856   1HD2  LEU  20          1HD2      LEU  20   8.402   1.534 -10.155
  857   2HD2  LEU  20          2HD2      LEU  20   9.521   0.214 -10.495
  858   3HD2  LEU  20          3HD2      LEU  20  10.063   1.887 -10.628
  859    H    CYS  21           H        CYS  21   9.866   5.476  -9.169
  860    HA   CYS  21           HA       CYS  21   8.061   7.161  -7.782
  861   1HB   CYS  21          2HB       CYS  21   9.944   7.985  -9.200
  862   2HB   CYS  21          3HB       CYS  21   9.101   7.409 -10.624
  863    H    TYR  22           H        TYR  22   5.983   7.783  -8.540
  864    HA   TYR  22           HA       TYR  22   4.638   5.770 -10.220
  865   1HB   TYR  22          2HB       TYR  22   3.595   5.463  -8.192
  866   2HB   TYR  22          3HB       TYR  22   3.826   7.136  -7.696
  867    HD1  TYR  22           HD1      TYR  22   1.968   5.185 -10.292
  868    HD2  TYR  22           HD2      TYR  22   1.962   8.489  -7.611
  869    HE1  TYR  22           HE1      TYR  22  -0.354   5.687 -10.926
  870    HE2  TYR  22           HE2      TYR  22  -0.362   9.000  -8.237
  871    HH   TYR  22           HH       TYR  22  -2.242   6.848 -10.236
  872    H    THR  23           H        THR  23   5.258   9.122  -9.681
  873    HA   THR  23           HA       THR  23   3.143  10.236 -11.181
  874    HB   THR  23           HB       THR  23   5.911  11.342 -10.670
  875    HG1  THR  23           HG1      THR  23   4.424  10.887  -8.837
  876   1HG2  THR  23          1HG2      THR  23   3.399  12.706 -11.648
  877   2HG2  THR  23          2HG2      THR  23   4.889  12.468 -12.562
  878   3HG2  THR  23          3HG2      THR  23   4.876  13.533 -11.157
  879    H    CYS  24           H        CYS  24   6.498   9.226 -12.111
  880    HA   CYS  24           HA       CYS  24   5.651   9.640 -14.884
  881   1HB   CYS  24          2HB       CYS  24   7.997   9.891 -15.471
  882   2HB   CYS  24          3HB       CYS  24   7.566  11.040 -14.221
  883    H    GLY  25           H        GLY  25   7.159   7.541 -12.497
  884   1HA   GLY  25          1HA       GLY  25   6.767   5.177 -12.478
  885   2HA   GLY  25          2HA       GLY  25   6.623   5.225 -14.229
  886    H    SER  26           H        SER  26   9.171   6.778 -12.367
  887    HA   SER  26           HA       SER  26  11.122   5.115 -13.789
  888   1HB   SER  26          2HB       SER  26  11.184   7.691 -13.805
  889   2HB   SER  26          3HB       SER  26  11.775   7.557 -12.149
  890    HG   SER  26           HG       SER  26  12.988   6.720 -14.546
  891    HA   PRO  27           HA       PRO  27  11.699   2.864  -9.984
  892   1HB   PRO  27          2HB       PRO  27  13.633   1.215 -10.939
  893   2HB   PRO  27          3HB       PRO  27  11.918   0.995 -11.302
  894   1HG   PRO  27          2HG       PRO  27  14.060   2.260 -12.967
  895   2HG   PRO  27          3HG       PRO  27  12.774   1.143 -13.460
  896   1HD   PRO  27          2HD       PRO  27  12.615   3.815 -13.864
  897   2HD   PRO  27          3HD       PRO  27  11.186   2.811 -13.548
  898    H    GLY  28           H        GLY  28  12.611   4.579  -8.765
  899   1HA   GLY  28          1HA       GLY  28  15.160   4.257  -7.815
  900   2HA   GLY  28          2HA       GLY  28  15.334   5.397  -9.141
  901    H    HIS  29           H        HIS  29  13.661   7.247  -9.047
  902    HA   HIS  29           HA       HIS  29  13.851   8.389  -6.369
  903   1HB   HIS  29          2HB       HIS  29  13.419  10.518  -7.410
  904   2HB   HIS  29          3HB       HIS  29  14.630   9.672  -8.371
  905    HD1  HIS  29           HD1      HIS  29  14.174   9.553 -10.805
  906    HD2  HIS  29           HD2      HIS  29  10.722  10.279  -8.610
  907    HE1  HIS  29           HE1      HIS  29  12.363   9.937 -12.507
  908    H    TYR  30           H        TYR  30  11.828  10.143  -6.224
  909    HA   TYR  30           HA       TYR  30   9.358   8.592  -6.569
  910   1HB   TYR  30          2HB       TYR  30  10.642   9.045  -4.101
  911   2HB   TYR  30          3HB       TYR  30   9.250  10.121  -4.131
  912    HD1  TYR  30           HD1      TYR  30  10.109   6.566  -4.910
  913    HD2  TYR  30           HD2      TYR  30   7.235   9.298  -3.367
  914    HE1  TYR  30           HE1      TYR  30   8.647   4.680  -4.312
  915    HE2  TYR  30           HE2      TYR  30   5.766   7.420  -2.764
  916    HH   TYR  30           HH       TYR  30   6.814   4.201  -2.732
  917    H    GLN  31           H        GLN  31   7.431  10.115  -5.837
  918    HA   GLN  31           HA       GLN  31   7.148  12.102  -7.716
  919   1HB   GLN  31          2HB       GLN  31   5.240  11.184  -6.545
  920   2HB   GLN  31          3HB       GLN  31   5.807  11.854  -5.021
  921   1HG   GLN  31          2HG       GLN  31   5.251  14.025  -5.622
  922   2HG   GLN  31          3HG       GLN  31   5.205  13.640  -7.341
  923   1HE2  GLN  31          1HE2      GLN  31   3.148  15.013  -6.455
  924   2HE2  GLN  31          2HE2      GLN  31   1.736  14.031  -6.286
  925    H    ALA  32           H        ALA  32   8.244  12.419  -4.364
  926    HA   ALA  32           HA       ALA  32   8.395  15.197  -4.225
  927   1HB   ALA  32          1HB       ALA  32   8.619  13.904  -2.234
  928   2HB   ALA  32          2HB       ALA  32  10.051  13.084  -2.860
  929   3HB   ALA  32          3HB       ALA  32  10.122  14.800  -2.459
  930    H    GLN  33           H        GLN  33  10.506  12.885  -5.757
  931    HA   GLN  33           HA       GLN  33  12.286  15.094  -6.554
  932   1HB   GLN  33          2HB       GLN  33  12.888  12.228  -5.892
  933   2HB   GLN  33          3HB       GLN  33  13.960  13.150  -6.937
  934   1HG   GLN  33          2HG       GLN  33  14.718  14.458  -5.250
  935   2HG   GLN  33          3HG       GLN  33  13.196  14.387  -4.362
  936   1HE2  GLN  33          1HE2      GLN  33  15.818  14.054  -3.290
  937   2HE2  GLN  33          2HE2      GLN  33  15.906  12.459  -2.633
  938    H    CYS  34           H        CYS  34   9.747  14.134  -7.882
  939    HA   CYS  34           HA       CYS  34  10.720  12.732 -10.192
  940   1HB   CYS  34          2HB       CYS  34   8.450  12.325  -9.200
  941   2HB   CYS  34          3HB       CYS  34   7.976  13.935  -9.707
  942    HA   PRO  35           HA       PRO  35  11.920  16.555 -12.157
  943   1HB   PRO  35          2HB       PRO  35  12.491  15.465 -14.576
  944   2HB   PRO  35          3HB       PRO  35  13.558  15.308 -13.177
  945   1HG   PRO  35          2HG       PRO  35  11.572  13.354 -14.272
  946   2HG   PRO  35          3HG       PRO  35  13.218  13.063 -13.679
  947   1HD   PRO  35          2HD       PRO  35  11.020  12.557 -12.182
  948   2HD   PRO  35          3HD       PRO  35  12.560  13.078 -11.471
  949    H    LYS  36           H        LYS  36   9.261  14.565 -12.960
  950    HA   LYS  36           HA       LYS  36   8.323  16.396 -15.045
  951   1HB   LYS  36          2HB       LYS  36   8.230  13.687 -14.939
  952   2HB   LYS  36          3HB       LYS  36   6.651  14.084 -14.276
  953   1HG   LYS  36          2HG       LYS  36   5.879  14.388 -16.324
  954   2HG   LYS  36          3HG       LYS  36   7.034  15.702 -16.561
  955   1HD   LYS  36          2HD       LYS  36   8.706  13.731 -17.015
  956   2HD   LYS  36          3HD       LYS  36   7.226  12.832 -17.358
  957   1HE   LYS  36          2HE       LYS  36   7.889  15.480 -18.629
  958   2HE   LYS  36          3HE       LYS  36   8.329  13.929 -19.343
  959   1HZ   LYS  36          1HZ       LYS  36   5.634  15.056 -18.907
  960   2HZ   LYS  36          2HZ       LYS  36   5.859  13.393 -19.118
  961   3HZ   LYS  36          3HZ       LYS  36   6.317  14.470 -20.339
  962    H    LYS  37           H        LYS  37   8.228  16.259 -11.797
  963    HA   LYS  37           HA       LYS  37   5.600  16.510 -10.994
  964   1HB   LYS  37          2HB       LYS  37   8.202  17.515  -9.987
  965   2HB   LYS  37          3HB       LYS  37   6.763  18.301  -9.354
  966   1HG   LYS  37          2HG       LYS  37   6.334  15.497  -9.279
  967   2HG   LYS  37          3HG       LYS  37   7.918  15.836  -8.579
  968   1HD   LYS  37          2HD       LYS  37   6.537  16.048  -6.742
  969   2HD   LYS  37          3HD       LYS  37   6.646  17.719  -7.303
  970   1HE   LYS  37          2HE       LYS  37   4.516  17.541  -8.405
  971   2HE   LYS  37          3HE       LYS  37   4.427  15.818  -8.046
  972   1HZ   LYS  37          1HZ       LYS  37   3.068  16.974  -6.494
  973   2HZ   LYS  37          2HZ       LYS  37   4.309  18.055  -6.102
  974   3HZ   LYS  37          3HZ       LYS  37   4.433  16.428  -5.656
  975    H    ARG  38           H        ARG  38   4.141  17.680 -12.093
  976    HA   ARG  38           HA       ARG  38   3.047  19.464 -12.983
  977   1HB   ARG  38          2HB       ARG  38   3.511  20.369 -10.696
  978   2HB   ARG  38          3HB       ARG  38   4.960  21.128 -11.342
  979   1HG   ARG  38          2HG       ARG  38   3.705  22.903 -11.778
  980   2HG   ARG  38          3HG       ARG  38   2.938  21.951 -13.050
  981   1HD   ARG  38          2HD       ARG  38   1.564  21.075 -10.907
  982   2HD   ARG  38          3HD       ARG  38   1.942  22.714 -10.380
  983    HE   ARG  38           HE       ARG  38   0.457  23.512 -11.926
  984   1HH1  ARG  38          2HH1      ARG  38   1.219  20.201 -12.684
  985   2HH1  ARG  38          1HH1      ARG  38   0.019  20.073 -13.928
  986   1HH2  ARG  38          2HH2      ARG  38  -1.126  23.357 -13.561
  987   2HH2  ARG  38          1HH2      ARG  38  -1.314  21.869 -14.426
  988    H    LYS  39           H        LYS  39   4.024  18.844 -15.039
  989    HA   LYS  39           HA       LYS  39   6.327  20.327 -15.959
  990   1HB   LYS  39          2HB       LYS  39   5.897  17.996 -16.682
  991   2HB   LYS  39          3HB       LYS  39   4.438  18.538 -17.501
  992   1HG   LYS  39          2HG       LYS  39   6.530  20.169 -18.434
  993   2HG   LYS  39          3HG       LYS  39   7.135  18.511 -18.442
  994   1HD   LYS  39          2HD       LYS  39   4.678  18.126 -19.483
  995   2HD   LYS  39          3HD       LYS  39   5.003  19.764 -20.053
  996   1HE   LYS  39          2HE       LYS  39   7.372  18.432 -20.532
  997   2HE   LYS  39          3HE       LYS  39   6.142  17.227 -20.909
  998   1HZ   LYS  39          1HZ       LYS  39   6.005  18.238 -22.870
  999   2HZ   LYS  39          2HZ       LYS  39   6.872  19.593 -22.347
 1000   3HZ   LYS  39          3HZ       LYS  39   5.206  19.498 -22.075
 1001    H    SER  40           H        SER  40   3.012  20.015 -17.246
 1002    HA   SER  40           HA       SER  40   3.228  22.440 -18.740
 1003   1HB   SER  40          2HB       SER  40   0.774  20.800 -18.067
 1004   2HB   SER  40          3HB       SER  40   0.863  22.065 -19.291
 1005    HG   SER  40           HG       SER  40   2.572  20.736 -20.256
 1006    H    GLY  41           H        GLY  41   1.601  24.223 -18.507
 1007   1HA   GLY  41          1HA       GLY  41  -0.001  25.122 -16.714
 1008   2HA   GLY  41          2HA       GLY  41   1.389  24.937 -15.656
 1009    H    ASN  42           H        ASN  42  -0.310  27.115 -17.427
 1010    HA   ASN  42           HA       ASN  42   2.009  28.755 -18.137
 1011   1HB   ASN  42          2HB       ASN  42   0.007  28.345 -19.710
 1012   2HB   ASN  42          3HB       ASN  42  -0.866  29.470 -18.671
 1013   1HD2  ASN  42          1HD2      ASN  42   0.952  29.204 -21.399
 1014   2HD2  ASN  42          2HD2      ASN  42   1.478  30.843 -21.554
 1015    H    SER  43           H        SER  43   2.767  29.885 -16.460
 1016    HA   SER  43           HA       SER  43   0.822  31.324 -14.775
 1017   1HB   SER  43          2HB       SER  43   3.599  30.511 -13.908
 1018   2HB   SER  43          3HB       SER  43   2.276  31.095 -12.898
 1019    HG   SER  43           HG       SER  43   1.174  29.176 -13.299
 1020    H    ARG  44           H        ARG  44   3.939  31.445 -16.408
 1021    HA   ARG  44           HA       ARG  44   5.288  33.173 -17.031
 1022   1HB   ARG  44          2HB       ARG  44   2.842  33.691 -18.016
 1023   2HB   ARG  44          3HB       ARG  44   3.044  35.112 -17.000
 1024   1HG   ARG  44          2HG       ARG  44   4.499  36.046 -18.406
 1025   2HG   ARG  44          3HG       ARG  44   5.383  34.536 -18.634
 1026   1HD   ARG  44          2HD       ARG  44   3.165  33.934 -19.994
 1027   2HD   ARG  44          3HD       ARG  44   3.139  35.686 -20.189
 1028    HE   ARG  44           HE       ARG  44   4.897  35.505 -21.635
 1029   1HH1  ARG  44          2HH1      ARG  44   4.681  32.582 -19.754
 1030   2HH1  ARG  44          1HH1      ARG  44   5.906  31.756 -20.659
 1031   1HH2  ARG  44          2HH2      ARG  44   6.511  34.426 -22.833
 1032   2HH2  ARG  44          1HH2      ARG  44   6.947  32.806 -22.409
 1033    H    GLU  45           H        GLU  45   4.983  32.739 -14.207
 1034    HA   GLU  45           HA       GLU  45   6.027  35.264 -13.277
 1035   1HB   GLU  45          2HB       GLU  45   4.470  35.531 -11.428
 1036   2HB   GLU  45          3HB       GLU  45   3.607  35.572 -12.959
 1037   1HG   GLU  45          2HG       GLU  45   3.054  33.155 -12.604
 1038   2HG   GLU  45          3HG       GLU  45   3.725  33.312 -10.982
 1039    H    ARG  46           H        ARG  46   7.004  32.560 -13.631
 1040    HA   ARG  46           HA       ARG  46   7.412  31.673 -10.864
 1041   1HB   ARG  46          2HB       ARG  46   6.689  30.135 -12.869
 1042   2HB   ARG  46          3HB       ARG  46   8.408  30.152 -13.240
 1043   1HG   ARG  46          2HG       ARG  46   8.972  29.048 -11.276
 1044   2HG   ARG  46          3HG       ARG  46   7.440  29.450 -10.498
 1045   1HD   ARG  46          2HD       ARG  46   6.310  27.765 -11.536
 1046   2HD   ARG  46          3HD       ARG  46   7.335  27.817 -12.971
 1047    HE   ARG  46           HE       ARG  46   8.708  26.259 -12.006
 1048   1HH1  ARG  46          2HH1      ARG  46   6.618  27.607  -9.571
 1049   2HH1  ARG  46          1HH1      ARG  46   7.095  26.476  -8.349
 1050   1HH2  ARG  46          2HH2      ARG  46   9.345  24.763 -10.406
 1051   2HH2  ARG  46          1HH2      ARG  46   8.647  24.860  -8.825
 1052    H    CYS  47           H        CYS  47   9.757  30.663 -10.486
 1053    HA   CYS  47           HA       CYS  47  11.655  32.552 -11.676
 1054   1HB   CYS  47          2HB       CYS  47  11.171  33.150  -9.327
 1055   2HB   CYS  47          3HB       CYS  47  11.650  31.545  -8.811
 1056    H    GLN  48           H        GLN  48  13.063  31.459 -12.868
 1057    HA   GLN  48           HA       GLN  48  13.450  28.593 -12.456
 1058   1HB   GLN  48          2HB       GLN  48  13.181  30.153 -14.739
 1059   2HB   GLN  48          3HB       GLN  48  14.897  29.769 -14.691
 1060   1HG   GLN  48          2HG       GLN  48  14.231  27.942 -15.810
 1061   2HG   GLN  48          3HG       GLN  48  13.885  27.341 -14.190
 1062   1HE2  GLN  48          1HE2      GLN  48  12.583  28.335 -17.202
 1063   2HE2  GLN  48          2HE2      GLN  48  10.927  27.988 -16.856
 1064    H    LEU  49           H        LEU  49  14.629  30.609 -10.668
 1065    HA   LEU  49           HA       LEU  49  17.461  29.901 -11.060
 1066   1HB   LEU  49          2HB       LEU  49  16.299  32.482 -10.931
 1067   2HB   LEU  49          3HB       LEU  49  17.224  32.241  -9.450
 1068    HG   LEU  49           HG       LEU  49  18.609  31.532 -11.957
 1069   1HD1  LEU  49          1HD1      LEU  49  18.070  33.426 -13.012
 1070   2HD1  LEU  49          2HD1      LEU  49  19.116  34.217 -11.833
 1071   3HD1  LEU  49          3HD1      LEU  49  17.375  34.147 -11.561
 1072   1HD2  LEU  49          1HD2      LEU  49  19.618  33.357  -9.825
 1073   2HD2  LEU  49          2HD2      LEU  49  20.486  32.165 -10.794
 1074   3HD2  LEU  49          3HD2      LEU  49  19.436  31.637  -9.476
 1075    H    CYS  50           H        CYS  50  14.784  30.514  -8.741
 1076    HA   CYS  50           HA       CYS  50  16.358  28.976  -6.812
 1077   1HB   CYS  50          2HB       CYS  50  15.783  30.377  -5.016
 1078   2HB   CYS  50          3HB       CYS  50  16.261  31.477  -6.292
 1079    H    ASN  51           H        ASN  51  14.095  28.684  -8.892
 1080    HA   ASN  51           HA       ASN  51  12.183  27.480  -9.161
 1081   1HB   ASN  51          2HB       ASN  51  13.633  26.226  -7.020
 1082   2HB   ASN  51          3HB       ASN  51  11.904  26.098  -6.709
 1083   1HD2  ASN  51          1HD2      ASN  51  13.727  26.104  -9.742
 1084   2HD2  ASN  51          2HD2      ASN  51  13.175  24.557 -10.278
 1085    H    GLY  52           H        GLY  52  12.234  30.098  -7.615
 1086   1HA   GLY  52          1HA       GLY  52  10.187  30.031  -5.664
 1087   2HA   GLY  52          2HA       GLY  52  10.743  31.461  -6.520
 1088    H    MET  53           H        MET  53   8.053  30.959  -5.802
 1089    HA   MET  53           HA       MET  53   6.846  30.699  -8.477
 1090   1HB   MET  53          2HB       MET  53   6.320  28.765  -6.996
 1091   2HB   MET  53          3HB       MET  53   5.565  29.880  -5.865
 1092   1HG   MET  53          2HG       MET  53   4.297  30.505  -8.193
 1093   2HG   MET  53          3HG       MET  53   4.561  28.772  -8.374
 1094   1HE   MET  53          1HE       MET  53   2.036  29.305  -8.717
 1095   2HE   MET  53          2HE       MET  53   1.789  27.760  -7.906
 1096   3HE   MET  53          3HE       MET  53   0.851  29.173  -7.418
 1097    H    GLY  54           H        GLY  54   6.642  32.839  -8.963
 1098   1HA   GLY  54          1HA       GLY  54   4.557  34.368  -8.469
 1099   2HA   GLY  54          2HA       GLY  54   5.453  34.635  -6.981
 1100    H    HIS  55           H        HIS  55   7.959  35.009  -7.604
 1101    HA   HIS  55           HA       HIS  55   7.911  37.452  -9.168
 1102   1HB   HIS  55          2HB       HIS  55  10.215  37.760  -8.321
 1103   2HB   HIS  55          3HB       HIS  55   9.058  37.490  -7.021
 1104    HD1  HIS  55           HD1      HIS  55   9.045  34.960  -6.046
 1105    HD2  HIS  55           HD2      HIS  55  12.350  36.074  -8.304
 1106    HE1  HIS  55           HE1      HIS  55  10.830  33.276  -5.500
 1107    H    ASN  56           H        ASN  56  10.333  37.695 -10.265
 1108    HA   ASN  56           HA       ASN  56  10.486  35.462 -12.182
 1109   1HB   ASN  56          2HB       ASN  56  10.625  38.432 -12.590
 1110   2HB   ASN  56          3HB       ASN  56  11.435  37.352 -13.720
 1111   1HD2  ASN  56          1HD2      ASN  56   9.992  35.483 -14.457
 1112   2HD2  ASN  56          2HD2      ASN  56   8.383  35.916 -14.913
 1113    H    ALA  57           H        ALA  57  12.549  34.919 -13.014
 1114    HA   ALA  57           HA       ALA  57  14.621  34.852 -11.151
 1115   1HB   ALA  57          1HB       ALA  57  14.674  33.187 -12.781
 1116   2HB   ALA  57          2HB       ALA  57  14.528  34.345 -14.103
 1117   3HB   ALA  57          3HB       ALA  57  16.037  34.225 -13.199
 1118    H    LYS  58           H        LYS  58  13.989  37.094 -13.791
 1119    HA   LYS  58           HA       LYS  58  16.461  38.431 -13.780
 1120   1HB   LYS  58          2HB       LYS  58  14.455  38.565 -15.444
 1121   2HB   LYS  58          3HB       LYS  58  13.887  39.848 -14.383
 1122   1HG   LYS  58          2HG       LYS  58  16.694  40.074 -15.213
 1123   2HG   LYS  58          3HG       LYS  58  15.507  40.223 -16.512
 1124   1HD   LYS  58          2HD       LYS  58  14.600  42.143 -15.647
 1125   2HD   LYS  58          3HD       LYS  58  15.044  41.733 -13.988
 1126   1HE   LYS  58          2HE       LYS  58  17.026  42.503 -16.124
 1127   2HE   LYS  58          3HE       LYS  58  16.324  43.643 -14.977
 1128   1HZ   LYS  58          1HZ       LYS  58  18.132  43.100 -13.783
 1129   2HZ   LYS  58          2HZ       LYS  58  18.358  41.616 -14.565
 1130   3HZ   LYS  58          3HZ       LYS  58  17.214  41.755 -13.326
 1131    H    GLN  59           H        GLN  59  13.807  38.522 -11.595
 1132    HA   GLN  59           HA       GLN  59  14.988  40.859 -10.244
 1133   1HB   GLN  59          2HB       GLN  59  12.496  40.808 -11.174
 1134   2HB   GLN  59          3HB       GLN  59  12.200  39.999  -9.642
 1135   1HG   GLN  59          2HG       GLN  59  13.258  41.923  -8.486
 1136   2HG   GLN  59          3HG       GLN  59  13.372  42.739 -10.044
 1137   1HE2  GLN  59          1HE2      GLN  59  12.088  44.291  -8.646
 1138   2HE2  GLN  59          2HE2      GLN  59  10.369  44.147  -8.722
 1139    H    CYS  60           H        CYS  60  15.430  37.733 -10.061
 1140    HA   CYS  60           HA       CYS  60  14.617  37.324  -7.320
 1141   1HB   CYS  60          2HB       CYS  60  14.393  35.482  -8.946
 1142   2HB   CYS  60          3HB       CYS  60  16.123  35.502  -9.227
 1143    H    ARG  61           H        ARG  61  15.899  37.959  -5.723
 1144    HA   ARG  61           HA       ARG  61  18.553  38.943  -6.176
 1145   1HB   ARG  61          2HB       ARG  61  16.770  38.695  -3.775
 1146   2HB   ARG  61          3HB       ARG  61  18.469  39.107  -3.579
 1147   1HG   ARG  61          2HG       ARG  61  18.129  41.036  -5.094
 1148   2HG   ARG  61          3HG       ARG  61  16.409  40.648  -5.139
 1149   1HD   ARG  61          2HD       ARG  61  16.142  41.885  -3.314
 1150   2HD   ARG  61          3HD       ARG  61  17.104  40.702  -2.429
 1151    HE   ARG  61           HE       ARG  61  18.837  42.467  -3.747
 1152   1HH1  ARG  61          2HH1      ARG  61  16.531  42.441  -1.139
 1153   2HH1  ARG  61          1HH1      ARG  61  17.315  43.713  -0.260
 1154   1HH2  ARG  61          2HH2      ARG  61  19.878  44.142  -2.600
 1155   2HH2  ARG  61          1HH2      ARG  61  19.217  44.680  -1.093
 1156    H    LYS  62           H        LYS  62  20.384  38.258  -4.741
 1157    HA   LYS  62           HA       LYS  62  20.471  35.319  -4.620
 1158   1HB   LYS  62          2HB       LYS  62  22.075  36.386  -6.167
 1159   2HB   LYS  62          3HB       LYS  62  22.759  37.287  -4.820
 1160   1HG   LYS  62          2HG       LYS  62  24.242  35.557  -4.982
 1161   2HG   LYS  62          3HG       LYS  62  23.109  34.906  -3.795
 1162   1HD   LYS  62          2HD       LYS  62  22.236  33.383  -5.262
 1163   2HD   LYS  62          3HD       LYS  62  22.566  34.391  -6.673
 1164   1HE   LYS  62          2HE       LYS  62  24.632  33.536  -6.956
 1165   2HE   LYS  62          3HE       LYS  62  24.945  33.452  -5.223
 1166   1HZ   LYS  62          1HZ       LYS  62  24.579  31.286  -5.334
 1167   2HZ   LYS  62          2HZ       LYS  62  24.166  31.385  -6.971
 1168   3HZ   LYS  62          3HZ       LYS  62  22.975  31.577  -5.786
 1169    H    ARG  63           H        ARG  63  22.132  38.032  -2.998
 1170    HA   ARG  63           HA       ARG  63  21.222  37.350  -0.411
 1171   1HB   ARG  63          2HB       ARG  63  22.667  35.416  -0.655
 1172   2HB   ARG  63          3HB       ARG  63  24.013  36.443  -1.129
 1173   1HG   ARG  63          2HG       ARG  63  24.448  37.100   0.998
 1174   2HG   ARG  63          3HG       ARG  63  22.759  36.982   1.497
 1175   1HD   ARG  63          2HD       ARG  63  24.305  35.280   2.513
 1176   2HD   ARG  63          3HD       ARG  63  22.890  34.622   1.690
 1177    HE   ARG  63           HE       ARG  63  24.283  33.621   0.173
 1178   1HH1  ARG  63          2HH1      ARG  63  26.064  36.031   1.944
 1179   2HH1  ARG  63          1HH1      ARG  63  27.599  35.567   1.286
 1180   1HH2  ARG  63          2HH2      ARG  63  26.297  33.001  -0.700
 1181   2HH2  ARG  63          1HH2      ARG  63  27.730  33.845  -0.218
 1182    H    ASP  64           H        ASP  64  24.459  38.338  -1.511
 1183    HA   ASP  64           HA       ASP  64  23.935  41.121  -1.032
 1184   1HB   ASP  64          2HB       ASP  64  24.241  40.617   1.257
 1185   2HB   ASP  64          3HB       ASP  64  25.574  39.517   0.920
  Start of MODEL   12
    1   1H5*    C 160          1H5*        C 160  26.614  28.491 -19.087
    2   2H5*    C 160          2H5*        C 160  25.511  27.350 -18.318
    3    H4*    C 160           H4*        C 160  27.521  26.202 -18.353
    4    H3*    C 160           H3*        C 160  27.152  27.488 -15.659
    5    H2*    C 160           H2*        C 160  29.152  26.442 -14.902
    6   2HO*    C 160          2HO*        C 160  30.154  24.954 -16.544
    7    H1*    C 160           H1*        C 160  30.615  27.248 -17.154
    8   1H4     C 160          1H4         C 160  31.880  31.786 -12.858
    9   2H4     C 160          2H4         C 160  30.305  32.495 -13.137
   10    H5     C 160           H5         C 160  28.666  31.544 -14.547
   11    H6     C 160           H6         C 160  28.130  29.662 -16.053
   12   1H5*    U 161          1H5*        U 161  27.591  23.208 -14.850
   13   2H5*    U 161          2H5*        U 161  26.528  22.763 -13.515
   14    H4*    U 161           H4*        U 161  28.845  22.198 -13.034
   15    H3*    U 161           H3*        U 161  27.546  24.300 -11.315
   16    H2*    U 161           H2*        U 161  29.475  24.337  -9.929
   17   2HO*    U 161          2HO*        U 161  30.427  22.391  -9.834
   18    H1*    U 161           H1*        U 161  31.247  24.487 -12.103
   19    H3     U 161           H3         U 161  31.395  28.522  -9.934
   20    H5     U 161           H5         U 161  28.088  28.774 -12.491
   21    H6     U 161           H6         U 161  28.375  26.381 -12.938
   22   1H5*    G 162          1H5*        G 162  28.901  21.066  -8.502
   23   2H5*    G 162          2H5*        G 162  27.539  20.850  -7.404
   24    H4*    G 162           H4*        G 162  29.578  21.176  -6.153
   25    H3*    G 162           H3*        G 162  27.509  23.343  -5.965
   26    H2*    G 162           H2*        G 162  28.843  24.488  -4.356
   27   2HO*    G 162          2HO*        G 162  30.317  23.266  -3.271
   28    H1*    G 162           H1*        G 162  31.150  24.356  -5.922
   29    H8     G 162           H8         G 162  28.301  24.874  -8.229
   30    H1     G 162           H1         G 162  30.160  30.318  -5.265
   31   1H2     G 162          1H2         G 162  31.468  29.859  -3.738
   32   2H2     G 162          2H2         G 162  31.983  28.240  -3.322
   33   1H5*    C 163          1H5*        C 163  28.393  22.308  -2.171
   34   2H5*    C 163          2H5*        C 163  27.061  22.200  -1.020
   35    H4*    C 163           H4*        C 163  28.642  23.858  -0.281
   36    H3*    C 163           H3*        C 163  25.979  24.929  -1.202
   37    H2*    C 163           H2*        C 163  26.621  27.086  -0.455
   38   2HO*    C 163          2HO*        C 163  29.149  26.341   0.426
   39    H1*    C 163           H1*        C 163  29.212  26.832  -1.615
   40   1H4     C 163          1H4         C 163  25.945  30.560  -5.645
   41   2H4     C 163          2H4         C 163  25.217  29.133  -6.348
   42    H5     C 163           H5         C 163  25.529  26.948  -5.509
   43    H6     C 163           H6         C 163  26.628  25.579  -3.772
   44   1H5*    C 164          1H5*        C 164  26.699  26.207   2.613
   45   2H5*    C 164          2H5*        C 164  25.352  26.123   3.748
   46    H4*    C 164           H4*        C 164  26.102  28.349   3.801
   47    H3*    C 164           H3*        C 164  23.581  28.055   2.182
   48    H2*    C 164           H2*        C 164  23.487  30.412   1.930
   49   2HO*    C 164          2HO*        C 164  24.308  31.457   3.646
   50    H1*    C 164           H1*        C 164  26.257  30.572   1.305
   51   1H4     C 164          1H4         C 164  23.279  30.974  -4.331
   52   2H4     C 164          2H4         C 164  23.099  29.234  -4.344
   53    H5     C 164           H5         C 164  23.707  27.834  -2.543
   54    H6     C 164           H6         C 164  24.648  27.758  -0.261
   55   1H5*    C 165          1H5*        C 165  22.659  30.877   5.205
   56   2H5*    C 165          2H5*        C 165  21.060  30.603   5.895
   57    H4*    C 165           H4*        C 165  21.128  32.836   5.082
   58    H3*    C 165           H3*        C 165  19.474  30.983   3.378
   59    H2*    C 165           H2*        C 165  18.774  32.842   2.079
   60   2HO*    C 165          2HO*        C 165  19.038  34.894   2.980
   61    H1*    C 165           H1*        C 165  21.413  33.869   1.902
   62   1H4     C 165          1H4         C 165  20.482  30.910  -3.676
   63   2H4     C 165          2H4         C 165  20.770  29.369  -2.899
   64    H5     C 165           H5         C 165  21.095  29.107  -0.575
   65    H6     C 165           H6         C 165  21.227  30.272   1.599
   66   1H5*    U 166          1H5*        U 166  16.695  34.088   4.432
   67   2H5*    U 166          2H5*        U 166  15.329  33.299   5.221
   68    H4*    U 166           H4*        U 166  14.321  34.625   3.613
   69    H3*    U 166           H3*        U 166  14.586  31.814   2.580
   70    H2*    U 166           H2*        U 166  13.419  32.436   0.603
   71   2HO*    U 166          2HO*        U 166  13.030  35.058   0.968
   72    H1*    U 166           H1*        U 166  14.994  34.703   0.169
   73    H3     U 166           H3         U 166  16.384  31.860  -3.078
   74    H5     U 166           H5         U 166  18.173  30.367   0.402
   75    H6     U 166           H6         U 166  16.857  32.007   1.664
   76   1H5*    C 167          1H5*        C 167  10.066  32.432   2.750
   77   2H5*    C 167          2H5*        C 167   9.365  30.817   2.667
   78    H4*    C 167           H4*        C 167   8.913  32.356   0.711
   79    H3*    C 167           H3*        C 167  10.026  29.578   0.366
   80    H2*    C 167           H2*        C 167   9.820  29.816  -1.987
   81   2HO*    C 167          2HO*        C 167   8.027  30.980  -2.381
   82    H1*    C 167           H1*        C 167  10.996  32.372  -2.001
   83   1H4     C 167          1H4         C 167  15.748  28.338  -3.418
   84   2H4     C 167          2H4         C 167  16.014  28.085  -1.708
   85    H5     C 167           H5         C 167  14.628  28.976  -0.016
   86    H6     C 167           H6         C 167  12.625  30.342   0.456
   87   1H5*    A 168          1H5*        A 168   6.404  27.420  -2.329
   88   2H5*    A 168          2H5*        A 168   5.806  28.855  -3.160
   89    H4*    A 168           H4*        A 168   3.663  28.630  -2.309
   90    H3*    A 168           H3*        A 168   4.917  27.499   0.072
   91    H2*    A 168           H2*        A 168   4.057  25.398  -0.311
   92   2HO*    A 168          2HO*        A 168   2.639  26.500   1.192
   93    H1*    A 168           H1*        A 168   2.064  26.732  -2.227
   94    H8     A 168           H8         A 168   4.530  24.153  -3.333
   95   1H6     A 168          1H6         A 168  -0.239  20.131  -3.530
   96   2H6     A 168          2H6         A 168   1.446  20.354  -3.948
   97    H2     A 168           H2         A 168  -1.651  23.866  -1.584
   98   1H5*    U 169          1H5*        U 169   6.198  31.380  -0.658
   99   2H5*    U 169          2H5*        U 169   5.284  32.017   0.709
  100    H4*    U 169           H4*        U 169   3.777  32.980  -1.300
  101    H3*    U 169           H3*        U 169   6.489  32.536  -2.520
  102    H2*    U 169           H2*        U 169   6.372  34.622  -3.601
  103   2HO*    U 169          2HO*        U 169   3.681  34.831  -2.634
  104    H1*    U 169           H1*        U 169   5.123  35.817  -1.266
  105    H3     U 169           H3         U 169   8.651  38.583  -1.863
  106    H5     U 169           H5         U 169  10.417  34.958  -0.735
  107    H6     U 169           H6         U 169   8.189  33.943  -0.871
  108   1H5*    C 170          1H5*        C 170   4.966  29.442  -5.570
  109   2H5*    C 170          2H5*        C 170   4.471  29.960  -7.182
  110    H4*    C 170           H4*        C 170   2.970  28.263  -6.589
  111    H3*    C 170           H3*        C 170   1.765  30.994  -6.307
  112    H2*    C 170           H2*        C 170  -0.305  30.052  -5.631
  113   2HO*    C 170          2HO*        C 170   0.768  27.434  -5.831
  114    H1*    C 170           H1*        C 170   0.983  28.263  -3.825
  115   1H4     C 170          1H4         C 170  -1.438  33.034  -0.297
  116   2H4     C 170          2H4         C 170   0.090  33.868  -0.468
  117    H5     C 170           H5         C 170   1.847  33.123  -1.858
  118    H6     C 170           H6         C 170   2.578  31.375  -3.443
  119   1H5*    C 171          1H5*        C 171  -1.727  29.307  -7.322
  120   2H5*    C 171          2H5*        C 171  -2.237  30.227  -8.738
  121    H4*    C 171           H4*        C 171  -3.875  30.483  -7.009
  122    H3*    C 171           H3*        C 171  -2.239  32.944  -7.583
  123    H2*    C 171           H2*        C 171  -3.611  34.182  -6.092
  124   2HO*    C 171          2HO*        C 171  -5.584  33.205  -5.428
  125    H1*    C 171           H1*        C 171  -3.475  32.235  -4.073
  126   1H4     C 171          1H4         C 171   1.147  36.303  -2.441
  127   2H4     C 171          2H4         C 171   2.137  35.731  -3.765
  128    H5     C 171           H5         C 171   1.412  34.146  -5.359
  129    H6     C 171           H6         C 171  -0.459  32.706  -6.082
  130   1H5*    G 172          1H5*        G 172  -6.230  34.044  -7.979
  131   2H5*    G 172          2H5*        G 172  -6.563  34.867  -9.503
  132    H4*    G 172           H4*        G 172  -7.434  36.308  -7.911
  133    H3*    G 172           H3*        G 172  -4.697  37.224  -8.738
  134    H2*    G 172           H2*        G 172  -4.908  39.138  -7.334
  135   2HO*    G 172          2HO*        G 172  -7.037  39.406  -6.300
  136    H1*    G 172           H1*        G 172  -5.692  37.642  -5.116
  137    H8     G 172           H8         G 172  -3.110  35.996  -7.344
  138    H1     G 172           H1         G 172  -0.641  39.676  -2.628
  139   1H2     G 172          1H2         G 172  -2.163  40.693  -1.680
  140   2H2     G 172          2H2         G 172  -3.857  40.568  -2.100
  141   1H5*    U 173          1H5*        U 173  -7.065  40.363  -8.850
  142   2H5*    U 173          2H5*        U 173  -7.142  41.312 -10.334
  143    H4*    U 173           H4*        U 173  -6.656  42.904  -8.733
  144    H3*    U 173           H3*        U 173  -4.085  42.020 -10.028
  145    H2*    U 173           H2*        U 173  -2.913  43.654  -8.766
  146   2HO*    U 173          2HO*        U 173  -4.119  45.328  -7.870
  147    H1*    U 173           H1*        U 173  -4.180  42.949  -6.358
  148    H3     U 173           H3         U 173   0.059  41.507  -5.686
  149    H5     U 173           H5         U 173  -1.526  38.720  -8.380
  150    H6     U 173           H6         U 173  -3.513  40.150  -8.535
  151   1H5*    C 174          1H5*        C 174  -4.229  46.061 -10.255
  152   2H5*    C 174          2H5*        C 174  -3.861  46.777 -11.824
  153    H4*    C 174           H4*        C 174  -2.387  47.822 -10.358
  154    H3*    C 174           H3*        C 174  -0.989  45.589 -11.819
  155    H2*    C 174           H2*        C 174   1.062  46.250 -10.810
  156   2HO*    C 174          2HO*        C 174   1.064  48.406 -10.567
  157    H1*    C 174           H1*        C 174  -0.082  46.404  -8.243
  158   1H4     C 174          1H4         C 174   2.569  40.603  -8.405
  159   2H4     C 174          2H4         C 174   1.214  40.013  -9.342
  160    H5     C 174           H5         C 174  -0.532  41.389 -10.140
  161    H6     C 174           H6         C 174  -1.415  43.692 -10.238
  162   1H5*    U 175          1H5*        U 175  -1.418  50.038 -13.712
  163   2H5*    U 175          2H5*        U 175  -3.120  50.469 -13.876
  164    H4*    U 175           H4*        U 175  -2.196  48.878 -16.130
  165    H3*    U 175           H3*        U 175  -0.526  51.240 -15.360
  166    H2*    U 175           H2*        U 175  -0.440  51.983 -17.614
  167   2HO*    U 175          2HO*        U 175  -0.950  50.490 -19.209
  168    H1*    U 175           H1*        U 175  -3.172  51.797 -18.028
  169    H3     U 175           H3         U 175  -2.058  56.234 -17.559
  170    H5     U 175           H5         U 175  -2.802  54.848 -13.678
  171    H6     U 175           H6         U 175  -2.882  52.581 -14.609
  172   1H5*    C 176          1H5*        C 176   1.642  48.239 -13.439
  173   2H5*    C 176          2H5*        C 176   1.524  49.984 -13.658
  174    H4*    C 176           H4*        C 176   3.680  50.355 -13.066
  175    H3*    C 176           H3*        C 176   4.337  47.821 -14.511
  176    H2*    C 176           H2*        C 176   6.297  47.504 -13.212
  177   2HO*    C 176          2HO*        C 176   6.095  49.620 -11.521
  178    H1*    C 176           H1*        C 176   5.033  47.879 -10.777
  179   1H4     C 176          1H4         C 176   4.587  41.596 -11.868
  180   2H4     C 176          2H4         C 176   3.105  41.877 -12.754
  181    H5     C 176           H5         C 176   2.255  44.025 -13.245
  182    H6     C 176           H6         C 176   2.620  46.456 -13.005
  183   1H5*    G 177          1H5*        G 177   7.973  50.022 -14.623
  184   2H5*    G 177          2H5*        G 177   8.468  50.220 -16.304
  185    H4*    G 177           H4*        G 177  10.347  49.383 -15.161
  186    H3*    G 177           H3*        G 177   8.981  47.348 -16.873
  187    H2*    G 177           H2*        G 177  10.570  45.682 -16.260
  188   2HO*    G 177          2HO*        G 177  12.306  46.520 -14.754
  189    H1*    G 177           H1*        G 177  10.274  46.162 -13.526
  190    H8     G 177           H8         G 177   6.901  46.560 -14.931
  191    H1     G 177           H1         G 177   8.637  40.347 -14.425
  192   1H2     G 177          1H2         G 177  10.659  40.226 -14.037
  193   2H2     G 177          2H2         G 177  11.725  41.602 -13.871
  194   1H5*    C 178          1H5*        C 178  13.108  47.095 -17.975
  195   2H5*    C 178          2H5*        C 178  13.260  47.077 -19.733
  196    H4*    C 178           H4*        C 178  14.387  45.166 -18.800
  197    H3*    C 178           H3*        C 178  11.914  44.608 -20.406
  198    H2*    C 178           H2*        C 178  12.236  42.272 -20.142
  199   2HO*    C 178          2HO*        C 178  14.284  41.598 -19.240
  200    H1*    C 178           H1*        C 178  12.729  42.510 -17.367
  201   1H4     C 178          1H4         C 178   6.607  40.740 -17.782
  202   2H4     C 178          2H4         C 178   6.163  42.401 -18.104
  203    H5     C 178           H5         C 178   7.723  44.148 -18.402
  204    H6     C 178           H6         C 178  10.121  44.736 -18.465
  205   1H5*    U 179          1H5*        U 179  15.121  42.415 -22.896
  206   2H5*    U 179          2H5*        U 179  14.427  42.464 -24.516
  207    H4*    U 179           H4*        U 179  14.812  40.174 -23.541
  208    H3*    U 179           H3*        U 179  12.135  41.031 -24.617
  209    H2*    U 179           H2*        U 179  11.312  38.828 -24.284
  210   2HO*    U 179          2HO*        U 179  13.541  37.708 -23.162
  211    H1*    U 179           H1*        U 179  12.334  38.649 -21.677
  212    H3     U 179           H3         U 179   7.719  38.897 -21.582
  213    H5     U 179           H5         U 179   9.099  42.848 -21.425
  214    H6     U 179           H6         U 179  11.337  41.982 -21.936
  215   1H5*    U 180          1H5*        U 180  13.111  37.651 -26.348
  216   2H5*    U 180          2H5*        U 180  12.921  37.445 -28.089
  217    H4*    U 180           H4*        U 180  11.675  35.729 -27.023
  218    H3*    U 180           H3*        U 180  10.014  37.885 -28.278
  219    H2*    U 180           H2*        U 180   8.016  36.777 -27.645
  220   2HO*    U 180          2HO*        U 180   8.164  34.600 -27.210
  221    H1*    U 180           H1*        U 180   8.954  36.309 -25.008
  222    H3     U 180           H3         U 180   5.499  39.153 -24.316
  223    H5     U 180           H5         U 180   8.468  41.579 -26.001
  224    H6     U 180           H6         U 180   9.778  39.542 -26.379
  225   1H5*    A 181          1H5*        A 181   9.920  34.867 -32.121
  226   2H5*    A 181          2H5*        A 181   9.509  36.121 -33.292
  227    H4*    A 181           H4*        A 181   7.739  34.376 -32.821
  228    H3*    A 181           H3*        A 181   7.202  37.333 -32.681
  229    H2*    A 181           H2*        A 181   4.900  36.888 -32.298
  230   2HO*    A 181          2HO*        A 181   4.410  34.453 -32.359
  231    H1*    A 181           H1*        A 181   5.402  34.982 -30.313
  232    H8     A 181           H8         A 181   7.829  37.833 -30.123
  233   1H6     A 181          1H6         A 181   3.644  40.710 -26.494
  234   2H6     A 181          2H6         A 181   5.281  40.788 -27.106
  235    H2     A 181           H2         A 181   1.750  37.058 -28.175
  236   1H5*    U 182          1H5*        U 182   5.422  34.517 -36.306
  237   2H5*    U 182          2H5*        U 182   4.992  35.735 -37.506
  238    H4*    U 182           H4*        U 182   2.689  34.960 -35.911
  239    H3*    U 182           H3*        U 182   4.338  32.744 -37.047
  240    H2*    U 182           H2*        U 182   2.421  31.674 -37.950
  241   2HO*    U 182          2HO*        U 182   0.458  33.382 -37.320
  242    H1*    U 182           H1*        U 182   1.437  33.929 -39.197
  243    H3     U 182           H3         U 182   3.269  31.546 -42.600
  244    H5     U 182           H5         U 182   6.554  33.372 -40.750
  245    H6     U 182           H6         U 182   5.019  34.122 -38.989
  246   1H5*    U 183          1H5*        U 183   1.655  28.500 -35.469
  247   2H5*    U 183          2H5*        U 183   2.146  29.413 -36.896
  248    H4*    U 183           H4*        U 183  -0.180  30.510 -36.766
  249    H3*    U 183           H3*        U 183  -0.457  28.629 -34.552
  250    H2*    U 183           H2*        U 183  -1.567  27.075 -35.837
  251   2HO*    U 183          2HO*        U 183  -3.463  29.180 -36.214
  252    H1*    U 183           H1*        U 183  -2.076  29.333 -37.851
  253    H3     U 183           H3         U 183  -1.207  24.241 -39.183
  254    H5     U 183           H5         U 183  -4.041  26.692 -41.054
  255    H6     U 183           H6         U 183  -3.385  28.470 -39.499
  256   1H5*    C 184          1H5*        C 184  -2.859  33.142 -32.309
  257   2H5*    C 184          2H5*        C 184  -3.244  31.698 -31.373
  258    H4*    C 184           H4*        C 184  -5.169  33.208 -33.154
  259    H3*    C 184           H3*        C 184  -4.763  33.246 -30.160
  260    H2*    C 184           H2*        C 184  -7.050  33.594 -29.884
  261   2HO*    C 184          2HO*        C 184  -7.659  34.054 -32.554
  262    H1*    C 184           H1*        C 184  -7.591  32.044 -32.336
  263   1H4     C 184          1H4         C 184  -8.919  28.639 -26.728
  264   2H4     C 184          2H4         C 184 -10.331  28.478 -27.749
  265    H5     C 184           H5         C 184 -10.540  29.485 -29.874
  266    H6     C 184           H6         C 184  -9.435  30.910 -31.561
  267   1H5*    G 185          1H5*        G 185  -6.051  37.926 -28.876
  268   2H5*    G 185          2H5*        G 185  -6.634  38.864 -30.251
  269    H4*    G 185           H4*        G 185  -4.091  39.042 -28.761
  270    H3*    G 185           H3*        G 185  -5.988  40.939 -30.101
  271    H2*    G 185           H2*        G 185  -4.256  42.566 -30.290
  272   2HO*    G 185          2HO*        G 185  -2.301  40.863 -29.224
  273    H1*    G 185           H1*        G 185  -2.452  40.762 -31.421
  274    H8     G 185           H8         G 185  -2.682  42.581 -33.277
  275    H1     G 185           H1         G 185  -8.581  40.389 -34.781
  276   1H2     G 185          1H2         G 185  -9.210  39.056 -33.339
  277   2H2     G 185          2H2         G 185  -8.277  38.599 -31.931
  278   1H5*    G 186          1H5*        G 186  -5.659  43.003 -24.745
  279   2H5*    G 186          2H5*        G 186  -6.365  44.260 -25.759
  280    H4*    G 186           H4*        G 186  -3.542  44.145 -24.686
  281    H3*    G 186           H3*        G 186  -5.964  45.748 -23.956
  282    H2*    G 186           H2*        G 186  -4.607  47.648 -23.481
  283   2HO*    G 186          2HO*        G 186  -2.172  46.788 -24.195
  284    H1*    G 186           H1*        G 186  -3.251  47.503 -25.915
  285    H8     G 186           H8         G 186  -6.853  46.545 -26.313
  286    H1     G 186           H1         G 186  -5.809  52.929 -26.523
  287   1H2     G 186          1H2         G 186  -3.863  53.326 -25.971
  288   2H2     G 186          2H2         G 186  -2.689  52.112 -25.517
  289   1H5*    G 187          1H5*        G 187  -4.186  42.560 -19.686
  290   2H5*    G 187          2H5*        G 187  -3.481  43.575 -20.944
  291    H4*    G 187           H4*        G 187  -5.731  41.705 -21.617
  292    H3*    G 187           H3*        G 187  -2.910  40.892 -21.013
  293    H2*    G 187           H2*        G 187  -2.926  39.372 -22.848
  294   2HO*    G 187          2HO*        G 187  -5.132  39.455 -24.040
  295    H1*    G 187           H1*        G 187  -3.868  41.285 -24.646
  296    H8     G 187           H8         G 187  -1.587  43.117 -22.422
  297    H1     G 187           H1         G 187   1.578  39.503 -26.758
  298   1H2     G 187          1H2         G 187   0.258  38.209 -27.670
  299   2H2     G 187          2H2         G 187  -1.452  38.115 -27.313
  300   1H5*    G 188          1H5*        G 188  -4.627  37.289 -22.253
  301   2H5*    G 188          2H5*        G 188  -4.705  36.333 -20.774
  302    H4*    G 188           H4*        G 188  -3.816  34.851 -22.312
  303    H3*    G 188           H3*        G 188  -1.590  36.091 -20.716
  304    H2*    G 188           H2*        G 188  -0.020  34.694 -21.839
  305   2HO*    G 188          2HO*        G 188  -1.325  33.301 -23.570
  306    H1*    G 188           H1*        G 188  -1.006  35.345 -24.372
  307    H8     G 188           H8         G 188  -1.189  38.466 -22.442
  308    H1     G 188           H1         G 188   4.849  37.087 -24.317
  309   1H2     G 188          1H2         G 188   4.928  35.147 -25.012
  310   2H2     G 188          2H2         G 188   3.562  34.056 -25.077
  311   1H5*    A 189          1H5*        A 189  -0.500  31.740 -20.623
  312   2H5*    A 189          2H5*        A 189  -0.053  31.569 -18.925
  313    H4*    A 189           H4*        A 189   1.739  30.910 -20.497
  314    H3*    A 189           H3*        A 189   2.230  33.136 -18.531
  315    H2*    A 189           H2*        A 189   4.511  33.191 -19.201
  316   2HO*    A 189          2HO*        A 189   5.310  31.370 -20.182
  317    H1*    A 189           H1*        A 189   3.861  33.191 -21.939
  318    H8     A 189           H8         A 189   1.535  35.357 -19.965
  319   1H6     A 189          1H6         A 189   5.668  39.965 -20.769
  320   2H6     A 189          2H6         A 189   4.058  39.588 -20.197
  321    H2     A 189           H2         A 189   7.510  36.181 -22.193
  322   1H5*    G 190          1H5*        G 190   5.454  29.801 -17.420
  323   2H5*    G 190          2H5*        G 190   5.537  30.116 -15.688
  324    H4*    G 190           H4*        G 190   7.729  30.185 -16.880
  325    H3*    G 190           H3*        G 190   6.748  32.517 -15.259
  326    H2*    G 190           H2*        G 190   8.814  33.645 -15.632
  327   2HO*    G 190          2HO*        G 190  10.476  32.279 -15.923
  328    H1*    G 190           H1*        G 190   8.743  33.227 -18.389
  329    H8     G 190           H8         G 190   5.248  33.834 -17.405
  330    H1     G 190           H1         G 190   8.735  39.282 -17.626
  331   1H2     G 190          1H2         G 190  10.738  38.812 -17.774
  332   2H2     G 190          2H2         G 190  11.377  37.184 -17.830
  333   1H5*    C 191          1H5*        C 191  10.557  31.484 -13.093
  334   2H5*    C 191          2H5*        C 191  10.254  31.971 -11.426
  335    H4*    C 191           H4*        C 191  12.126  33.167 -12.605
  336    H3*    C 191           H3*        C 191   9.867  34.653 -11.279
  337    H2*    C 191           H2*        C 191  10.983  36.703 -11.719
  338   2HO*    C 191          2HO*        C 191  13.185  36.589 -12.312
  339    H1*    C 191           H1*        C 191  11.521  36.031 -14.396
  340   1H4     C 191          1H4         C 191   6.185  39.560 -14.540
  341   2H4     C 191          2H4         C 191   5.251  38.097 -14.327
  342    H5     C 191           H5         C 191   6.204  35.976 -13.914
  343    H6     C 191           H6         C 191   8.310  34.725 -13.599
  344   1H5*    G 192          1H5*        G 192  13.526  36.141  -8.969
  345   2H5*    G 192          2H5*        G 192  12.949  36.013  -7.307
  346    H4*    G 192           H4*        G 192  13.832  38.233  -7.775
  347    H3*    G 192           H3*        G 192  10.906  37.991  -7.141
  348    H2*    G 192           H2*        G 192  10.705  40.366  -7.171
  349   2HO*    G 192          2HO*        G 192  13.227  41.031  -7.933
  350    H1*    G 192           H1*        G 192  11.992  40.612  -9.637
  351    H8     G 192           H8         G 192   9.901  37.530  -9.665
  352    H1     G 192           H1         G 192   6.526  42.926 -10.838
  353   1H2     G 192          1H2         G 192   7.701  44.573 -10.442
  354   2H2     G 192          2H2         G 192   9.355  44.503  -9.877
  355   1H5*    G 193          1H5*        G 193  12.675  40.660  -4.172
  356   2H5*    G 193          2H5*        G 193  11.837  40.541  -2.626
  357    H4*    G 193           H4*        G 193  11.820  42.816  -3.594
  358    H3*    G 193           H3*        G 193   9.238  41.398  -3.014
  359    H2*    G 193           H2*        G 193   8.021  43.350  -3.634
  360   2HO*    G 193          2HO*        G 193   9.921  45.016  -4.458
  361    H1*    G 193           H1*        G 193   9.393  43.649  -6.045
  362    H8     G 193           H8         G 193   9.000  40.017  -5.593
  363    H1     G 193           H1         G 193   3.531  42.870  -7.553
  364   1H2     G 193          1H2         G 193   3.723  44.916  -7.382
  365   2H2     G 193          2H2         G 193   5.150  45.737  -6.794
  366   1H5*    A 194          1H5*        A 194   8.585  45.175  -0.531
  367   2H5*    A 194          2H5*        A 194   8.351  44.399   1.036
  368    H4*    A 194           H4*        A 194   6.551  45.924   0.667
  369    H3*    A 194           H3*        A 194   5.820  43.018   0.538
  370    H2*    A 194           H2*        A 194   3.536  43.576   0.204
  371   2HO*    A 194          2HO*        A 194   4.245  46.337   0.311
  372    H1*    A 194           H1*        A 194   4.099  45.447  -1.806
  373    H8     A 194           H8         A 194   6.274  42.373  -1.939
  374   1H6     A 194          1H6         A 194   1.905  39.899  -5.647
  375   2H6     A 194          2H6         A 194   3.510  39.661  -4.991
  376    H2     A 194           H2         A 194   0.358  43.747  -4.050
  377   1H5*    C 195          1H5*        C 195   3.269  44.694   3.798
  378   2H5*    C 195          2H5*        C 195   2.993  43.408   4.973
  379    H4*    C 195           H4*        C 195   0.906  44.262   4.011
  380    H3*    C 195           H3*        C 195   1.638  41.381   3.557
  381    H2*    C 195           H2*        C 195  -0.443  41.018   2.478
  382   2HO*    C 195          2HO*        C 195  -1.984  42.833   2.592
  383    H1*    C 195           H1*        C 195  -0.204  43.351   0.903
  384   1H4     C 195          1H4         C 195   1.720  38.639  -2.949
  385   2H4     C 195          2H4         C 195   3.281  38.641  -2.159
  386    H5     C 195           H5         C 195   3.799  39.962  -0.271
  387    H6     C 195           H6         C 195   2.938  41.623   1.340
  388   1H5*    G 196          1H5*        G 196  -1.201  40.605   7.305
  389   2H5*    G 196          2H5*        G 196  -0.245  39.343   8.082
  390    H4*    G 196           H4*        G 196  -2.409  38.493   7.387
  391    H3*    G 196           H3*        G 196   0.024  37.366   6.031
  392    H2*    G 196           H2*        G 196  -1.350  35.807   4.863
  393   2HO*    G 196          2HO*        G 196  -3.094  35.278   6.039
  394    H1*    G 196           H1*        G 196  -3.137  37.774   4.001
  395    H8     G 196           H8         G 196   0.359  39.101   4.000
  396    H1     G 196           H1         G 196  -1.126  35.707  -1.307
  397   1H2     G 196          1H2         G 196  -2.936  34.756  -1.033
  398   2H2     G 196          2H2         G 196  -3.906  34.863   0.419
  399   1H5*    A 197          1H5*        A 197  -2.151  33.360   7.067
  400   2H5*    A 197          2H5*        A 197  -3.041  34.450   8.129
  401    H4*    A 197           H4*        A 197  -2.292  32.639   9.953
  402    H3*    A 197           H3*        A 197  -2.024  31.197   7.356
  403    H2*    A 197           H2*        A 197  -3.197  29.302   8.181
  404   2HO*    A 197          2HO*        A 197  -3.304  29.076  10.383
  405    H1*    A 197           H1*        A 197  -5.324  30.810   9.177
  406    H8     A 197           H8         A 197  -3.274  30.237   6.051
  407   1H6     A 197          1H6         A 197  -8.699  30.298   2.966
  408   2H6     A 197          2H6         A 197  -6.982  30.001   2.809
  409    H2     A 197           H2         A 197  -9.486  31.448   7.185
  410   1H5*    U 198          1H5*        U 198   3.192  30.316   7.223
  411   2H5*    U 198          2H5*        U 198   2.529  28.952   8.123
  412    H4*    U 198           H4*        U 198   2.564  31.065   9.957
  413    H3*    U 198           H3*        U 198   5.003  31.176   8.185
  414    H2*    U 198           H2*        U 198   6.333  31.574  10.052
  415   2HO*    U 198          2HO*        U 198   4.590  32.065  12.009
  416    H1*    U 198           H1*        U 198   4.464  29.998  11.718
  417    H3     U 198           H3         U 198   7.230  26.079  10.726
  418    H5     U 198           H5         U 198   9.488  29.454  11.752
  419    H6     U 198           H6         U 198   7.447  30.784  11.469
  420   1H5*    G 199          1H5*        G 199   4.443  35.217   5.382
  421   2H5*    G 199          2H5*        G 199   5.936  34.931   6.278
  422    H4*    G 199           H4*        G 199   5.458  37.319   5.602
  423    H3*    G 199           H3*        G 199   6.126  36.517   8.420
  424    H2*    G 199           H2*        G 199   6.136  38.810   9.065
  425   2HO*    G 199          2HO*        G 199   6.276  40.339   7.425
  426    H1*    G 199           H1*        G 199   3.668  39.340   7.878
  427    H8     G 199           H8         G 199   4.712  36.175   9.797
  428    H1     G 199           H1         G 199   0.600  40.105  12.885
  429   1H2     G 199          1H2         G 199   0.201  41.748  11.706
  430   2H2     G 199          2H2         G 199   0.880  42.021  10.117
  431   1H5*    A 200          1H5*        A 200   7.260  37.122  10.616
  432   2H5*    A 200          2H5*        A 200   8.942  37.624  10.791
  433    H4*    A 200           H4*        A 200   8.652  35.986  12.423
  434    H3*    A 200           H3*        A 200  10.107  34.980  10.030
  435    H2*    A 200           H2*        A 200  10.186  32.754  10.868
  436   2HO*    A 200          2HO*        A 200   8.676  33.561  13.140
  437    H1*    A 200           H1*        A 200   7.507  32.532  11.309
  438    H8     A 200           H8         A 200   7.047  34.757   8.596
  439   1H6     A 200          1H6         A 200   8.966  30.373   4.589
  440   2H6     A 200          2H6         A 200   8.150  31.915   4.720
  441    H2     A 200           H2         A 200  10.102  29.100   8.691
  442   1H5*    C 201          1H5*        C 201  14.400  33.710  13.377
  443   2H5*    C 201          2H5*        C 201  13.773  33.248  11.796
  444    H4*    C 201           H4*        C 201  11.685  34.059  13.692
  445    H3*    C 201           H3*        C 201  13.552  31.818  14.438
  446    H2*    C 201           H2*        C 201  11.699  30.608  15.318
  447   2HO*    C 201          2HO*        C 201   9.820  31.766  15.737
  448    H1*    C 201           H1*        C 201  10.140  31.050  13.021
  449   1H4     C 201          1H4         C 201  12.898  25.287  12.376
  450   2H4     C 201          2H4         C 201  14.117  26.057  11.385
  451    H5     C 201           H5         C 201  14.283  28.393  11.080
  452    H6     C 201           H6         C 201  13.311  30.588  11.659
  453   1H5*    C 202          1H5*        C 202  11.103  32.821  17.480
  454   2H5*    C 202          2H5*        C 202  11.691  32.842  19.142
  455    H4*    C 202           H4*        C 202   9.818  31.379  19.046
  456    H3*    C 202           H3*        C 202  12.454  29.947  19.330
  457    H2*    C 202           H2*        C 202  11.280  27.903  19.611
  458   2HO*    C 202          2HO*        C 202   8.961  28.071  19.922
  459    H1*    C 202           H1*        C 202   9.544  28.458  17.435
  460   1H4     C 202          1H4         C 202  13.940  24.432  15.122
  461   2H4     C 202          2H4         C 202  14.995  25.795  14.826
  462    H5     C 202           H5         C 202  14.512  28.006  15.501
  463    H6     C 202           H6         C 202  12.880  29.468  16.637
  464   1H5*    C 203          1H5*        C 203  10.336  28.939  23.227
  465   2H5*    C 203          2H5*        C 203  11.645  28.790  24.400
  466    H4*    C 203           H4*        C 203  10.312  26.743  24.229
  467    H3*    C 203           H3*        C 203  13.217  26.621  23.449
  468    H2*    C 203           H2*        C 203  13.031  24.260  23.215
  469   2HO*    C 203          2HO*        C 203  10.987  23.315  23.936
  470    H1*    C 203           H1*        C 203  10.687  24.449  21.674
  471   1H4     C 203          1H4         C 203  15.417  23.944  17.409
  472   2H4     C 203          2H4         C 203  15.682  25.669  17.526
  473    H5     C 203           H5         C 203  14.561  27.071  19.061
  474    H6     C 203           H6         C 203  12.896  27.164  20.881
  475   1H5*    U 204          1H5*        U 204  12.751  23.857  26.812
  476   2H5*    U 204          2H5*        U 204  14.244  23.778  27.746
  477    H4*    U 204           H4*        U 204  13.559  21.600  26.813
  478    H3*    U 204           H3*        U 204  16.208  22.784  26.023
  479    H2*    U 204           H2*        U 204  16.734  20.788  24.838
  480   2HO*    U 204          2HO*        U 204  15.582  18.963  25.375
  481    H1*    U 204           H1*        U 204  14.281  20.739  23.495
  482    H3     U 204           H3         U 204  17.717  21.825  20.593
  483    H5     U 204           H5         U 204  16.268  25.453  22.104
  484    H6     U 204           H6         U 204  14.965  24.145  23.719
  485   1H5*    A 205          1H5*        A 205  17.782  20.174  29.726
  486   2H5*    A 205          2H5*        A 205  19.397  20.862  29.884
  487    H4*    A 205           H4*        A 205  19.134  18.539  28.810
  488    H3*    A 205           H3*        A 205  20.846  20.760  27.717
  489    H2*    A 205           H2*        A 205  21.646  19.294  26.031
  490   2HO*    A 205          2HO*        A 205  21.167  17.039  26.290
  491    H1*    A 205           H1*        A 205  19.091  18.375  25.351
  492    H8     A 205           H8         A 205  18.709  21.969  26.039
  493   1H6     A 205          1H6         A 205  20.802  23.086  20.267
  494   2H6     A 205          2H6         A 205  20.043  23.813  21.664
  495    H2     A 205           H2         A 205  21.502  18.796  21.195
  496   1H5*    G 206          1H5*        G 206  24.298  21.442  27.220
  497   2H5*    G 206          2H5*        G 206  23.089  20.669  26.195
  498    H4*    G 206           H4*        G 206  26.012  20.524  26.111
  499    H3*    G 206           H3*        G 206  23.744  20.207  24.160
  500    H2*    G 206           H2*        G 206  25.229  19.145  22.628
  501   2HO*    G 206          2HO*        G 206  27.142  20.172  22.909
  502    H1*    G 206           H1*        G 206  26.223  17.386  24.564
  503    H8     G 206           H8         G 206  22.523  18.333  24.512
  504    H1     G 206           H1         G 206  23.991  12.782  21.526
  505   1H2     G 206          1H2         G 206  26.037  12.530  21.507
  506   2H2     G 206          2H2         G 206  27.185  13.656  22.198
  507   1H5*    U 207          1H5*        U 207  24.254  22.003  20.348
  508   2H5*    U 207          2H5*        U 207  25.895  22.430  19.867
  509    H4*    U 207           H4*        U 207  23.849  23.932  19.205
  510    H3*    U 207           H3*        U 207  26.600  24.831  20.018
  511    H2*    U 207           H2*        U 207  25.971  27.090  19.658
  512   2HO*    U 207          2HO*        U 207  23.413  26.896  18.929
  513    H1*    U 207           H1*        U 207  23.589  26.887  21.085
  514    H3     U 207           H3         U 207  25.963  29.181  24.130
  515    H5     U 207           H5         U 207  27.926  25.485  24.012
  516    H6     U 207           H6         U 207  26.425  24.857  22.176
  517   1H5*    A 208          1H5*        A 208  28.129  26.605  15.216
  518   2H5*    A 208          2H5*        A 208  26.747  26.377  14.143
  519    H4*    A 208           H4*        A 208  28.659  25.468  13.065
  520    H3*    A 208           H3*        A 208  26.670  23.470  14.048
  521    H2*    A 208           H2*        A 208  27.991  21.654  13.257
  522   2HO*    A 208          2HO*        A 208  29.946  23.551  12.398
  523    H1*    A 208           H1*        A 208  30.325  22.610  14.479
  524    H8     A 208           H8         A 208  26.922  22.863  16.204
  525   1H6     A 208          1H6         A 208  28.663  17.753  19.335
  526   2H6     A 208          2H6         A 208  27.408  18.963  19.181
  527    H2     A 208           H2         A 208  31.811  18.691  16.342
  528   1H5*    G 209          1H5*        G 209  26.174  22.378  10.626
  529   2H5*    G 209          2H5*        G 209  24.555  21.819  10.207
  530    H4*    G 209           H4*        G 209  26.020  20.152  11.387
  531    H3*    G 209           H3*        G 209  23.278  20.872  12.382
  532    H2*    G 209           H2*        G 209  23.465  19.214  14.084
  533   2HO*    G 209          2HO*        G 209  25.922  18.273  13.783
  534    H1*    G 209           H1*        G 209  25.966  20.112  14.930
  535    H8     G 209           H8         G 209  24.120  23.163  14.039
  536    H1     G 209           H1         G 209  22.226  20.714  19.722
  537   1H2     G 209          1H2         G 209  22.994  18.812  19.942
  538   2H2     G 209          2H2         G 209  24.000  18.003  18.763
  539   1H5*    A 210          1H5*        A 210  23.559  16.724  13.184
  540   2H5*    A 210          2H5*        A 210  22.269  16.050  12.188
  541    H4*    A 210           H4*        A 210  21.987  15.188  14.374
  542    H3*    A 210           H3*        A 210  19.979  17.325  13.690
  543    H2*    A 210           H2*        A 210  18.854  16.885  15.735
  544   2HO*    A 210          2HO*        A 210  20.023  15.004  16.965
  545    H1*    A 210           H1*        A 210  21.240  16.889  17.232
  546    H8     A 210           H8         A 210  21.241  19.587  14.643
  547   1H6     A 210          1H6         A 210  18.358  23.184  18.850
  548   2H6     A 210          2H6         A 210  19.137  23.181  17.283
  549    H2     A 210           H2         A 210  18.491  19.033  20.429
  550   1H5*    G 211          1H5*        G 211  17.431  13.452  14.702
  551   2H5*    G 211          2H5*        G 211  16.063  13.757  13.632
  552    H4*    G 211           H4*        G 211  15.478  13.390  16.037
  553    H3*    G 211           H3*        G 211  14.622  15.865  14.563
  554    H2*    G 211           H2*        G 211  13.366  16.558  16.466
  555   2HO*    G 211          2HO*        G 211  12.923  15.006  18.027
  556    H1*    G 211           H1*        G 211  15.496  16.165  18.226
  557    H8     G 211           H8         G 211  17.027  17.468  15.150
  558    H1     G 211           H1         G 211  14.073  22.093  18.580
  559   1H2     G 211          1H2         G 211  12.903  21.226  20.041
  560   2H2     G 211          2H2         G 211  12.746  19.502  20.297
  561   1H5*    G 212          1H5*        G 212  10.344  14.089  15.649
  562   2H5*    G 212          2H5*        G 212   9.659  14.357  14.046
  563    H4*    G 212           H4*        G 212   8.300  15.356  15.825
  564    H3*    G 212           H3*        G 212   9.520  17.155  13.750
  565    H2*    G 212           H2*        G 212   8.356  19.012  14.682
  566   2HO*    G 212          2HO*        G 212   6.579  18.546  15.903
  567    H1*    G 212           H1*        G 212   9.192  18.447  17.286
  568    H8     G 212           H8         G 212  11.977  17.649  14.955
  569    H1     G 212           H1         G 212  11.529  23.958  16.324
  570   1H2     G 212          1H2         G 212   9.756  24.324  17.310
  571   2H2     G 212          2H2         G 212   8.566  23.104  17.706
  572   1H5*    G 213          1H5*        G 213   4.964  17.630  13.130
  573   2H5*    G 213          2H5*        G 213   4.814  18.171  11.459
  574    H4*    G 213           H4*        G 213   3.903  19.743  13.178
  575    H3*    G 213           H3*        G 213   5.972  20.619  11.180
  576    H2*    G 213           H2*        G 213   5.784  22.856  11.981
  577   2HO*    G 213          2HO*        G 213   3.616  22.970  12.421
  578    H1*    G 213           H1*        G 213   6.063  22.095  14.657
  579    H8     G 213           H8         G 213   8.350  19.910  12.781
  580    H1     G 213           H1         G 213  10.694  25.901  13.494
  581   1H2     G 213          1H2         G 213   9.200  27.149  14.173
  582   2H2     G 213          2H2         G 213   7.557  26.648  14.500
  583   1H5*    G 214          1H5*        G 214   4.791  24.341  10.059
  584   2H5*    G 214          2H5*        G 214   4.437  23.887   8.392
  585    H4*    G 214           H4*        G 214   6.340  25.441   8.597
  586    H3*    G 214           H3*        G 214   6.739  22.737   7.355
  587    H2*    G 214           H2*        G 214   8.997  23.295   6.842
  588   2HO*    G 214          2HO*        G 214   8.671  25.817   8.109
  589    H1*    G 214           H1*        G 214   9.538  24.190   9.437
  590    H8     G 214           H8         G 214   7.364  21.274   9.897
  591    H1     G 214           H1         G 214  13.406  19.588   8.307
  592   1H2     G 214          1H2         G 214  14.436  21.251   7.654
  593   2H2     G 214          2H2         G 214  13.763  22.863   7.553
  594   1H5*    G 215          1H5*        G 215   8.314  25.184   3.875
  595   2H5*    G 215          2H5*        G 215   6.893  24.966   2.853
  596    H4*    G 215           H4*        G 215   8.661  24.529   1.421
  597    H3*    G 215           H3*        G 215   7.479  21.978   2.450
  598    H2*    G 215           H2*        G 215   9.029  20.696   1.177
  599   2HO*    G 215          2HO*        G 215   9.156  21.970  -0.648
  600    H1*    G 215           H1*        G 215  11.249  22.061   2.105
  601    H8     G 215           H8         G 215   8.920  22.052   4.960
  602    H1     G 215           H1         G 215  11.854  16.343   4.138
  603   1H2     G 215          1H2         G 215  12.805  16.314   2.309
  604   2H2     G 215          2H2         G 215  12.807  17.639   1.167
  605   1H5*    C 216          1H5*        C 216   6.035  21.505  -1.857
  606   2H5*    C 216          2H5*        C 216   4.508  20.649  -1.653
  607    H4*    C 216           H4*        C 216   6.367  19.368  -2.775
  608    H3*    C 216           H3*        C 216   4.913  18.283  -0.367
  609    H2*    C 216           H2*        C 216   6.058  16.225  -0.648
  610   2HO*    C 216          2HO*        C 216   5.851  16.384  -2.966
  611    H1*    C 216           H1*        C 216   8.553  17.496  -1.037
  612   1H4     C 216          1H4         C 216   8.360  15.608   5.088
  613   2H4     C 216          2H4         C 216   7.765  17.199   5.502
  614    H5     C 216           H5         C 216   7.171  18.838   3.908
  615    H6     C 216           H6         C 216   7.001  19.357   1.501
  616   1H5*    U 217          1H5*        U 217   2.747  15.072  -3.093
  617   2H5*    U 217          2H5*        U 217   1.760  14.532  -1.735
  618    H4*    U 217           H4*        U 217   3.933  13.218  -2.743
  619    H3*    U 217           H3*        U 217   2.540  13.056  -0.081
  620    H2*    U 217           H2*        U 217   4.123  11.446   0.644
  621   2HO*    U 217          2HO*        U 217   5.464  10.492  -0.969
  622    H1*    U 217           H1*        U 217   6.333  12.906  -0.209
  623    H3     U 217           H3         U 217   6.148  13.098   4.380
  624    H5     U 217           H5         U 217   3.746  16.252   3.033
  625    H6     U 217           H6         U 217   3.968  15.325   0.773
  626   1H5*    G 218          1H5*        G 218  -0.514   8.987  -0.541
  627   2H5*    G 218          2H5*        G 218   0.774   9.992   0.126
  628    H4*    G 218           H4*        G 218   1.114   7.473  -0.799
  629    H3*    G 218           H3*        G 218   3.104   9.747  -0.665
  630    H2*    G 218           H2*        G 218   4.757   8.252  -1.417
  631   2HO*    G 218          2HO*        G 218   2.978   6.056  -1.304
  632    H1*    G 218           H1*        G 218   2.893   6.959  -3.211
  633    H8     G 218           H8         G 218   3.127  10.678  -3.543
  634    H1     G 218           H1         G 218   7.561   7.478  -7.004
  635   1H2     G 218          1H2         G 218   7.543   5.485  -6.474
  636   2H2     G 218          2H2         G 218   6.483   4.785  -5.271
  637   1H5*    C 219          1H5*        C 219   4.295   7.277   2.235
  638   2H5*    C 219          2H5*        C 219   3.984   5.822   3.181
  639    H4*    C 219           H4*        C 219   4.818   7.004   4.884
  640    H3*    C 219           H3*        C 219   1.998   7.968   4.714
  641    H2*    C 219           H2*        C 219   2.381   9.690   6.279
  642   2HO*    C 219          2HO*        C 219   3.756   8.983   7.800
  643    H1*    C 219           H1*        C 219   4.794  10.533   5.133
  644   1H4     C 219          1H4         C 219  -0.015  14.147   2.803
  645   2H4     C 219          2H4         C 219   0.254  13.320   1.285
  646    H5     C 219           H5         C 219   1.701  11.471   1.032
  647    H6     C 219           H6         C 219   3.263   9.944   2.184
  648   1H5*    G 220          1H5*        G 220   4.656   3.935   6.751
  649   2H5*    G 220          2H5*        G 220   5.050   5.612   6.374
  650    H4*    G 220           H4*        G 220   6.287   3.206   5.441
  651    H3*    G 220           H3*        G 220   6.861   6.156   5.086
  652    H2*    G 220           H2*        G 220   8.606   5.566   3.628
  653   2HO*    G 220          2HO*        G 220   8.193   2.824   4.323
  654    H1*    G 220           H1*        G 220   7.049   3.363   2.553
  655    H8     G 220           H8         G 220   6.762   3.969   0.131
  656    H1     G 220           H1         G 220   6.891  10.321   1.361
  657   1H2     G 220          1H2         G 220   6.996  10.627   3.397
  658   2H2     G 220          2H2         G 220   7.042   9.352   4.594
  659   1H5*    G 221          1H5*        G 221  10.230   4.893   6.345
  660   2H5*    G 221          2H5*        G 221  11.387   5.994   7.094
  661    H4*    G 221           H4*        G 221  11.387   5.444   4.488
  662    H3*    G 221           H3*        G 221  12.194   7.946   5.929
  663    H2*    G 221           H2*        G 221  12.671   9.026   3.873
  664   2HO*    G 221          2HO*        G 221  13.554   7.049   3.003
  665    H1*    G 221           H1*        G 221  10.281   8.356   2.666
  666    H8     G 221           H8         G 221  10.206   8.936   6.431
  667    H1     G 221           H1         G 221   8.822  14.136   2.835
  668   1H2     G 221          1H2         G 221   9.111  13.692   0.841
  669   2H2     G 221          2H2         G 221   9.647  12.141   0.235
  670   1H5*    C 222          1H5*        C 222  15.872   8.115   3.159
  671   2H5*    C 222          2H5*        C 222  16.771   9.077   4.331
  672    H4*    C 222           H4*        C 222  15.757  10.070   2.055
  673    H3*    C 222           H3*        C 222  16.170  11.471   4.702
  674    H2*    C 222           H2*        C 222  15.509  13.482   3.664
  675   2HO*    C 222          2HO*        C 222  15.161  12.508   1.112
  676    H1*    C 222           H1*        C 222  13.428  12.168   2.189
  677   1H4     C 222          1H4         C 222  10.550  15.510   6.835
  678   2H4     C 222          2H4         C 222  10.722  14.118   7.882
  679    H5     C 222           H5         C 222  11.926  12.173   7.295
  680    H6     C 222           H6         C 222  13.275  11.074   5.543
  681   1H5*    U 223          1H5*        U 223  17.002  14.569   2.424
  682   2H5*    U 223          2H5*        U 223  18.672  14.984   2.811
  683    H4*    U 223           H4*        U 223  17.336  16.911   3.201
  684    H3*    U 223           H3*        U 223  18.291  15.558   5.710
  685    H2*    U 223           H2*        U 223  17.243  17.176   7.030
  686   2HO*    U 223          2HO*        U 223  18.092  18.898   5.790
  687    H1*    U 223           H1*        U 223  15.051  17.413   5.107
  688    H3     U 223           H3         U 223  12.950  16.920   9.126
  689    H5     U 223           H5         U 223  14.465  13.115   8.250
  690    H6     U 223           H6         U 223  15.658  14.132   6.365
  691   1H5*    U 224          1H5*        U 224  20.585  18.380   1.988
  692   2H5*    U 224          2H5*        U 224  19.030  18.031   2.745
  693    H4*    U 224           H4*        U 224  19.908  16.454   0.347
  694    H3*    U 224           H3*        U 224  19.188  19.328   0.310
  695    H2*    U 224           H2*        U 224  17.543  19.077  -1.369
  696   2HO*    U 224          2HO*        U 224  17.726  16.355  -1.701
  697    H1*    U 224           H1*        U 224  16.238  16.955  -0.193
  698    H3     U 224           H3         U 224  13.311  20.017   1.236
  699    H5     U 224           H5         U 224  16.877  21.282   3.031
  700    H6     U 224           H6         U 224  18.005  19.455   1.846
  701   1H5*    A 225          1H5*        A 225  20.752  18.728  -3.944
  702   2H5*    A 225          2H5*        A 225  20.890  20.354  -4.615
  703    H4*    A 225           H4*        A 225  18.985  18.856  -5.441
  704    H3*    A 225           H3*        A 225  18.624  21.715  -4.558
  705    H2*    A 225           H2*        A 225  16.360  21.618  -5.264
  706   2HO*    A 225          2HO*        A 225  15.996  20.237  -6.909
  707    H1*    A 225           H1*        A 225  15.898  19.142  -4.014
  708    H8     A 225           H8         A 225  18.040  21.463  -1.975
  709   1H6     A 225          1H6         A 225  12.727  23.639   0.471
  710   2H6     A 225          2H6         A 225  14.472  23.689   0.598
  711    H2     A 225           H2         A 225  11.698  20.912  -2.884
  712   1H5*    G 226          1H5*        G 226  17.598  20.634  -8.337
  713   2H5*    G 226          2H5*        G 226  17.903  21.582  -9.791
  714    H4*    G 226           H4*        G 226  15.658  20.887  -9.918
  715    H3*    G 226           H3*        G 226  15.985  23.774  -9.213
  716    H2*    G 226           H2*        G 226  13.624  24.077  -9.114
  717   2HO*    G 226          2HO*        G 226  12.653  21.646  -9.497
  718    H1*    G 226           H1*        G 226  13.253  21.869  -7.434
  719    H8     G 226           H8         G 226  16.357  23.425  -6.259
  720    H1     G 226           H1         G 226  11.114  26.752  -4.434
  721   1H2     G 226          1H2         G 226   9.470  26.071  -5.476
  722   2H2     G 226          2H2         G 226   9.507  24.789  -6.665
  723   1H5*    G 227          1H5*        G 227  14.984  24.767 -13.571
  724   2H5*    G 227          2H5*        G 227  16.398  25.733 -13.990
  725    H4*    G 227           H4*        G 227  14.299  27.032 -13.946
  726    H3*    G 227           H3*        G 227  16.582  27.780 -12.152
  727    H2*    G 227           H2*        G 227  15.370  29.672 -11.358
  728   2HO*    G 227          2HO*        G 227  13.044  29.608 -12.483
  729    H1*    G 227           H1*        G 227  13.084  28.188 -10.779
  730    H8     G 227           H8         G 227  16.531  26.642 -10.224
  731    H1     G 227           H1         G 227  13.849  29.344  -4.990
  732   1H2     G 227          1H2         G 227  12.088  30.275  -5.521
  733   2H2     G 227          2H2         G 227  11.436  30.318  -7.143
  734   1H5*    A 228          1H5*        A 228  15.009  31.549 -14.027
  735   2H5*    A 228          2H5*        A 228  16.419  32.605 -14.105
  736    H4*    A 228           H4*        A 228  14.531  33.490 -12.743
  737    H3*    A 228           H3*        A 228  17.251  33.108 -11.498
  738    H2*    A 228           H2*        A 228  16.470  34.223  -9.550
  739   2HO*    A 228          2HO*        A 228  15.245  35.717 -10.870
  740    H1*    A 228           H1*        A 228  14.070  32.719  -9.504
  741    H8     A 228           H8         A 228  16.914  30.471 -10.270
  742   1H6     A 228          1H6         A 228  17.918  30.067  -4.124
  743   2H6     A 228          2H6         A 228  18.355  29.395  -5.679
  744    H2     A 228           H2         A 228  14.954  33.300  -4.838
  745   1H5*    G 229          1H5*        G 229  16.872  37.922 -11.415
  746   2H5*    G 229          2H5*        G 229  18.604  38.222 -11.567
  747    H4*    G 229           H4*        G 229  17.515  39.267  -9.575
  748    H3*    G 229           H3*        G 229  19.867  37.417  -9.287
  749    H2*    G 229           H2*        G 229  19.932  37.876  -6.951
  750   2HO*    G 229          2HO*        G 229  18.712  39.646  -6.202
  751    H1*    G 229           H1*        G 229  17.200  37.390  -6.612
  752    H8     G 229           H8         G 229  18.336  34.906  -9.076
  753    H1     G 229           H1         G 229  20.076  33.365  -3.036
  754   1H2     G 229          1H2         G 229  19.773  34.985  -1.798
  755   2H2     G 229          2H2         G 229  19.142  36.531  -2.317
  756   1H5*    G 230          1H5*        G 230  21.398  41.459  -7.208
  757   2H5*    G 230          2H5*        G 230  23.065  41.310  -7.762
  758    H4*    G 230           H4*        G 230  22.783  41.573  -5.292
  759    H3*    G 230           H3*        G 230  24.276  39.244  -6.467
  760    H2*    G 230           H2*        G 230  24.875  38.528  -4.276
  761   2HO*    G 230          2HO*        G 230  23.447  40.419  -2.876
  762    H1*    G 230           H1*        G 230  22.253  38.685  -3.326
  763    H8     G 230           H8         G 230  21.943  37.451  -6.773
  764    H1     G 230           H1         G 230  23.955  32.854  -2.687
  765   1H2     G 230          1H2         G 230  24.500  33.716  -0.895
  766   2H2     G 230          2H2         G 230  24.423  35.429  -0.550
  767   1H5*    G 231          1H5*        G 231  27.094  41.190  -3.339
  768   2H5*    G 231          2H5*        G 231  28.624  41.102  -4.213
  769    H4*    G 231           H4*        G 231  28.757  40.140  -1.955
  770    H3*    G 231           H3*        G 231  29.291  38.385  -4.335
  771    H2*    G 231           H2*        G 231  29.897  36.599  -2.879
  772   2HO*    G 231          2HO*        G 231  29.549  37.438  -0.460
  773    H1*    G 231           H1*        G 231  27.592  36.861  -1.324
  774    H8     G 231           H8         G 231  26.536  37.526  -4.790
  775    H1     G 231           H1         G 231  27.375  31.216  -3.622
  776   1H2     G 231          1H2         G 231  28.347  30.973  -1.819
  777   2H2     G 231          2H2         G 231  28.858  32.283  -0.779
  778   1H5*    C 232          1H5*        C 232  32.552  38.134  -1.687
  779   2H5*    C 232          2H5*        C 232  34.122  38.195  -2.487
  780    H4*    C 232           H4*        C 232  34.052  36.253  -1.099
  781    H3*    C 232           H3*        C 232  33.981  35.723  -4.051
  782    H2*    C 232           H2*        C 232  34.001  33.383  -3.662
  783   2HO*    C 232          2HO*        C 232  34.085  33.927  -0.857
  784    H1*    C 232           H1*        C 232  31.990  33.547  -1.683
  785   1H4     C 232          1H4         C 232  28.955  31.785  -7.026
  786   2H4     C 232          2H4         C 232  28.846  33.468  -7.492
  787    H5     C 232           H5         C 232  29.870  35.232  -6.301
  788    H6     C 232           H6         C 232  31.265  35.821  -4.351
  789   1H5*    A 233          1H5*        A 233  37.879  33.388  -2.751
  790   2H5*    A 233          2H5*        A 233  38.889  33.867  -4.116
  791    H4*    A 233           H4*        A 233  38.797  31.429  -3.800
  792    H3*    A 233           H3*        A 233  37.794  32.620  -6.370
  793    H2*    A 233           H2*        A 233  37.433  30.443  -7.246
  794   2HO*    A 233          2HO*        A 233  38.290  29.217  -4.853
  795    H1*    A 233           H1*        A 233  36.090  29.540  -4.965
  796    H8     A 233           H8         A 233  35.075  33.055  -5.526
  797   1H6     A 233          1H6         A 233  30.891  30.927  -9.640
  798   2H6     A 233          2H6         A 233  31.408  32.340  -8.746
  799    H2     A 233           H2         A 233  33.603  27.579  -8.557
  800   1H5*    G 234          1H5*        G 234  41.024  29.719  -7.386
  801   2H5*    G 234          2H5*        G 234  41.986  30.436  -8.679
  802    H4*    G 234           H4*        G 234  41.257  28.198  -9.273
  803    H3*    G 234           H3*        G 234  40.181  30.487 -10.893
  804    H2*    G 234           H2*        G 234  39.092  28.948 -12.351
  805   2HO*    G 234          2HO*        G 234  40.886  27.455 -12.145
  806    H1*    G 234           H1*        G 234  37.912  27.533 -10.256
  807    H8     G 234           H8         G 234  37.920  31.108  -9.290
  808    H1     G 234           H1         G 234  33.180  29.630 -13.441
  809   1H2     G 234          1H2         G 234  33.497  27.742 -14.204
  810   2H2     G 234          2H2         G 234  34.847  26.711 -13.783
  811   1H    GLY  15          1H        GLY  15   6.082  -3.450   0.486
  812   1HA   GLY  15          1HA       GLY  15   5.976  -2.725  -1.689
  813   2HA   GLY  15          2HA       GLY  15   4.588  -1.771  -1.188
  814    H    ARG  16           H        ARG  16   8.144  -1.749  -0.976
  815    HA   ARG  16           HA       ARG  16   8.188   1.129  -0.748
  816   1HB   ARG  16          2HB       ARG  16   9.832  -0.235   0.458
  817   2HB   ARG  16          3HB       ARG  16  10.445  -0.857  -1.069
  818   1HG   ARG  16          2HG       ARG  16  11.110   1.434  -1.699
  819   2HG   ARG  16          3HG       ARG  16  10.573   1.995  -0.114
  820   1HD   ARG  16          2HD       ARG  16  12.552  -0.237  -0.342
  821   2HD   ARG  16          3HD       ARG  16  13.080   1.438  -0.496
  822    HE   ARG  16           HE       ARG  16  11.521   1.195   1.820
  823   1HH1  ARG  16          2HH1      ARG  16  14.604   0.180   0.560
  824   2HH1  ARG  16          1HH1      ARG  16  15.361   0.101   2.116
  825   1HH2  ARG  16          2HH2      ARG  16  12.507   1.094   3.875
  826   2HH2  ARG  16          1HH2      ARG  16  14.166   0.621   4.001
  827    H    ALA  17           H        ALA  17   9.000   2.580  -2.265
  828    HA   ALA  17           HA       ALA  17   9.711   1.600  -4.913
  829   1HB   ALA  17          1HB       ALA  17   7.469   1.764  -5.408
  830   2HB   ALA  17          2HB       ALA  17   7.214   3.117  -4.305
  831   3HB   ALA  17          3HB       ALA  17   8.038   3.376  -5.843
  832    H    ARG  18           H        ARG  18  10.755   3.253  -2.533
  833    HA   ARG  18           HA       ARG  18  11.104   5.909  -3.181
  834   1HB   ARG  18          2HB       ARG  18  12.274   4.043  -1.372
  835   2HB   ARG  18          3HB       ARG  18  13.575   4.942  -2.142
  836   1HG   ARG  18          2HG       ARG  18  11.222   6.139  -0.693
  837   2HG   ARG  18          3HG       ARG  18  12.867   6.000  -0.070
  838   1HD   ARG  18          2HD       ARG  18  12.009   7.582  -2.490
  839   2HD   ARG  18          3HD       ARG  18  12.430   8.248  -0.913
  840    HE   ARG  18           HE       ARG  18  14.608   6.762  -1.736
  841   1HH1  ARG  18          2HH1      ARG  18  12.830   9.534  -2.864
  842   2HH1  ARG  18          1HH1      ARG  18  14.200  10.260  -3.639
  843   1HH2  ARG  18          2HH2      ARG  18  16.418   7.708  -2.751
  844   2HH2  ARG  18          1HH2      ARG  18  16.239   9.220  -3.575
  845    H    GLY  19           H        GLY  19  12.325   7.050  -4.586
  846   1HA   GLY  19          1HA       GLY  19  14.193   7.404  -6.007
  847   2HA   GLY  19          2HA       GLY  19  14.417   5.663  -6.101
  848    H    LEU  20           H        LEU  20  11.428   5.411  -6.571
  849    HA   LEU  20           HA       LEU  20  11.531   6.036  -9.444
  850   1HB   LEU  20          2HB       LEU  20  10.528   3.759  -7.880
  851   2HB   LEU  20          3HB       LEU  20   9.470   4.285  -9.188
  852    HG   LEU  20           HG       LEU  20  12.245   3.990 -10.028
  853   1HD1  LEU  20          1HD1      LEU  20  12.369   1.598  -9.909
  854   2HD1  LEU  20          2HD1      LEU  20  10.783   1.508  -9.142
  855   3HD1  LEU  20          3HD1      LEU  20  12.140   2.233  -8.279
  856   1HD2  LEU  20          1HD2      LEU  20   9.522   3.163 -10.943
  857   2HD2  LEU  20          2HD2      LEU  20  10.957   2.443 -11.673
  858   3HD2  LEU  20          3HD2      LEU  20  10.713   4.188 -11.745
  859    H    CYS  21           H        CYS  21  10.202   7.634 -10.223
  860    HA   CYS  21           HA       CYS  21   8.384   8.878  -8.470
  861   1HB   CYS  21          2HB       CYS  21   9.621  10.033 -10.313
  862   2HB   CYS  21          3HB       CYS  21   8.615   9.199 -11.480
  863    H    TYR  22           H        TYR  22   6.098   8.942  -8.703
  864    HA   TYR  22           HA       TYR  22   4.933   6.570 -10.007
  865   1HB   TYR  22          2HB       TYR  22   4.507   6.136  -7.787
  866   2HB   TYR  22          3HB       TYR  22   4.434   7.840  -7.355
  867    HD1  TYR  22           HD1      TYR  22   2.548   5.354  -9.417
  868    HD2  TYR  22           HD2      TYR  22   2.370   8.722  -6.822
  869    HE1  TYR  22           HE1      TYR  22   0.091   5.252  -9.462
  870    HE2  TYR  22           HE2      TYR  22  -0.088   8.627  -6.859
  871    HH   TYR  22           HH       TYR  22  -1.874   7.759  -8.340
  872    H    THR  23           H        THR  23   4.824   9.996  -9.635
  873    HA   THR  23           HA       THR  23   2.202  10.477 -10.573
  874    HB   THR  23           HB       THR  23   4.580  12.315 -10.887
  875    HG1  THR  23           HG1      THR  23   4.356  12.831  -8.812
  876   1HG2  THR  23          1HG2      THR  23   1.746  12.547 -11.437
  877   2HG2  THR  23          2HG2      THR  23   3.065  13.642 -11.852
  878   3HG2  THR  23          3HG2      THR  23   2.282  13.761 -10.276
  879    H    CYS  24           H        CYS  24   5.395  10.272 -12.275
  880    HA   CYS  24           HA       CYS  24   3.862  10.337 -14.770
  881   1HB   CYS  24          2HB       CYS  24   5.884  11.094 -15.885
  882   2HB   CYS  24          3HB       CYS  24   5.493  12.171 -14.558
  883    H    GLY  25           H        GLY  25   6.323   8.754 -12.819
  884   1HA   GLY  25          1HA       GLY  25   6.521   6.371 -12.728
  885   2HA   GLY  25          2HA       GLY  25   5.960   6.296 -14.392
  886    H    SER  26           H        SER  26   8.440   8.478 -13.181
  887    HA   SER  26           HA       SER  26  10.335   7.233 -15.040
  888   1HB   SER  26          2HB       SER  26   9.767   9.757 -15.059
  889   2HB   SER  26          3HB       SER  26  10.779   9.849 -13.618
  890    HG   SER  26           HG       SER  26  12.426   8.786 -14.952
  891    HA   PRO  27           HA       PRO  27  12.306   5.413 -11.478
  892   1HB   PRO  27          2HB       PRO  27  14.285   4.182 -12.869
  893   2HB   PRO  27          3HB       PRO  27  12.632   3.560 -12.797
  894   1HG   PRO  27          2HG       PRO  27  13.961   5.164 -14.947
  895   2HG   PRO  27          3HG       PRO  27  12.891   3.758 -15.100
  896   1HD   PRO  27          2HD       PRO  27  12.023   6.296 -15.471
  897   2HD   PRO  27          3HD       PRO  27  10.984   5.018 -14.805
  898    H    GLY  28           H        GLY  28  13.080   7.320 -10.499
  899   1HA   GLY  28          1HA       GLY  28  15.778   7.651 -10.226
  900   2HA   GLY  28          2HA       GLY  28  15.354   8.724 -11.551
  901    H    HIS  29           H        HIS  29  13.334  10.121 -11.024
  902    HA   HIS  29           HA       HIS  29  13.906  11.432  -8.477
  903   1HB   HIS  29          2HB       HIS  29  12.755  13.349  -9.372
  904   2HB   HIS  29          3HB       HIS  29  13.863  12.750 -10.603
  905    HD1  HIS  29           HD1      HIS  29  12.881  12.399 -12.852
  906    HD2  HIS  29           HD2      HIS  29   9.980  12.444  -9.878
  907    HE1  HIS  29           HE1      HIS  29  10.678  12.271 -14.059
  908    H    TYR  30           H        TYR  30  11.652  12.673  -7.792
  909    HA   TYR  30           HA       TYR  30   9.601  10.581  -7.526
  910   1HB   TYR  30          2HB       TYR  30  11.288  11.485  -5.460
  911   2HB   TYR  30          3HB       TYR  30   9.717  12.219  -5.156
  912    HD1  TYR  30           HD1      TYR  30  11.184   8.901  -6.064
  913    HD2  TYR  30           HD2      TYR  30   8.180  11.019  -3.921
  914    HE1  TYR  30           HE1      TYR  30  10.390   6.784  -5.097
  915    HE2  TYR  30           HE2      TYR  30   7.378   8.907  -2.947
  916    HH   TYR  30           HH       TYR  30   7.750   6.721  -2.730
  917    H    GLN  31           H        GLN  31   7.584  11.646  -6.390
  918    HA   GLN  31           HA       GLN  31   6.424  13.409  -8.164
  919   1HB   GLN  31          2HB       GLN  31   5.043  12.149  -6.672
  920   2HB   GLN  31          3HB       GLN  31   5.795  12.880  -5.260
  921   1HG   GLN  31          2HG       GLN  31   4.509  14.715  -5.357
  922   2HG   GLN  31          3HG       GLN  31   4.539  14.772  -7.119
  923   1HE2  GLN  31          1HE2      GLN  31   3.359  12.498  -4.657
  924   2HE2  GLN  31          2HE2      GLN  31   1.782  12.318  -5.337
  925    H    ALA  32           H        ALA  32   8.092  14.131  -5.126
  926    HA   ALA  32           HA       ALA  32   7.573  16.875  -5.015
  927   1HB   ALA  32          1HB       ALA  32   8.688  15.299  -3.287
  928   2HB   ALA  32          2HB       ALA  32  10.189  15.752  -4.097
  929   3HB   ALA  32          3HB       ALA  32   9.179  16.993  -3.354
  930    H    GLN  33           H        GLN  33   9.707  15.061  -7.042
  931    HA   GLN  33           HA       GLN  33  10.776  17.582  -8.132
  932   1HB   GLN  33          2HB       GLN  33  12.192  14.913  -8.099
  933   2HB   GLN  33          3HB       GLN  33  12.839  16.438  -8.688
  934   1HG   GLN  33          2HG       GLN  33  12.883  17.350  -6.480
  935   2HG   GLN  33          3HG       GLN  33  12.025  15.951  -5.835
  936   1HE2  GLN  33          1HE2      GLN  33  13.159  13.825  -6.247
  937   2HE2  GLN  33          2HE2      GLN  33  14.869  13.802  -6.004
  938    H    CYS  34           H        CYS  34   8.310  15.961  -8.888
  939    HA   CYS  34           HA       CYS  34   9.059  14.747 -11.369
  940   1HB   CYS  34          2HB       CYS  34   7.181  13.918  -9.923
  941   2HB   CYS  34          3HB       CYS  34   6.278  15.367 -10.320
  942    HA   PRO  35           HA       PRO  35   8.985  18.652 -13.527
  943   1HB   PRO  35          2HB       PRO  35   9.264  17.607 -16.017
  944   2HB   PRO  35          3HB       PRO  35  10.605  17.734 -14.873
  945   1HG   PRO  35          2HG       PRO  35   8.898  15.366 -15.534
  946   2HG   PRO  35          3HG       PRO  35  10.653  15.450 -15.303
  947   1HD   PRO  35          2HD       PRO  35   8.971  14.557 -13.378
  948   2HD   PRO  35          3HD       PRO  35  10.478  15.417 -13.005
  949    H    LYS  36           H        LYS  36   6.702  16.125 -13.752
  950    HA   LYS  36           HA       LYS  36   4.987  17.630 -15.590
  951   1HB   LYS  36          2HB       LYS  36   5.439  14.869 -15.156
  952   2HB   LYS  36          3HB       LYS  36   3.784  15.195 -14.660
  953   1HG   LYS  36          2HG       LYS  36   3.304  16.173 -16.833
  954   2HG   LYS  36          3HG       LYS  36   4.975  15.903 -17.334
  955   1HD   LYS  36          2HD       LYS  36   4.694  13.524 -17.197
  956   2HD   LYS  36          3HD       LYS  36   3.091  13.708 -16.481
  957   1HE   LYS  36          2HE       LYS  36   2.146  13.860 -18.488
  958   2HE   LYS  36          3HE       LYS  36   3.256  15.141 -18.971
  959   1HZ   LYS  36          1HZ       LYS  36   4.879  13.453 -19.576
  960   2HZ   LYS  36          2HZ       LYS  36   3.436  13.231 -20.430
  961   3HZ   LYS  36          3HZ       LYS  36   3.807  12.226 -19.121
  962    H    LYS  37           H        LYS  37   5.596  17.614 -12.395
  963    HA   LYS  37           HA       LYS  37   3.197  17.353 -11.057
  964   1HB   LYS  37          2HB       LYS  37   5.688  18.895 -10.616
  965   2HB   LYS  37          3HB       LYS  37   4.280  19.423  -9.704
  966   1HG   LYS  37          2HG       LYS  37   4.439  16.595  -9.520
  967   2HG   LYS  37          3HG       LYS  37   6.031  17.267  -9.161
  968   1HD   LYS  37          2HD       LYS  37   5.121  17.408  -7.081
  969   2HD   LYS  37          3HD       LYS  37   4.552  18.950  -7.721
  970   1HE   LYS  37          2HE       LYS  37   2.784  16.708  -8.330
  971   2HE   LYS  37          3HE       LYS  37   2.980  16.996  -6.602
  972   1HZ   LYS  37          1HZ       LYS  37   1.132  18.236  -7.791
  973   2HZ   LYS  37          2HZ       LYS  37   2.346  19.191  -8.480
  974   3HZ   LYS  37          3HZ       LYS  37   2.151  19.153  -6.799
  975    H    ARG  38           H        ARG  38   4.546  20.458 -12.194
  976    HA   ARG  38           HA       ARG  38   3.552  22.404 -12.829
  977   1HB   ARG  38          2HB       ARG  38   2.283  20.360 -14.229
  978   2HB   ARG  38          3HB       ARG  38   0.961  21.327 -13.589
  979   1HG   ARG  38          2HG       ARG  38   1.373  23.031 -14.977
  980   2HG   ARG  38          3HG       ARG  38   3.122  22.893 -14.788
  981   1HD   ARG  38          2HD       ARG  38   3.336  21.457 -16.541
  982   2HD   ARG  38          3HD       ARG  38   1.742  20.745 -16.291
  983    HE   ARG  38           HE       ARG  38   2.396  22.956 -17.987
  984   1HH1  ARG  38          2HH1      ARG  38  -0.120  21.505 -16.068
  985   2HH1  ARG  38          1HH1      ARG  38  -1.407  22.229 -16.973
  986   1HH2  ARG  38          2HH2      ARG  38   0.710  23.915 -19.187
  987   2HH2  ARG  38          1HH2      ARG  38  -0.934  23.598 -18.748
  988    H    LYS  39           H        LYS  39   1.166  23.538 -12.685
  989    HA   LYS  39           HA       LYS  39   0.600  23.517  -9.822
  990   1HB   LYS  39          2HB       LYS  39  -0.318  25.438 -11.969
  991   2HB   LYS  39          3HB       LYS  39  -0.556  25.637 -10.238
  992   1HG   LYS  39          2HG       LYS  39   2.167  25.429 -11.491
  993   2HG   LYS  39          3HG       LYS  39   1.322  26.964 -11.270
  994   1HD   LYS  39          2HD       LYS  39   1.253  26.634  -8.882
  995   2HD   LYS  39          3HD       LYS  39   1.947  25.019  -9.049
  996   1HE   LYS  39          2HE       LYS  39   3.325  27.576  -9.864
  997   2HE   LYS  39          3HE       LYS  39   3.587  26.741  -8.333
  998   1HZ   LYS  39          1HZ       LYS  39   5.151  25.597  -9.387
  999   2HZ   LYS  39          2HZ       LYS  39   4.681  26.180 -10.904
 1000   3HZ   LYS  39          3HZ       LYS  39   3.925  24.814 -10.251
 1001    H    SER  40           H        SER  40  -1.327  22.969  -8.937
 1002    HA   SER  40           HA       SER  40  -3.775  22.807 -10.316
 1003   1HB   SER  40          2HB       SER  40  -2.710  20.900 -11.449
 1004   2HB   SER  40          3HB       SER  40  -2.389  20.148  -9.886
 1005    HG   SER  40           HG       SER  40  -4.267  19.254 -10.299
 1006    H    GLY  41           H        GLY  41  -5.254  23.091  -8.789
 1007   1HA   GLY  41          1HA       GLY  41  -4.587  22.317  -6.034
 1008   2HA   GLY  41          2HA       GLY  41  -5.786  23.514  -6.501
 1009    H    ASN  42           H        ASN  42  -6.644  21.842  -4.679
 1010    HA   ASN  42           HA       ASN  42  -8.842  20.549  -5.873
 1011   1HB   ASN  42          2HB       ASN  42  -8.274  18.198  -5.226
 1012   2HB   ASN  42          3HB       ASN  42  -7.292  18.831  -6.545
 1013   1HD2  ASN  42          1HD2      ASN  42  -5.201  18.498  -6.397
 1014   2HD2  ASN  42          2HD2      ASN  42  -4.318  18.195  -4.942
 1015    H    SER  43           H        SER  43 -10.206  19.428  -4.274
 1016    HA   SER  43           HA       SER  43 -11.278  19.355  -2.269
 1017   1HB   SER  43          2HB       SER  43  -8.853  19.835  -0.647
 1018   2HB   SER  43          3HB       SER  43 -10.050  18.545  -0.535
 1019    HG   SER  43           HG       SER  43  -8.113  17.672  -1.238
 1020    H    ARG  44           H        ARG  44 -11.462  20.620  -0.071
 1021    HA   ARG  44           HA       ARG  44 -10.546  23.283   0.062
 1022   1HB   ARG  44          2HB       ARG  44 -12.674  24.450  -0.425
 1023   2HB   ARG  44          3HB       ARG  44 -11.989  23.669  -1.844
 1024   1HG   ARG  44          2HG       ARG  44 -13.563  21.833  -1.620
 1025   2HG   ARG  44          3HG       ARG  44 -14.227  22.565  -0.158
 1026   1HD   ARG  44          2HD       ARG  44 -14.209  24.476  -2.301
 1027   2HD   ARG  44          3HD       ARG  44 -15.022  22.999  -2.816
 1028    HE   ARG  44           HE       ARG  44 -16.043  23.596  -0.328
 1029   1HH1  ARG  44          2HH1      ARG  44 -15.875  25.148  -3.440
 1030   2HH1  ARG  44          1HH1      ARG  44 -17.356  26.023  -3.228
 1031   1HH2  ARG  44          2HH2      ARG  44 -17.993  24.742  -0.037
 1032   2HH2  ARG  44          1HH2      ARG  44 -18.559  25.793  -1.292
 1033    H    GLU  45           H        GLU  45 -10.725  21.167   1.854
 1034    HA   GLU  45           HA       GLU  45 -12.621  22.261   3.821
 1035   1HB   GLU  45          2HB       GLU  45 -13.352  20.042   2.857
 1036   2HB   GLU  45          3HB       GLU  45 -11.921  19.334   3.593
 1037   1HG   GLU  45          2HG       GLU  45 -12.797  20.305   5.790
 1038   2HG   GLU  45          3HG       GLU  45 -14.322  20.521   4.932
 1039    H    ARG  46           H        ARG  46  -9.996  19.847   3.748
 1040    HA   ARG  46           HA       ARG  46  -8.911  21.046   6.190
 1041   1HB   ARG  46          2HB       ARG  46  -9.402  18.524   5.905
 1042   2HB   ARG  46          3HB       ARG  46  -7.940  18.496   4.928
 1043   1HG   ARG  46          2HG       ARG  46  -6.586  19.127   6.756
 1044   2HG   ARG  46          3HG       ARG  46  -7.990  19.558   7.736
 1045   1HD   ARG  46          2HD       ARG  46  -8.305  17.446   8.405
 1046   2HD   ARG  46          3HD       ARG  46  -8.050  16.802   6.784
 1047    HE   ARG  46           HE       ARG  46  -6.129  16.957   8.899
 1048   1HH1  ARG  46          2HH1      ARG  46  -6.535  16.942   5.441
 1049   2HH1  ARG  46          1HH1      ARG  46  -4.944  16.334   5.127
 1050   1HH2  ARG  46          2HH2      ARG  46  -4.032  16.155   8.497
 1051   2HH2  ARG  46          1HH2      ARG  46  -3.521  15.885   6.865
 1052    H    CYS  47           H        CYS  47  -6.388  21.039   6.373
 1053    HA   CYS  47           HA       CYS  47  -5.352  21.932   3.780
 1054   1HB   CYS  47          2HB       CYS  47  -5.646  23.813   5.339
 1055   2HB   CYS  47          3HB       CYS  47  -4.659  23.000   6.537
 1056    H    GLN  48           H        GLN  48  -3.837  20.594   3.070
 1057    HA   GLN  48           HA       GLN  48  -2.523  18.735   4.901
 1058   1HB   GLN  48          2HB       GLN  48  -3.571  18.442   2.346
 1059   2HB   GLN  48          3HB       GLN  48  -1.832  18.463   2.085
 1060   1HG   GLN  48          2HG       GLN  48  -2.054  16.776   4.212
 1061   2HG   GLN  48          3HG       GLN  48  -3.528  16.424   3.310
 1062   1HE2  GLN  48          1HE2      GLN  48  -3.262  14.723   2.073
 1063   2HE2  GLN  48          2HE2      GLN  48  -1.850  14.334   1.156
 1064    H    LEU  49           H        LEU  49  -1.780  21.546   4.853
 1065    HA   LEU  49           HA       LEU  49   1.045  21.229   4.096
 1066   1HB   LEU  49          2HB       LEU  49  -0.791  23.031   2.977
 1067   2HB   LEU  49          3HB       LEU  49   0.231  23.986   4.049
 1068    HG   LEU  49           HG       LEU  49   1.621  22.148   2.192
 1069   1HD1  LEU  49          1HD1      LEU  49  -0.105  24.406   1.301
 1070   2HD1  LEU  49          2HD1      LEU  49   0.223  22.859   0.522
 1071   3HD1  LEU  49          3HD1      LEU  49   1.439  24.134   0.493
 1072   1HD2  LEU  49          1HD2      LEU  49   2.731  23.696   3.814
 1073   2HD2  LEU  49          2HD2      LEU  49   2.096  25.045   2.872
 1074   3HD2  LEU  49          3HD2      LEU  49   3.227  23.909   2.136
 1075    H    CYS  50           H        CYS  50  -1.371  22.721   6.295
 1076    HA   CYS  50           HA       CYS  50   0.828  23.028   8.198
 1077   1HB   CYS  50          2HB       CYS  50   0.101  25.144   8.923
 1078   2HB   CYS  50          3HB       CYS  50   0.073  25.243   7.173
 1079    H    ASN  51           H        ASN  51  -1.493  21.146   7.438
 1080    HA   ASN  51           HA       ASN  51  -2.983  19.780   8.478
 1081   1HB   ASN  51          2HB       ASN  51  -0.892  20.159  10.264
 1082   2HB   ASN  51          3HB       ASN  51  -2.328  20.478  11.233
 1083   1HD2  ASN  51          1HD2      ASN  51  -2.183  18.652  12.462
 1084   2HD2  ASN  51          2HD2      ASN  51  -2.433  17.062  11.832
 1085    H    GLY  52           H        GLY  52  -3.508  22.754   8.120
 1086   1HA   GLY  52          1HA       GLY  52  -5.152  23.664  10.222
 1087   2HA   GLY  52          2HA       GLY  52  -5.198  24.242   8.563
 1088    H    MET  53           H        MET  53  -7.477  23.979  10.180
 1089    HA   MET  53           HA       MET  53  -8.898  21.832   8.751
 1090   1HB   MET  53          2HB       MET  53  -8.804  22.449  11.628
 1091   2HB   MET  53          3HB       MET  53 -10.420  22.190  10.986
 1092   1HG   MET  53          2HG       MET  53 -10.015  20.035  11.377
 1093   2HG   MET  53          3HG       MET  53  -9.062  20.104   9.896
 1094   1HE   MET  53          1HE       MET  53  -9.095  20.347  13.720
 1095   2HE   MET  53          2HE       MET  53  -8.918  18.642  13.310
 1096   3HE   MET  53          3HE       MET  53  -7.616  19.487  14.147
 1097    H    GLY  54           H        GLY  54  -9.750  23.112   7.149
 1098   1HA   GLY  54          1HA       GLY  54 -12.135  24.237   7.200
 1099   2HA   GLY  54          2HA       GLY  54 -11.192  25.541   7.906
 1100    H    HIS  55           H        HIS  55  -9.011  25.821   6.511
 1101    HA   HIS  55           HA       HIS  55  -9.971  26.612   3.891
 1102   1HB   HIS  55          2HB       HIS  55  -7.800  27.766   3.694
 1103   2HB   HIS  55          3HB       HIS  55  -8.642  28.205   5.178
 1104    HD1  HIS  55           HD1      HIS  55  -7.738  26.949   7.396
 1105    HD2  HIS  55           HD2      HIS  55  -5.267  26.835   4.057
 1106    HE1  HIS  55           HE1      HIS  55  -5.464  26.318   8.264
 1107    H    ASN  56           H        ASN  56  -7.866  26.463   2.247
 1108    HA   ASN  56           HA       ASN  56  -7.257  23.583   2.101
 1109   1HB   ASN  56          2HB       ASN  56  -8.920  24.540   0.396
 1110   2HB   ASN  56          3HB       ASN  56  -7.538  25.375  -0.306
 1111   1HD2  ASN  56          1HD2      ASN  56  -6.878  24.369  -2.050
 1112   2HD2  ASN  56          2HD2      ASN  56  -6.749  22.657  -2.256
 1113    H    ALA  57           H        ALA  57  -5.249  22.991   1.139
 1114    HA   ALA  57           HA       ALA  57  -3.044  24.454   1.984
 1115   1HB   ALA  57          1HB       ALA  57  -3.352  22.246  -0.023
 1116   2HB   ALA  57          2HB       ALA  57  -1.780  22.972   0.318
 1117   3HB   ALA  57          3HB       ALA  57  -2.683  22.178   1.608
 1118    H    LYS  58           H        LYS  58  -4.570  24.324  -1.211
 1119    HA   LYS  58           HA       LYS  58  -2.704  25.892  -2.592
 1120   1HB   LYS  58          2HB       LYS  58  -5.059  24.596  -3.223
 1121   2HB   LYS  58          3HB       LYS  58  -5.470  26.290  -3.450
 1122   1HG   LYS  58          2HG       LYS  58  -4.713  25.408  -5.533
 1123   2HG   LYS  58          3HG       LYS  58  -3.483  26.518  -4.921
 1124   1HD   LYS  58          2HD       LYS  58  -2.969  23.870  -3.947
 1125   2HD   LYS  58          3HD       LYS  58  -3.157  23.831  -5.702
 1126   1HE   LYS  58          2HE       LYS  58  -1.321  25.679  -4.180
 1127   2HE   LYS  58          3HE       LYS  58  -0.823  24.206  -5.011
 1128   1HZ   LYS  58          1HZ       LYS  58  -1.956  25.354  -7.029
 1129   2HZ   LYS  58          2HZ       LYS  58  -0.385  25.793  -6.581
 1130   3HZ   LYS  58          3HZ       LYS  58  -1.694  26.771  -6.144
 1131    H    GLN  59           H        GLN  59  -5.086  26.745  -0.267
 1132    HA   GLN  59           HA       GLN  59  -4.593  29.596  -0.819
 1133   1HB   GLN  59          2HB       GLN  59  -7.017  28.431  -1.024
 1134   2HB   GLN  59          3HB       GLN  59  -7.035  28.857   0.682
 1135   1HG   GLN  59          2HG       GLN  59  -7.193  31.060   0.271
 1136   2HG   GLN  59          3HG       GLN  59  -6.150  30.981  -1.147
 1137   1HE2  GLN  59          1HE2      GLN  59  -9.230  29.451  -0.269
 1138   2HE2  GLN  59          2HE2      GLN  59 -10.082  29.963  -1.682
 1139    H    CYS  60           H        CYS  60  -3.137  27.597   0.986
 1140    HA   CYS  60           HA       CYS  60  -3.897  28.428   3.615
 1141   1HB   CYS  60          2HB       CYS  60  -3.039  26.178   3.286
 1142   2HB   CYS  60          3HB       CYS  60  -1.545  26.795   2.609
 1143    H    ARG  61           H        ARG  61  -3.665  30.664   3.564
 1144    HA   ARG  61           HA       ARG  61  -1.191  31.752   4.268
 1145   1HB   ARG  61          2HB       ARG  61  -1.563  31.520   1.441
 1146   2HB   ARG  61          3HB       ARG  61  -1.583  33.224   1.873
 1147   1HG   ARG  61          2HG       ARG  61   0.575  31.374   2.828
 1148   2HG   ARG  61          3HG       ARG  61   0.658  32.189   1.265
 1149   1HD   ARG  61          2HD       ARG  61   0.005  34.243   2.936
 1150   2HD   ARG  61          3HD       ARG  61   1.030  33.250   3.971
 1151    HE   ARG  61           HE       ARG  61   1.843  34.771   1.663
 1152   1HH1  ARG  61          2HH1      ARG  61   2.616  32.126   3.790
 1153   2HH1  ARG  61          1HH1      ARG  61   4.314  32.175   3.446
 1154   1HH2  ARG  61          2HH2      ARG  61   4.075  34.846   1.202
 1155   2HH2  ARG  61          1HH2      ARG  61   5.143  33.723   1.975
 1156    H    LYS  62           H        LYS  62  -4.204  32.533   2.552
 1157    HA   LYS  62           HA       LYS  62  -4.469  35.173   3.422
 1158   1HB   LYS  62          2HB       LYS  62  -5.974  33.379   1.898
 1159   2HB   LYS  62          3HB       LYS  62  -7.030  33.821   3.233
 1160   1HG   LYS  62          2HG       LYS  62  -6.649  36.202   2.697
 1161   2HG   LYS  62          3HG       LYS  62  -5.688  35.703   1.302
 1162   1HD   LYS  62          2HD       LYS  62  -7.514  35.315   0.078
 1163   2HD   LYS  62          3HD       LYS  62  -8.268  34.380   1.371
 1164   1HE   LYS  62          2HE       LYS  62  -9.133  36.352   2.393
 1165   2HE   LYS  62          3HE       LYS  62  -8.184  37.391   1.330
 1166   1HZ   LYS  62          1HZ       LYS  62 -10.767  36.476   0.927
 1167   2HZ   LYS  62          2HZ       LYS  62  -9.808  35.663  -0.204
 1168   3HZ   LYS  62          3HZ       LYS  62  -9.808  37.354  -0.155
 1169    H    ARG  63           H        ARG  63  -6.593  35.731   4.793
 1170    HA   ARG  63           HA       ARG  63  -6.600  34.120   7.245
 1171   1HB   ARG  63          2HB       ARG  63  -5.043  36.206   7.298
 1172   2HB   ARG  63          3HB       ARG  63  -6.544  37.115   7.415
 1173   1HG   ARG  63          2HG       ARG  63  -6.797  36.609   9.567
 1174   2HG   ARG  63          3HG       ARG  63  -6.435  34.904   9.293
 1175   1HD   ARG  63          2HD       ARG  63  -4.185  35.183   9.662
 1176   2HD   ARG  63          3HD       ARG  63  -4.209  36.881   9.190
 1177    HE   ARG  63           HE       ARG  63  -4.652  37.438  11.362
 1178   1HH1  ARG  63          2HH1      ARG  63  -5.302  34.049  10.907
 1179   2HH1  ARG  63          1HH1      ARG  63  -5.568  33.741  12.591
 1180   1HH2  ARG  63          2HH2      ARG  63  -5.000  37.045  13.582
 1181   2HH2  ARG  63          1HH2      ARG  63  -5.397  35.445  14.111
 1182    H    ASP  64           H        ASP  64  -8.447  34.535   8.636
 1183    HA   ASP  64           HA       ASP  64 -10.667  36.006   7.462
 1184   1HB   ASP  64          2HB       ASP  64 -10.942  33.822   6.449
 1185   2HB   ASP  64          3HB       ASP  64 -10.781  33.036   8.018
  Start of MODEL   13
    1   1H5*    C 160          1H5*        C 160  26.569  30.997 -16.206
    2   2H5*    C 160          2H5*        C 160  25.593  29.762 -15.411
    3    H4*    C 160           H4*        C 160  27.484  29.871 -14.085
    4    H3*    C 160           H3*        C 160  25.311  31.557 -12.869
    5    H2*    C 160           H2*        C 160  26.718  32.014 -11.006
    6   2HO*    C 160          2HO*        C 160  28.698  30.780 -10.870
    7    H1*    C 160           H1*        C 160  28.904  32.713 -12.601
    8   1H4     C 160          1H4         C 160  26.086  38.321 -11.500
    9   2H4     C 160          2H4         C 160  24.816  37.916 -12.634
   10    H5     C 160           H5         C 160  24.639  35.826 -13.719
   11    H6     C 160           H6         C 160  25.647  33.588 -13.986
   12   1H5*    U 161          1H5*        U 161  26.653  29.021  -9.881
   13   2H5*    U 161          2H5*        U 161  25.354  28.138  -9.080
   14    H4*    U 161           H4*        U 161  26.562  29.123  -7.342
   15    H3*    U 161           H3*        U 161  24.074  30.699  -7.953
   16    H2*    U 161           H2*        U 161  24.547  32.141  -6.118
   17   2HO*    U 161          2HO*        U 161  26.722  31.396  -5.021
   18    H1*    U 161           H1*        U 161  27.203  32.543  -6.899
   19    H3     U 161           H3         U 161  25.146  36.505  -7.772
   20    H5     U 161           H5         U 161  24.038  34.038 -10.969
   21    H6     U 161           H6         U 161  25.089  32.176  -9.767
   22   1H5*    G 162          1H5*        G 162  24.383  29.777  -3.961
   23   2H5*    G 162          2H5*        G 162  22.957  29.094  -3.180
   24    H4*    G 162           H4*        G 162  23.667  30.836  -1.780
   25    H3*    G 162           H3*        G 162  21.286  31.611  -3.435
   26    H2*    G 162           H2*        G 162  21.194  33.721  -2.333
   27   2HO*    G 162          2HO*        G 162  23.382  33.594  -0.768
   28    H1*    G 162           H1*        G 162  23.904  34.248  -2.747
   29    H8     G 162           H8         G 162  22.605  32.484  -5.746
   30    H1     G 162           H1         G 162  21.167  38.794  -5.690
   31   1H2     G 162          1H2         G 162  21.599  39.582  -3.834
   32   2H2     G 162          2H2         G 162  22.253  38.670  -2.493
   33   1H5*    C 163          1H5*        C 163  20.533  32.590   0.382
   34   2H5*    C 163          2H5*        C 163  19.011  32.034   1.077
   35    H4*    C 163           H4*        C 163  19.045  34.332   1.484
   36    H3*    C 163           H3*        C 163  17.313  33.689  -0.889
   37    H2*    C 163           H2*        C 163  16.686  35.974  -1.042
   38   2HO*    C 163          2HO*        C 163  17.234  37.333   0.748
   39    H1*    C 163           H1*        C 163  19.315  36.907  -0.846
   40   1H4     C 163          1H4         C 163  18.287  36.538  -7.132
   41   2H4     C 163          2H4         C 163  18.582  34.815  -7.075
   42    H5     C 163           H5         C 163  18.947  33.608  -5.079
   43    H6     C 163           H6         C 163  19.121  33.759  -2.619
   44   1H5*    C 164          1H5*        C 164  15.235  36.196   1.470
   45   2H5*    C 164          2H5*        C 164  13.656  35.585   1.962
   46    H4*    C 164           H4*        C 164  13.194  37.709   1.149
   47    H3*    C 164           H3*        C 164  12.616  35.650  -0.967
   48    H2*    C 164           H2*        C 164  11.791  37.359  -2.396
   49   2HO*    C 164          2HO*        C 164  11.497  39.472  -1.428
   50    H1*    C 164           H1*        C 164  13.991  39.033  -1.981
   51   1H4     C 164          1H4         C 164  15.549  35.789  -7.246
   52   2H4     C 164          2H4         C 164  15.985  34.406  -6.266
   53    H5     C 164           H5         C 164  15.677  34.304  -3.926
   54    H6     C 164           H6         C 164  14.868  35.513  -1.932
   55   1H5*    C 165          1H5*        C 165   9.528  37.996  -0.608
   56   2H5*    C 165          2H5*        C 165   7.880  37.370  -0.548
   57    H4*    C 165           H4*        C 165   7.985  38.886  -2.363
   58    H3*    C 165           H3*        C 165   7.943  36.006  -3.251
   59    H2*    C 165           H2*        C 165   7.762  36.732  -5.500
   60   2HO*    C 165          2HO*        C 165   7.000  38.805  -5.845
   61    H1*    C 165           H1*        C 165   9.777  38.705  -5.162
   62   1H4     C 165          1H4         C 165  12.748  33.866  -8.080
   63   2H4     C 165          2H4         C 165  12.859  33.023  -6.551
   64    H5     C 165           H5         C 165  11.874  33.794  -4.548
   65    H6     C 165           H6         C 165  10.526  35.583  -3.508
   66   1H5*    U 166          1H5*        U 166   4.629  38.102  -5.031
   67   2H5*    U 166          2H5*        U 166   3.142  37.174  -4.839
   68    H4*    U 166           H4*        U 166   3.271  37.815  -7.112
   69    H3*    U 166           H3*        U 166   3.834  34.916  -6.620
   70    H2*    U 166           H2*        U 166   4.145  34.526  -8.939
   71   2HO*    U 166          2HO*        U 166   3.748  36.577 -10.283
   72    H1*    U 166           H1*        U 166   5.822  36.780  -9.245
   73    H3     U 166           H3         U 166   8.394  33.055  -9.970
   74    H5     U 166           H5         U 166   8.272  33.509  -5.809
   75    H6     U 166           H6         U 166   6.570  35.243  -6.146
   76   1H5*    C 167          1H5*        C 167   0.307  34.741  -9.457
   77   2H5*    C 167          2H5*        C 167  -0.575  33.291  -8.978
   78    H4*    C 167           H4*        C 167   0.204  33.217 -11.311
   79    H3*    C 167           H3*        C 167   1.193  31.145  -9.368
   80    H2*    C 167           H2*        C 167   2.300  30.019 -11.140
   81   2HO*    C 167          2HO*        C 167   1.875  31.217 -13.324
   82    H1*    C 167           H1*        C 167   3.420  32.397 -12.160
   83   1H4     C 167          1H4         C 167   8.058  29.834  -8.596
   84   2H4     C 167          2H4         C 167   7.309  30.502  -7.162
   85    H5     C 167           H5         C 167   5.232  31.626  -7.165
   86    H6     C 167           H6         C 167   3.344  32.395  -8.557
   87   1H5*    A 168          1H5*        A 168  -4.071  29.320 -11.263
   88   2H5*    A 168          2H5*        A 168  -3.847  30.771 -10.286
   89    H4*    A 168           H4*        A 168  -3.748  28.541  -8.524
   90    H3*    A 168           H3*        A 168  -5.988  28.346 -10.545
   91    H2*    A 168           H2*        A 168  -7.407  27.615  -8.849
   92   2HO*    A 168          2HO*        A 168  -6.384  26.619  -6.984
   93    H1*    A 168           H1*        A 168  -5.882  29.211  -6.883
   94    H8     A 168           H8         A 168  -8.618  29.294  -9.541
   95   1H6     A 168          1H6         A 168 -11.717  32.982  -5.574
   96   2H6     A 168          2H6         A 168 -11.824  32.139  -7.102
   97    H2     A 168           H2         A 168  -7.690  32.186  -3.874
   98   1H5*    U 169          1H5*        U 169  -5.203  28.398 -12.630
   99   2H5*    U 169          2H5*        U 169  -5.625  27.217 -13.870
  100    H4*    U 169           H4*        U 169  -2.979  28.618 -13.475
  101    H3*    U 169           H3*        U 169  -5.200  28.901 -15.435
  102    H2*    U 169           H2*        U 169  -3.701  29.164 -17.265
  103   2HO*    U 169          2HO*        U 169  -1.386  28.727 -15.792
  104    H1*    U 169           H1*        U 169  -2.228  26.893 -16.657
  105    H3     U 169           H3         U 169  -4.857  25.965 -20.308
  106    H5     U 169           H5         U 169  -7.241  25.111 -16.972
  107    H6     U 169           H6         U 169  -5.504  26.151 -15.588
  108   1H5*    C 170          1H5*        C 170  -6.097  30.531 -13.781
  109   2H5*    C 170          2H5*        C 170  -7.447  31.607 -14.139
  110    H4*    C 170           H4*        C 170  -7.153  31.689 -11.807
  111    H3*    C 170           H3*        C 170  -6.033  34.130 -13.167
  112    H2*    C 170           H2*        C 170  -5.590  35.086 -11.036
  113   2HO*    C 170          2HO*        C 170  -7.352  34.412  -9.880
  114    H1*    C 170           H1*        C 170  -4.373  32.746 -10.066
  115   1H4     C 170          1H4         C 170   0.503  36.340 -12.080
  116   2H4     C 170          2H4         C 170   0.194  35.823 -13.723
  117    H5     C 170           H5         C 170  -1.641  34.479 -14.357
  118    H6     C 170           H6         C 170  -3.652  33.287 -13.562
  119   1H5*    C 171          1H5*        C 171  -9.591  37.120 -13.699
  120   2H5*    C 171          2H5*        C 171  -8.100  38.042 -13.892
  121    H4*    C 171           H4*        C 171  -9.408  37.074 -11.478
  122    H3*    C 171           H3*        C 171  -7.350  39.182 -12.135
  123    H2*    C 171           H2*        C 171  -6.931  39.425  -9.817
  124   2HO*    C 171          2HO*        C 171  -8.483  38.499  -8.368
  125    H1*    C 171           H1*        C 171  -6.942  36.604  -9.401
  126   1H4     C 171          1H4         C 171  -0.803  38.442  -9.411
  127   2H4     C 171          2H4         C 171  -0.770  38.151 -11.136
  128    H5     C 171           H5         C 171  -2.678  37.604 -12.416
  129    H6     C 171           H6         C 171  -5.112  37.194 -12.354
  130   1H5*    G 172          1H5*        G 172 -10.730  42.173 -10.811
  131   2H5*    G 172          2H5*        G 172 -10.548  43.414 -12.050
  132    H4*    G 172           H4*        G 172 -10.084  44.363  -9.894
  133    H3*    G 172           H3*        G 172  -7.729  44.088 -11.739
  134    H2*    G 172           H2*        G 172  -6.357  45.224 -10.156
  135   2HO*    G 172          2HO*        G 172  -8.420  45.410  -8.260
  136    H1*    G 172           H1*        G 172  -7.172  43.604  -8.033
  137    H8     G 172           H8         G 172  -6.863  41.704 -11.265
  138    H1     G 172           H1         G 172  -1.320  42.213  -7.961
  139   1H2     G 172          1H2         G 172  -1.574  43.523  -6.389
  140   2H2     G 172          2H2         G 172  -3.065  44.359  -6.021
  141   1H5*    U 173          1H5*        U 173  -8.028  48.079 -10.359
  142   2H5*    U 173          2H5*        U 173  -7.968  49.249 -11.677
  143    H4*    U 173           H4*        U 173  -6.440  50.025 -10.077
  144    H3*    U 173           H3*        U 173  -5.105  48.723 -12.418
  145    H2*    U 173           H2*        U 173  -2.957  49.151 -11.496
  146   2HO*    U 173          2HO*        U 173  -3.480  50.269  -9.153
  147    H1*    U 173           H1*        U 173  -3.695  48.150  -8.961
  148    H3     U 173           H3         U 173  -0.599  45.231 -10.624
  149    H5     U 173           H5         U 173  -4.193  44.152 -12.482
  150    H6     U 173           H6         U 173  -5.185  46.176 -11.518
  151   1H5*    C 174          1H5*        C 174  -3.080  52.521 -12.125
  152   2H5*    C 174          2H5*        C 174  -3.068  53.253 -13.730
  153    H4*    C 174           H4*        C 174  -0.825  53.185 -12.963
  154    H3*    C 174           H3*        C 174  -1.450  51.194 -15.118
  155    H2*    C 174           H2*        C 174   0.808  50.467 -15.145
  156   2HO*    C 174          2HO*        C 174   2.176  51.789 -13.495
  157    H1*    C 174           H1*        C 174   0.911  50.323 -12.307
  158   1H4     C 174          1H4         C 174   0.132  44.284 -14.240
  159   2H4     C 174          2H4         C 174  -1.583  44.578 -14.418
  160    H5     C 174           H5         C 174  -2.591  46.697 -14.141
  161    H6     C 174           H6         C 174  -2.195  49.078 -13.620
  162   1H5*    U 175          1H5*        U 175  -2.448  55.497 -18.180
  163   2H5*    U 175          2H5*        U 175  -1.796  54.157 -19.123
  164    H4*    U 175           H4*        U 175  -1.074  56.064 -20.249
  165    H3*    U 175           H3*        U 175   1.108  54.912 -18.545
  166    H2*    U 175           H2*        U 175   2.615  56.591 -19.272
  167   2HO*    U 175          2HO*        U 175   1.063  58.075 -20.888
  168    H1*    U 175           H1*        U 175   0.673  58.645 -18.907
  169    H3     U 175           H3         U 175   4.132  59.527 -16.033
  170    H5     U 175           H5         U 175   1.806  56.636 -14.093
  171    H6     U 175           H6         U 175   0.542  56.394 -16.180
  172   1H5*    C 176          1H5*        C 176   2.209  52.262 -18.809
  173   2H5*    C 176          2H5*        C 176   2.577  53.417 -17.527
  174    H4*    C 176           H4*        C 176   5.043  53.087 -18.210
  175    H3*    C 176           H3*        C 176   3.763  50.927 -19.825
  176    H2*    C 176           H2*        C 176   5.454  49.365 -19.226
  177   2HO*    C 176          2HO*        C 176   7.227  50.705 -19.190
  178    H1*    C 176           H1*        C 176   5.239  49.857 -16.503
  179   1H4     C 176          1H4         C 176   1.175  45.065 -17.787
  180   2H4     C 176          2H4         C 176  -0.107  46.252 -17.882
  181    H5     C 176           H5         C 176   0.251  48.585 -17.794
  182    H6     C 176           H6         C 176   1.943  50.371 -17.591
  183   1H5*    G 177          1H5*        G 177   8.295  50.598 -21.282
  184   2H5*    G 177          2H5*        G 177   7.859  50.657 -22.990
  185    H4*    G 177           H4*        G 177   9.298  48.732 -22.371
  186    H3*    G 177           H3*        G 177   6.612  48.295 -23.644
  187    H2*    G 177           H2*        G 177   7.043  45.954 -23.749
  188   2HO*    G 177          2HO*        G 177   9.547  46.412 -22.461
  189    H1*    G 177           H1*        G 177   7.799  45.799 -21.067
  190    H8     G 177           H8         G 177   5.043  48.244 -21.195
  191    H1     G 177           H1         G 177   2.959  42.130 -21.589
  192   1H2     G 177          1H2         G 177   4.562  40.876 -21.919
  193   2H2     G 177          2H2         G 177   6.224  41.402 -22.067
  194   1H5*    C 178          1H5*        C 178   9.480  46.345 -26.219
  195   2H5*    C 178          2H5*        C 178   9.014  46.507 -27.912
  196    H4*    C 178           H4*        C 178   9.217  44.167 -27.245
  197    H3*    C 178           H3*        C 178   6.501  45.167 -28.073
  198    H2*    C 178           H2*        C 178   5.657  42.951 -27.929
  199   2HO*    C 178          2HO*        C 178   8.192  41.982 -27.111
  200    H1*    C 178           H1*        C 178   6.847  42.494 -25.416
  201   1H4     C 178          1H4         C 178   0.820  44.159 -24.100
  202   2H4     C 178          2H4         C 178   1.276  45.843 -24.224
  203    H5     C 178           H5         C 178   3.413  46.581 -24.908
  204    H6     C 178           H6         C 178   5.661  45.876 -25.649
  205   1H5*    U 179          1H5*        U 179   7.158  41.890 -30.999
  206   2H5*    U 179          2H5*        U 179   6.454  42.500 -32.496
  207    H4*    U 179           H4*        U 179   5.424  40.399 -31.747
  208    H3*    U 179           H3*        U 179   3.703  42.864 -31.930
  209    H2*    U 179           H2*        U 179   1.792  41.543 -31.454
  210   2HO*    U 179          2HO*        U 179   2.812  39.101 -31.126
  211    H1*    U 179           H1*        U 179   3.082  40.190 -29.327
  212    H3     U 179           H3         U 179  -0.377  42.742 -27.655
  213    H5     U 179           H5         U 179   2.945  45.286 -27.822
  214    H6     U 179           H6         U 179   4.099  43.534 -29.091
  215   1H5*    U 180          1H5*        U 180   2.097  39.907 -34.085
  216   2H5*    U 180          2H5*        U 180   1.389  40.240 -35.667
  217    H4*    U 180           H4*        U 180  -0.288  39.226 -34.324
  218    H3*    U 180           H3*        U 180  -0.691  42.151 -34.837
  219    H2*    U 180           H2*        U 180  -2.726  42.130 -33.619
  220   2HO*    U 180          2HO*        U 180  -3.372  40.086 -34.414
  221    H1*    U 180           H1*        U 180  -1.583  40.651 -31.483
  222    H3     U 180           H3         U 180  -2.541  44.635 -29.543
  223    H5     U 180           H5         U 180   0.772  45.466 -31.965
  224    H6     U 180           H6         U 180   0.558  43.196 -32.867
  225   1H5*    A 181          1H5*        A 181  -3.439  40.603 -38.576
  226   2H5*    A 181          2H5*        A 181  -3.343  42.121 -39.468
  227    H4*    A 181           H4*        A 181  -5.607  41.489 -38.528
  228    H3*    A 181           H3*        A 181  -4.325  44.169 -38.056
  229    H2*    A 181           H2*        A 181  -6.290  44.906 -36.946
  230   2HO*    A 181          2HO*        A 181  -7.776  43.899 -38.304
  231    H1*    A 181           H1*        A 181  -6.476  42.616 -35.350
  232    H8     A 181           H8         A 181  -2.911  43.662 -35.835
  233   1H6     A 181          1H6         A 181  -3.672  47.355 -30.862
  234   2H6     A 181          2H6         A 181  -2.492  46.714 -31.984
  235    H2     A 181           H2         A 181  -7.644  45.721 -32.000
  236   1H5*    U 182          1H5*        U 182  -3.330  44.342 -40.298
  237   2H5*    U 182          2H5*        U 182  -2.956  45.889 -41.059
  238    H4*    U 182           H4*        U 182  -3.022  43.160 -42.207
  239    H3*    U 182           H3*        U 182  -1.307  45.606 -42.460
  240    H2*    U 182           H2*        U 182  -0.597  44.932 -44.624
  241   2HO*    U 182          2HO*        U 182  -0.477  42.718 -44.118
  242    H1*    U 182           H1*        U 182  -3.173  44.432 -45.546
  243    H3     U 182           H3         U 182  -1.891  48.303 -47.586
  244    H5     U 182           H5         U 182  -3.144  49.487 -43.769
  245    H6     U 182           H6         U 182  -3.302  47.110 -43.190
  246   1H5*    U 183          1H5*        U 183   2.893  42.898 -40.312
  247   2H5*    U 183          2H5*        U 183   1.890  43.497 -38.991
  248    H4*    U 183           H4*        U 183   4.009  44.491 -38.719
  249    H3*    U 183           H3*        U 183   1.989  46.410 -39.860
  250    H2*    U 183           H2*        U 183   3.586  48.158 -39.696
  251   2HO*    U 183          2HO*        U 183   5.718  47.316 -38.666
  252    H1*    U 183           H1*        U 183   5.641  46.567 -40.822
  253    H3     U 183           H3         U 183   4.956  49.822 -43.918
  254    H5     U 183           H5         U 183   1.697  47.238 -44.407
  255    H6     U 183           H6         U 183   2.456  46.059 -42.395
  256   1H5*    C 184          1H5*        C 184  -0.913  47.064 -35.403
  257   2H5*    C 184          2H5*        C 184  -0.182  48.616 -35.816
  258    H4*    C 184           H4*        C 184  -0.037  47.042 -33.292
  259    H3*    C 184           H3*        C 184  -0.436  49.933 -34.035
  260    H2*    C 184           H2*        C 184   0.452  50.609 -32.002
  261   2HO*    C 184          2HO*        C 184  -0.626  49.453 -30.505
  262    H1*    C 184           H1*        C 184   2.111  48.150 -31.908
  263   1H4     C 184          1H4         C 184   5.647  53.704 -33.118
  264   2H4     C 184          2H4         C 184   6.525  52.817 -31.893
  265    H5     C 184           H5         C 184   5.799  50.761 -30.984
  266    H6     C 184           H6         C 184   4.035  49.033 -31.027
  267   1H5*    G 185          1H5*        G 185  -3.430  52.424 -31.035
  268   2H5*    G 185          2H5*        G 185  -1.910  52.399 -31.929
  269    H4*    G 185           H4*        G 185  -1.672  51.262 -29.242
  270    H3*    G 185           H3*        G 185  -2.804  54.030 -29.529
  271    H2*    G 185           H2*        G 185  -1.448  54.773 -27.716
  272   2HO*    G 185          2HO*        G 185  -0.359  53.142 -26.491
  273    H1*    G 185           H1*        G 185   0.883  53.673 -28.783
  274    H8     G 185           H8         G 185   1.484  56.203 -28.671
  275    H1     G 185           H1         G 185  -2.464  57.443 -33.647
  276   1H2     G 185          1H2         G 185  -3.615  55.779 -34.044
  277   2H2     G 185          2H2         G 185  -3.525  54.272 -33.160
  278   1H5*    G 186          1H5*        G 186  -2.739  54.313 -26.028
  279   2H5*    G 186          2H5*        G 186  -3.190  53.349 -24.621
  280    H4*    G 186           H4*        G 186  -3.286  55.627 -23.977
  281    H3*    G 186           H3*        G 186  -5.960  54.319 -24.305
  282    H2*    G 186           H2*        G 186  -7.062  56.318 -23.625
  283   2HO*    G 186          2HO*        G 186  -5.853  57.525 -22.286
  284    H1*    G 186           H1*        G 186  -5.643  57.914 -25.420
  285    H8     G 186           H8         G 186  -7.012  54.370 -26.007
  286    H1     G 186           H1         G 186 -10.158  59.134 -29.054
  287   1H2     G 186          1H2         G 186  -9.292  60.945 -28.581
  288   2H2     G 186          2H2         G 186  -7.918  61.142 -27.515
  289   1H5*    G 187          1H5*        G 187  -7.254  51.617 -21.609
  290   2H5*    G 187          2H5*        G 187  -6.218  51.769 -23.028
  291    H4*    G 187           H4*        G 187  -9.242  51.907 -23.033
  292    H3*    G 187           H3*        G 187  -7.356  49.635 -23.497
  293    H2*    G 187           H2*        G 187  -8.686  48.819 -25.298
  294   2HO*    G 187          2HO*        G 187 -10.777  49.634 -25.487
  295    H1*    G 187           H1*        G 187  -8.789  51.298 -26.572
  296    H8     G 187           H8         G 187  -5.406  51.105 -25.146
  297    H1     G 187           H1         G 187  -6.041  47.493 -30.478
  298   1H2     G 187          1H2         G 187  -8.038  47.326 -30.964
  299   2H2     G 187          2H2         G 187  -9.346  48.056 -30.060
  300   1H5*    G 188          1H5*        G 188 -11.055  47.842 -24.280
  301   2H5*    G 188          2H5*        G 188 -11.282  46.752 -22.912
  302    H4*    G 188           H4*        G 188 -11.797  45.423 -24.733
  303    H3*    G 188           H3*        G 188  -8.944  44.938 -23.919
  304    H2*    G 188           H2*        G 188  -8.771  43.233 -25.574
  305   2HO*    G 188          2HO*        G 188 -10.667  42.346 -26.270
  306    H1*    G 188           H1*        G 188  -9.826  44.858 -27.590
  307    H8     G 188           H8         G 188  -7.726  47.086 -25.557
  308    H1     G 188           H1         G 188  -4.225  43.268 -29.438
  309   1H2     G 188          1H2         G 188  -5.431  41.786 -30.215
  310   2H2     G 188          2H2         G 188  -7.135  41.605 -29.868
  311   1H5*    A 189          1H5*        A 189 -10.497  40.683 -23.953
  312   2H5*    A 189          2H5*        A 189  -9.604  40.020 -22.584
  313    H4*    A 189           H4*        A 189  -9.187  38.898 -24.783
  314    H3*    A 189           H3*        A 189  -6.931  40.035 -23.148
  315    H2*    A 189           H2*        A 189  -5.372  39.098 -24.684
  316   2HO*    A 189          2HO*        A 189  -6.971  38.011 -26.533
  317    H1*    A 189           H1*        A 189  -6.733  40.101 -26.922
  318    H8     A 189           H8         A 189  -6.824  42.642 -24.212
  319   1H6     A 189          1H6         A 189  -1.209  44.532 -26.175
  320   2H6     A 189          2H6         A 189  -2.547  44.924 -25.119
  321    H2     A 189           H2         A 189  -2.199  40.728 -28.247
  322   1H5*    G 190          1H5*        G 190  -5.872  35.732 -23.886
  323   2H5*    G 190          2H5*        G 190  -5.458  35.151 -22.273
  324    H4*    G 190           H4*        G 190  -3.709  34.513 -23.757
  325    H3*    G 190           H3*        G 190  -2.983  36.726 -21.858
  326    H2*    G 190           H2*        G 190  -0.740  36.672 -22.660
  327   2HO*    G 190          2HO*        G 190  -0.981  34.833 -24.635
  328    H1*    G 190           H1*        G 190  -1.514  36.789 -25.339
  329    H8     G 190           H8         G 190  -3.848  38.922 -23.401
  330    H1     G 190           H1         G 190   1.809  41.820 -24.617
  331   1H2     G 190          1H2         G 190   3.149  40.434 -25.351
  332   2H2     G 190          2H2         G 190   2.792  38.740 -25.598
  333   1H5*    C 191          1H5*        C 191  -0.105  33.518 -20.969
  334   2H5*    C 191          2H5*        C 191   0.519  33.745 -19.335
  335    H4*    C 191           H4*        C 191   2.204  34.005 -21.164
  336    H3*    C 191           H3*        C 191   1.722  36.207 -19.169
  337    H2*    C 191           H2*        C 191   3.559  37.406 -20.087
  338   2HO*    C 191          2HO*        C 191   4.216  35.703 -22.115
  339    H1*    C 191           H1*        C 191   2.677  37.028 -22.732
  340   1H4     C 191          1H4         C 191   0.571  42.804 -20.917
  341   2H4     C 191          2H4         C 191  -0.930  42.048 -20.432
  342    H5     C 191           H5         C 191  -1.284  39.713 -20.420
  343    H6     C 191           H6         C 191  -0.273  37.506 -20.873
  344   1H5*    G 192          1H5*        G 192   5.839  35.614 -19.253
  345   2H5*    G 192          2H5*        G 192   6.381  35.140 -17.643
  346    H4*    G 192           H4*        G 192   7.883  36.796 -18.301
  347    H3*    G 192           H3*        G 192   5.795  37.915 -16.451
  348    H2*    G 192           H2*        G 192   6.908  40.022 -16.476
  349   2HO*    G 192          2HO*        G 192   8.845  39.292 -18.325
  350    H1*    G 192           H1*        G 192   7.062  40.098 -19.262
  351    H8     G 192           H8         G 192   3.806  38.559 -18.468
  352    H1     G 192           H1         G 192   3.768  44.987 -17.712
  353   1H2     G 192          1H2         G 192   5.702  45.699 -17.780
  354   2H2     G 192          2H2         G 192   7.123  44.704 -18.008
  355   1H5*    G 193          1H5*        G 193   9.476  39.051 -15.169
  356   2H5*    G 193          2H5*        G 193   9.804  38.852 -13.448
  357    H4*    G 193           H4*        G 193  10.302  41.102 -14.011
  358    H3*    G 193           H3*        G 193   7.768  40.777 -12.429
  359    H2*    G 193           H2*        G 193   7.538  43.147 -12.319
  360   2HO*    G 193          2HO*        G 193   9.555  43.963 -12.208
  361    H1*    G 193           H1*        G 193   7.904  43.483 -15.064
  362    H8     G 193           H8         G 193   5.976  40.371 -14.739
  363    H1     G 193           H1         G 193   2.327  45.636 -13.815
  364   1H2     G 193          1H2         G 193   3.543  47.288 -13.599
  365   2H2     G 193          2H2         G 193   5.291  47.251 -13.659
  366   1H5*    A 194          1H5*        A 194   9.711  43.993  -9.924
  367   2H5*    A 194          2H5*        A 194  10.070  42.948  -8.549
  368    H4*    A 194           H4*        A 194   9.096  44.823  -7.584
  369    H3*    A 194           H3*        A 194   7.140  42.578  -7.826
  370    H2*    A 194           H2*        A 194   5.400  43.899  -6.881
  371   2HO*    A 194          2HO*        A 194   6.815  46.256  -6.689
  372    H1*    A 194           H1*        A 194   5.894  46.057  -8.607
  373    H8     A 194           H8         A 194   6.214  42.649 -10.199
  374   1H6     A 194          1H6         A 194   0.169  43.193 -11.657
  375   2H6     A 194          2H6         A 194   1.601  42.215 -11.889
  376    H2     A 194           H2         A 194   1.274  46.592  -9.017
  377   1H5*    C 195          1H5*        C 195   6.735  43.543  -3.566
  378   2H5*    C 195          2H5*        C 195   6.375  42.025  -2.745
  379    H4*    C 195           H4*        C 195   4.574  43.771  -2.652
  380    H3*    C 195           H3*        C 195   3.993  41.015  -3.740
  381    H2*    C 195           H2*        C 195   1.695  41.572  -3.773
  382   2HO*    C 195          2HO*        C 195   1.275  43.805  -2.742
  383    H1*    C 195           H1*        C 195   2.240  44.187  -4.805
  384   1H4     C 195          1H4         C 195  -0.051  40.749  -9.699
  385   2H4     C 195          2H4         C 195   1.584  40.228 -10.042
  386    H5     C 195           H5         C 195   3.438  40.721  -8.666
  387    H6     C 195           H6         C 195   4.189  41.844  -6.599
  388   1H5*    G 196          1H5*        G 196   2.681  40.096   0.687
  389   2H5*    G 196          2H5*        G 196   3.414  38.507   0.898
  390    H4*    G 196           H4*        G 196   1.049  38.280   1.120
  391    H3*    G 196           H3*        G 196   2.237  37.093  -1.360
  392    H2*    G 196           H2*        G 196   0.101  36.299  -2.053
  393   2HO*    G 196          2HO*        G 196  -1.649  37.011  -0.358
  394    H1*    G 196           H1*        G 196  -1.120  38.797  -1.632
  395    H8     G 196           H8         G 196   2.329  39.029  -3.119
  396    H1     G 196           H1         G 196  -2.384  38.258  -7.487
  397   1H2     G 196          1H2         G 196  -4.158  37.845  -6.520
  398   2H2     G 196          2H2         G 196  -4.341  37.726  -4.785
  399   1H5*    A 197          1H5*        A 197   3.598  35.881   3.124
  400   2H5*    A 197          2H5*        A 197   4.835  34.729   2.620
  401    H4*    A 197           H4*        A 197   4.151  34.129   4.810
  402    H3*    A 197           H3*        A 197   3.163  32.277   2.665
  403    H2*    A 197           H2*        A 197   1.901  31.079   4.165
  404   2HO*    A 197          2HO*        A 197   2.971  31.644   6.544
  405    H1*    A 197           H1*        A 197   1.927  33.422   6.036
  406    H8     A 197           H8         A 197  -0.238  32.807   2.954
  407   1H6     A 197          1H6         A 197  -4.888  31.801   6.993
  408   2H6     A 197          2H6         A 197  -4.490  31.941   5.296
  409    H2     A 197           H2         A 197  -1.140  32.392   9.307
  410   1H5*    U 198          1H5*        U 198   7.834  32.874   3.670
  411   2H5*    U 198          2H5*        U 198   8.910  31.499   3.918
  412    H4*    U 198           H4*        U 198   6.415  31.700   5.560
  413    H3*    U 198           H3*        U 198   8.546  33.696   5.669
  414    H2*    U 198           H2*        U 198   9.632  32.644   7.398
  415   2HO*    U 198          2HO*        U 198   8.224  34.276   8.327
  416    H1*    U 198           H1*        U 198   7.051  31.047   7.842
  417    H3     U 198           H3         U 198   8.587  27.711  10.407
  418    H5     U 198           H5         U 198  12.108  29.639   9.213
  419    H6     U 198           H6         U 198  10.718  31.101   7.819
  420   1H5*    G 199          1H5*        G 199   8.000  36.353   3.974
  421   2H5*    G 199          2H5*        G 199   9.466  35.644   4.652
  422    H4*    G 199           H4*        G 199   9.430  38.159   4.066
  423    H3*    G 199           H3*        G 199  10.576  36.931   6.551
  424    H2*    G 199           H2*        G 199  11.272  39.070   7.322
  425   2HO*    G 199          2HO*        G 199  10.823  40.865   5.731
  426    H1*    G 199           H1*        G 199   8.808  40.265   6.925
  427    H8     G 199           H8         G 199   9.234  36.615   8.036
  428    H1     G 199           H1         G 199   7.639  40.794  12.714
  429   1H2     G 199          1H2         G 199   7.551  42.700  11.933
  430   2H2     G 199          2H2         G 199   7.863  43.107  10.260
  431   1H5*    A 200          1H5*        A 200  11.811  37.299   8.071
  432   2H5*    A 200          2H5*        A 200  13.541  37.448   8.382
  433    H4*    A 200           H4*        A 200  12.727  35.858   9.917
  434    H3*    A 200           H3*        A 200  14.311  34.691   7.673
  435    H2*    A 200           H2*        A 200  13.978  32.475   8.477
  436   2HO*    A 200          2HO*        A 200  12.276  33.166  10.553
  437    H1*    A 200           H1*        A 200  11.252  32.660   8.615
  438    H8     A 200           H8         A 200  11.562  34.887   5.849
  439   1H6     A 200          1H6         A 200  13.038  30.094   2.133
  440   2H6     A 200          2H6         A 200  12.543  31.773   2.154
  441    H2     A 200           H2         A 200  13.370  28.737   6.351
  442   1H5*    C 201          1H5*        C 201  17.892  33.354  10.820
  443   2H5*    C 201          2H5*        C 201  17.713  31.856   9.909
  444    H4*    C 201           H4*        C 201  15.515  33.433  11.263
  445    H3*    C 201           H3*        C 201  16.908  30.848  11.944
  446    H2*    C 201           H2*        C 201  14.907  30.096  12.994
  447   2HO*    C 201          2HO*        C 201  13.253  31.672  13.338
  448    H1*    C 201           H1*        C 201  13.322  30.901  10.792
  449   1H4     C 201          1H4         C 201  14.357  24.587  10.234
  450   2H4     C 201          2H4         C 201  15.650  24.970   9.121
  451    H5     C 201           H5         C 201  16.415  27.164   8.697
  452    H6     C 201           H6         C 201  16.123  29.555   9.241
  453   1H5*    C 202          1H5*        C 202  14.918  32.591  15.052
  454   2H5*    C 202          2H5*        C 202  15.665  32.668  16.647
  455    H4*    C 202           H4*        C 202  13.465  31.802  16.907
  456    H3*    C 202           H3*        C 202  15.667  29.811  17.310
  457    H2*    C 202           H2*        C 202  14.095  28.110  17.829
  458   2HO*    C 202          2HO*        C 202  11.765  29.425  17.470
  459    H1*    C 202           H1*        C 202  12.475  28.708  15.604
  460   1H4     C 202          1H4         C 202  16.200  23.804  13.842
  461   2H4     C 202          2H4         C 202  17.363  24.963  13.237
  462    H5     C 202           H5         C 202  17.174  27.297  13.538
  463    H6     C 202           H6         C 202  15.809  29.114  14.505
  464   1H5*    C 203          1H5*        C 203  13.210  29.700  20.878
  465   2H5*    C 203          2H5*        C 203  14.196  29.455  22.319
  466    H4*    C 203           H4*        C 203  12.524  27.717  22.129
  467    H3*    C 203           H3*        C 203  15.394  26.869  21.802
  468    H2*    C 203           H2*        C 203  14.694  24.595  21.738
  469   2HO*    C 203          2HO*        C 203  12.433  24.194  22.239
  470    H1*    C 203           H1*        C 203  12.685  25.104  19.846
  471   1H4     C 203          1H4         C 203  17.738  23.155  16.445
  472   2H4     C 203          2H4         C 203  18.315  24.806  16.407
  473    H5     C 203           H5         C 203  17.304  26.582  17.591
  474    H6     C 203           H6         C 203  15.472  27.217  19.120
  475   1H5*    U 204          1H5*        U 204  13.554  24.641  24.549
  476   2H5*    U 204          2H5*        U 204  14.316  24.377  26.117
  477    H4*    U 204           H4*        U 204  13.721  22.250  25.272
  478    H3*    U 204           H3*        U 204  16.669  22.813  25.116
  479    H2*    U 204           H2*        U 204  17.048  20.602  24.318
  480   2HO*    U 204          2HO*        U 204  15.267  19.131  24.431
  481    H1*    U 204           H1*        U 204  15.076  20.778  22.354
  482    H3     U 204           H3         U 204  19.194  20.914  20.313
  483    H5     U 204           H5         U 204  18.309  24.882  21.318
  484    H6     U 204           H6         U 204  16.406  24.027  22.606
  485   1H5*    A 205          1H5*        A 205  16.683  20.431  29.197
  486   2H5*    A 205          2H5*        A 205  18.266  20.874  29.836
  487    H4*    A 205           H4*        A 205  18.005  18.546  28.839
  488    H3*    A 205           H3*        A 205  20.233  20.429  28.093
  489    H2*    A 205           H2*        A 205  21.225  18.704  26.799
  490   2HO*    A 205          2HO*        A 205  19.164  16.883  27.401
  491    H1*    A 205           H1*        A 205  18.805  18.013  25.551
  492    H8     A 205           H8         A 205  18.872  21.692  25.782
  493   1H6     A 205          1H6         A 205  22.416  21.729  20.645
  494   2H6     A 205          2H6         A 205  21.485  22.736  21.733
  495    H2     A 205           H2         A 205  22.142  17.545  22.115
  496   1H5*    G 206          1H5*        G 206  23.213  18.880  26.941
  497   2H5*    G 206          2H5*        G 206  24.255  18.833  28.362
  498    H4*    G 206           H4*        G 206  23.698  21.234  26.608
  499    H3*    G 206           H3*        G 206  25.961  19.296  26.737
  500    H2*    G 206           H2*        G 206  27.577  21.027  26.466
  501   2HO*    G 206          2HO*        G 206  25.844  23.161  26.548
  502    H1*    G 206           H1*        G 206  26.509  22.585  28.518
  503    H8     G 206           H8         G 206  26.194  19.018  29.505
  504    H1     G 206           H1         G 206  32.125  21.412  30.490
  505   1H2     G 206          1H2         G 206  32.286  23.252  29.573
  506   2H2     G 206          2H2         G 206  31.005  24.031  28.672
  507   1H5*    U 207          1H5*        U 207  25.169  20.153  21.604
  508   2H5*    U 207          2H5*        U 207  26.839  20.126  21.041
  509    H4*    U 207           H4*        U 207  25.339  22.001  20.195
  510    H3*    U 207           H3*        U 207  28.076  22.448  21.362
  511    H2*    U 207           H2*        U 207  27.916  24.757  20.831
  512   2HO*    U 207          2HO*        U 207  25.342  24.614  19.785
  513    H1*    U 207           H1*        U 207  25.350  25.023  21.914
  514    H3     U 207           H3         U 207  27.636  27.195  25.114
  515    H5     U 207           H5         U 207  29.011  23.257  25.492
  516    H6     U 207           H6         U 207  27.681  22.707  23.507
  517   1H5*    A 208          1H5*        A 208  30.573  23.546  16.740
  518   2H5*    A 208          2H5*        A 208  29.433  23.307  15.418
  519    H4*    A 208           H4*        A 208  31.360  21.958  15.011
  520    H3*    A 208           H3*        A 208  28.846  20.500  15.693
  521    H2*    A 208           H2*        A 208  29.933  18.391  15.554
  522   2HO*    A 208          2HO*        A 208  32.393  19.705  14.991
  523    H1*    A 208           H1*        A 208  32.063  19.177  17.188
  524    H8     A 208           H8         A 208  28.431  20.231  17.815
  525   1H6     A 208          1H6         A 208  28.420  15.786  22.196
  526   2H6     A 208          2H6         A 208  27.468  17.061  21.467
  527    H2     A 208           H2         A 208  32.349  15.687  20.125
  528   1H5*    G 209          1H5*        G 209  29.054  19.000  12.282
  529   2H5*    G 209          2H5*        G 209  27.538  18.676  11.439
  530    H4*    G 209           H4*        G 209  28.211  16.898  13.031
  531    H3*    G 209           H3*        G 209  25.574  18.303  13.335
  532    H2*    G 209           H2*        G 209  24.998  16.838  15.124
  533   2HO*    G 209          2HO*        G 209  27.269  15.407  15.374
  534    H1*    G 209           H1*        G 209  27.421  17.249  16.457
  535    H8     G 209           H8         G 209  26.337  20.456  14.911
  536    H1     G 209           H1         G 209  23.376  19.196  20.527
  537   1H2     G 209          1H2         G 209  23.775  17.255  21.095
  538   2H2     G 209          2H2         G 209  24.764  16.135  20.186
  539   1H5*    A 210          1H5*        A 210  24.622  13.890  13.975
  540   2H5*    A 210          2H5*        A 210  23.170  13.785  12.977
  541    H4*    A 210           H4*        A 210  22.807  13.046  15.299
  542    H3*    A 210           H3*        A 210  21.244  15.402  14.260
  543    H2*    A 210           H2*        A 210  19.966  15.400  16.261
  544   2HO*    A 210          2HO*        A 210  20.755  13.490  17.752
  545    H1*    A 210           H1*        A 210  22.242  15.161  17.904
  546    H8     A 210           H8         A 210  22.886  17.513  15.081
  547   1H6     A 210          1H6         A 210  20.415  21.995  18.652
  548   2H6     A 210          2H6         A 210  21.288  21.685  17.168
  549    H2     A 210           H2         A 210  19.686  18.084  20.628
  550   1H5*    G 211          1H5*        G 211  17.887  12.218  15.149
  551   2H5*    G 211          2H5*        G 211  16.754  12.654  13.871
  552    H4*    G 211           H4*        G 211  15.817  12.681  16.192
  553    H3*    G 211           H3*        G 211  15.656  15.078  14.387
  554    H2*    G 211           H2*        G 211  14.345  16.216  16.019
  555   2HO*    G 211          2HO*        G 211  14.366  14.425  18.035
  556    H1*    G 211           H1*        G 211  16.125  15.658  18.092
  557    H8     G 211           H8         G 211  18.250  16.247  15.150
  558    H1     G 211           H1         G 211  15.906  21.743  17.636
  559   1H2     G 211          1H2         G 211  14.418  21.305  18.994
  560   2H2     G 211          2H2         G 211  13.884  19.689  19.399
  561   1H5*    G 212          1H5*        G 212  11.021  14.204  15.583
  562   2H5*    G 212          2H5*        G 212  10.408  14.662  13.995
  563    H4*    G 212           H4*        G 212   9.369  15.853  15.941
  564    H3*    G 212           H3*        G 212  10.618  17.338  13.647
  565    H2*    G 212           H2*        G 212   9.889  19.402  14.588
  566   2HO*    G 212          2HO*        G 212   8.775  18.668  16.885
  567    H1*    G 212           H1*        G 212  10.921  18.817  17.111
  568    H8     G 212           H8         G 212  13.349  17.407  14.737
  569    H1     G 212           H1         G 212  13.827  23.843  15.222
  570   1H2     G 212          1H2         G 212  12.187  24.581  16.230
  571   2H2     G 212          2H2         G 212  10.878  23.603  16.852
  572   1H5*    G 213          1H5*        G 213   6.335  18.561  13.884
  573   2H5*    G 213          2H5*        G 213   5.765  18.978  12.268
  574    H4*    G 213           H4*        G 213   5.509  20.817  13.884
  575    H3*    G 213           H3*        G 213   7.241  21.204  11.461
  576    H2*    G 213           H2*        G 213   7.570  23.488  12.057
  577   2HO*    G 213          2HO*        G 213   5.802  24.240  13.066
  578    H1*    G 213           H1*        G 213   8.290  22.884  14.680
  579    H8     G 213           H8         G 213   9.733  20.159  12.690
  580    H1     G 213           H1         G 213  13.106  25.653  12.128
  581   1H2     G 213          1H2         G 213  12.013  27.216  12.914
  582   2H2     G 213          2H2         G 213  10.420  27.060  13.621
  583   1H5*    G 214          1H5*        G 214   6.416  24.909  10.668
  584   2H5*    G 214          2H5*        G 214   5.208  24.686   9.403
  585    H4*    G 214           H4*        G 214   6.803  26.030   8.394
  586    H3*    G 214           H3*        G 214   7.196  23.165   7.608
  587    H2*    G 214           H2*        G 214   9.035  23.761   6.221
  588   2HO*    G 214          2HO*        G 214   8.994  25.814   5.481
  589    H1*    G 214           H1*        G 214  10.333  25.211   8.184
  590    H8     G 214           H8         G 214   8.648  22.486  10.008
  591    H1     G 214           H1         G 214  13.999  20.500   6.956
  592   1H2     G 214          1H2         G 214  14.634  21.967   5.653
  593   2H2     G 214          2H2         G 214  13.836  23.506   5.423
  594   1H5*    G 215          1H5*        G 215   7.603  25.406   3.132
  595   2H5*    G 215          2H5*        G 215   6.288  24.340   2.639
  596    H4*    G 215           H4*        G 215   8.368  24.276   1.218
  597    H3*    G 215           H3*        G 215   7.131  21.802   2.395
  598    H2*    G 215           H2*        G 215   8.711  20.461   1.221
  599   2HO*    G 215          2HO*        G 215   8.791  21.684  -0.666
  600    H1*    G 215           H1*        G 215  10.895  21.971   2.083
  601    H8     G 215           H8         G 215   8.427  21.782   4.858
  602    H1     G 215           H1         G 215  12.110  16.484   4.358
  603   1H2     G 215          1H2         G 215  13.166  16.543   2.588
  604   2H2     G 215          2H2         G 215  13.068  17.837   1.414
  605   1H5*    C 216          1H5*        C 216   5.291  21.605  -1.876
  606   2H5*    C 216          2H5*        C 216   3.849  20.610  -1.675
  607    H4*    C 216           H4*        C 216   5.830  19.534  -2.826
  608    H3*    C 216           H3*        C 216   4.429  18.268  -0.479
  609    H2*    C 216           H2*        C 216   5.759  16.323  -0.767
  610   2HO*    C 216          2HO*        C 216   6.808  16.066  -2.753
  611    H1*    C 216           H1*        C 216   8.145  17.790  -1.022
  612   1H4     C 216          1H4         C 216   7.818  15.930   5.101
  613   2H4     C 216          2H4         C 216   7.023  17.444   5.470
  614    H5     C 216           H5         C 216   6.343  19.006   3.834
  615    H6     C 216           H6         C 216   6.258  19.504   1.417
  616   1H5*    U 217          1H5*        U 217   4.552  15.670  -3.340
  617   2H5*    U 217          2H5*        U 217   3.114  14.793  -3.860
  618    H4*    U 217           H4*        U 217   4.609  13.104  -3.342
  619    H3*    U 217           H3*        U 217   2.763  13.567  -1.015
  620    H2*    U 217           H2*        U 217   3.772  11.742   0.140
  621   2HO*    U 217          2HO*        U 217   5.471  10.588  -1.151
  622    H1*    U 217           H1*        U 217   6.363  12.686  -0.296
  623    H3     U 217           H3         U 217   5.724  13.513   4.114
  624    H5     U 217           H5         U 217   3.489  16.493   2.198
  625    H6     U 217           H6         U 217   3.968  15.354   0.081
  626   1H5*    G 218          1H5*        G 218   0.343   9.279  -2.630
  627   2H5*    G 218          2H5*        G 218  -0.045   8.775  -0.985
  628    H4*    G 218           H4*        G 218   1.411   7.125  -1.272
  629    H3*    G 218           H3*        G 218   3.322   9.433  -1.033
  630    H2*    G 218           H2*        G 218   5.133   8.023  -1.554
  631   2HO*    G 218          2HO*        G 218   4.697   5.696  -1.466
  632    H1*    G 218           H1*        G 218   3.572   6.628  -3.552
  633    H8     G 218           H8         G 218   3.673  10.354  -3.887
  634    H1     G 218           H1         G 218   8.640   7.353  -6.752
  635   1H2     G 218          1H2         G 218   8.647   5.363  -6.212
  636   2H2     G 218          2H2         G 218   7.480   4.618  -5.141
  637   1H5*    C 219          1H5*        C 219   4.281   6.685   1.971
  638   2H5*    C 219          2H5*        C 219   3.701   5.336   2.950
  639    H4*    C 219           H4*        C 219   4.661   6.573   4.588
  640    H3*    C 219           H3*        C 219   1.829   7.511   4.375
  641    H2*    C 219           H2*        C 219   2.183   9.226   5.945
  642   2HO*    C 219          2HO*        C 219   4.108   9.072   7.254
  643    H1*    C 219           H1*        C 219   4.661  10.032   4.892
  644   1H4     C 219          1H4         C 219   0.016  13.823   2.512
  645   2H4     C 219          2H4         C 219   0.301  13.019   0.986
  646    H5     C 219           H5         C 219   1.703  11.135   0.733
  647    H6     C 219           H6         C 219   3.190   9.542   1.896
  648   1H5*    G 220          1H5*        G 220   4.623   3.588   6.594
  649   2H5*    G 220          2H5*        G 220   4.720   5.319   6.272
  650    H4*    G 220           H4*        G 220   6.364   3.157   5.281
  651    H3*    G 220           H3*        G 220   6.568   6.174   5.300
  652    H2*    G 220           H2*        G 220   8.407   6.010   3.870
  653   2HO*    G 220          2HO*        G 220   8.407   3.194   4.438
  654    H1*    G 220           H1*        G 220   7.232   3.610   2.630
  655    H8     G 220           H8         G 220   7.028   4.169   0.183
  656    H1     G 220           H1         G 220   6.789  10.533   1.333
  657   1H2     G 220          1H2         G 220   6.752  10.864   3.367
  658   2H2     G 220          2H2         G 220   6.782   9.605   4.582
  659   1H5*    G 221          1H5*        G 221   9.960   5.052   6.240
  660   2H5*    G 221          2H5*        G 221  11.087   5.991   7.219
  661    H4*    G 221           H4*        G 221  11.287   5.933   4.608
  662    H3*    G 221           H3*        G 221  11.720   8.294   6.420
  663    H2*    G 221           H2*        G 221  12.348   9.609   4.541
  664   2HO*    G 221          2HO*        G 221  12.925   8.516   2.666
  665    H1*    G 221           H1*        G 221  10.138   8.847   3.022
  666    H8     G 221           H8         G 221   9.585   9.292   6.755
  667    H1     G 221           H1         G 221   8.482  14.584   3.195
  668   1H2     G 221          1H2         G 221   9.048  14.231   1.244
  669   2H2     G 221          2H2         G 221   9.721  12.727   0.659
  670   1H5*    C 222          1H5*        C 222  15.540   8.138   3.765
  671   2H5*    C 222          2H5*        C 222  16.581   9.239   4.667
  672    H4*    C 222           H4*        C 222  15.650   9.849   2.276
  673    H3*    C 222           H3*        C 222  16.067  11.696   4.619
  674    H2*    C 222           H2*        C 222  15.419  13.528   3.260
  675   2HO*    C 222          2HO*        C 222  14.873  12.496   0.910
  676    H1*    C 222           H1*        C 222  13.169  12.213   2.226
  677   1H4     C 222          1H4         C 222  11.149  15.736   7.193
  678   2H4     C 222          2H4         C 222  11.269  14.299   8.183
  679    H5     C 222           H5         C 222  12.197  12.261   7.436
  680    H6     C 222           H6         C 222  13.252  11.087   5.535
  681   1H5*    U 223          1H5*        U 223  16.958  14.250   1.666
  682   2H5*    U 223          2H5*        U 223  18.610  14.779   1.985
  683    H4*    U 223           H4*        U 223  17.048  16.658   1.835
  684    H3*    U 223           H3*        U 223  18.430  16.182   4.470
  685    H2*    U 223           H2*        U 223  17.472  18.147   5.324
  686   2HO*    U 223          2HO*        U 223  17.414  19.718   3.829
  687    H1*    U 223           H1*        U 223  14.976  17.667   3.956
  688    H3     U 223           H3         U 223  14.036  18.129   8.429
  689    H5     U 223           H5         U 223  15.358  14.182   7.969
  690    H6     U 223           H6         U 223  16.006  14.770   5.679
  691   1H5*    U 224          1H5*        U 224  21.464  19.668   1.786
  692   2H5*    U 224          2H5*        U 224  20.607  21.209   1.760
  693    H4*    U 224           H4*        U 224  20.205  18.977   0.102
  694    H3*    U 224           H3*        U 224  18.778  21.611   0.447
  695    H2*    U 224           H2*        U 224  17.172  20.907  -1.144
  696   2HO*    U 224          2HO*        U 224  18.190  18.421  -1.687
  697    H1*    U 224           H1*        U 224  16.880  18.354  -0.011
  698    H3     U 224           H3         U 224  12.945  19.782   1.539
  699    H5     U 224           H5         U 224  15.583  22.672   3.030
  700    H6     U 224           H6         U 224  17.382  21.496   1.852
  701   1H5*    A 225          1H5*        A 225  19.716  20.580  -3.397
  702   2H5*    A 225          2H5*        A 225  20.014  21.755  -4.679
  703    H4*    A 225           H4*        A 225  18.200  20.358  -5.347
  704    H3*    A 225           H3*        A 225  17.425  23.171  -4.625
  705    H2*    A 225           H2*        A 225  15.183  22.728  -5.254
  706   2HO*    A 225          2HO*        A 225  15.495  20.083  -5.943
  707    H1*    A 225           H1*        A 225  15.199  20.216  -3.889
  708    H8     A 225           H8         A 225  16.629  22.895  -1.758
  709   1H6     A 225          1H6         A 225  10.792  24.267  -0.024
  710   2H6     A 225          2H6         A 225  12.481  24.573   0.315
  711    H2     A 225           H2         A 225  10.597  21.417  -3.427
  712   1H5*    G 226          1H5*        G 226  16.329  21.805  -8.316
  713   2H5*    G 226          2H5*        G 226  16.488  22.781  -9.776
  714    H4*    G 226           H4*        G 226  14.312  21.879  -9.814
  715    H3*    G 226           H3*        G 226  14.388  24.787  -9.100
  716    H2*    G 226           H2*        G 226  12.011  24.855  -8.967
  717   2HO*    G 226          2HO*        G 226  11.379  22.270  -9.359
  718    H1*    G 226           H1*        G 226  11.888  22.594  -7.312
  719    H8     G 226           H8         G 226  14.813  24.476  -6.145
  720    H1     G 226           H1         G 226   9.250  27.172  -4.230
  721   1H2     G 226          1H2         G 226   7.680  26.321  -5.263
  722   2H2     G 226          2H2         G 226   7.848  25.065  -6.470
  723   1H5*    G 227          1H5*        G 227  14.224  23.238 -13.870
  724   2H5*    G 227          2H5*        G 227  15.404  24.197 -14.764
  725    H4*    G 227           H4*        G 227  13.470  24.396 -16.028
  726    H3*    G 227           H3*        G 227  13.858  26.802 -14.290
  727    H2*    G 227           H2*        G 227  11.868  27.796 -15.146
  728   2HO*    G 227          2HO*        G 227  10.779  26.455 -16.865
  729    H1*    G 227           H1*        G 227  10.322  25.524 -14.682
  730    H8     G 227           H8         G 227  12.830  25.897 -11.944
  731    H1     G 227           H1         G 227   7.567  29.575 -11.135
  732   1H2     G 227          1H2         G 227   6.437  29.550 -12.860
  733   2H2     G 227          2H2         G 227   6.854  28.663 -14.309
  734   1H5*    A 228          1H5*        A 228  12.968  28.288 -18.041
  735   2H5*    A 228          2H5*        A 228  14.241  29.341 -18.660
  736    H4*    A 228           H4*        A 228  12.294  30.576 -18.957
  737    H3*    A 228           H3*        A 228  13.746  31.460 -16.483
  738    H2*    A 228           H2*        A 228  12.118  33.157 -16.117
  739   2HO*    A 228          2HO*        A 228  10.346  32.986 -17.955
  740    H1*    A 228           H1*        A 228   9.963  31.415 -16.397
  741    H8     A 228           H8         A 228  13.044  29.966 -14.726
  742   1H6     A 228          1H6         A 228  10.396  31.653  -9.332
  743   2H6     A 228          2H6         A 228  11.743  30.792 -10.041
  744    H2     A 228           H2         A 228   7.915  33.246 -12.656
  745   1H5*    G 229          1H5*        G 229  13.064  35.224 -18.978
  746   2H5*    G 229          2H5*        G 229  14.452  36.240 -18.588
  747    H4*    G 229           H4*        G 229  12.244  37.291 -18.135
  748    H3*    G 229           H3*        G 229  14.284  36.978 -15.951
  749    H2*    G 229           H2*        G 229  12.876  38.199 -14.466
  750   2HO*    G 229          2HO*        G 229  10.894  38.401 -16.490
  751    H1*    G 229           H1*        G 229  10.627  36.653 -15.054
  752    H8     G 229           H8         G 229  13.446  34.292 -15.071
  753    H1     G 229           H1         G 229  11.651  35.943  -9.077
  754   1H2     G 229          1H2         G 229  10.373  37.560  -9.161
  755   2H2     G 229          2H2         G 229   9.863  38.349 -10.637
  756   1H5*    G 230          1H5*        G 230  12.993  41.180 -16.245
  757   2H5*    G 230          2H5*        G 230  14.420  42.208 -16.114
  758    H4*    G 230           H4*        G 230  12.709  42.971 -14.596
  759    H3*    G 230           H3*        G 230  15.198  41.829 -13.373
  760    H2*    G 230           H2*        G 230  14.389  42.345 -11.193
  761   2HO*    G 230          2HO*        G 230  11.980  43.315 -11.569
  762    H1*    G 230           H1*        G 230  11.913  41.136 -11.639
  763    H8     G 230           H8         G 230  14.357  39.014 -13.389
  764    H1     G 230           H1         G 230  14.437  38.105  -6.982
  765   1H2     G 230          1H2         G 230  13.359  39.602  -6.060
  766   2H2     G 230          2H2         G 230  12.553  40.908  -6.899
  767   1H5*    G 231          1H5*        G 231  14.530  45.911 -11.205
  768   2H5*    G 231          2H5*        G 231  16.188  46.504 -11.303
  769    H4*    G 231           H4*        G 231  15.319  46.605  -9.024
  770    H3*    G 231           H3*        G 231  17.657  44.803  -9.581
  771    H2*    G 231           H2*        G 231  17.831  44.306  -7.257
  772   2HO*    G 231          2HO*        G 231  16.349  45.537  -5.848
  773    H1*    G 231           H1*        G 231  15.119  43.694  -7.012
  774    H8     G 231           H8         G 231  16.206  42.462 -10.328
  775    H1     G 231           H1         G 231  17.948  38.530  -5.491
  776   1H2     G 231          1H2         G 231  17.649  39.483  -3.687
  777   2H2     G 231          2H2         G 231  17.020  41.106  -3.511
  778   1H5*    C 232          1H5*        C 232  18.556  47.030  -6.425
  779   2H5*    C 232          2H5*        C 232  20.023  48.005  -6.503
  780    H4*    C 232           H4*        C 232  20.235  46.888  -4.486
  781    H3*    C 232           H3*        C 232  21.790  45.440  -6.610
  782    H2*    C 232           H2*        C 232  22.563  43.883  -4.991
  783   2HO*    C 232          2HO*        C 232  21.500  44.550  -2.726
  784    H1*    C 232           H1*        C 232  20.016  43.441  -3.923
  785   1H4     C 232          1H4         C 232  20.673  38.788  -8.238
  786   2H4     C 232          2H4         C 232  20.299  39.923  -9.516
  787    H5     C 232           H5         C 232  19.983  42.238  -9.171
  788    H6     C 232           H6         C 232  19.946  44.052  -7.495
  789   1H5*    A 233          1H5*        A 233  24.264  46.033  -3.280
  790   2H5*    A 233          2H5*        A 233  25.809  46.765  -3.712
  791    H4*    A 233           H4*        A 233  26.320  44.904  -2.366
  792    H3*    A 233           H3*        A 233  26.833  44.394  -5.282
  793    H2*    A 233           H2*        A 233  27.712  42.250  -4.762
  794   2HO*    A 233          2HO*        A 233  28.480  41.980  -2.714
  795    H1*    A 233           H1*        A 233  25.573  41.545  -3.119
  796    H8     A 233           H8         A 233  24.354  43.575  -6.012
  797   1H6     A 233          1H6         A 233  24.014  38.227  -9.210
  798   2H6     A 233          2H6         A 233  23.602  39.927  -9.242
  799    H2     A 233           H2         A 233  26.106  37.422  -5.374
  800   1H5*    G 234          1H5*        G 234  30.369  43.398  -3.148
  801   2H5*    G 234          2H5*        G 234  31.778  44.165  -3.880
  802    H4*    G 234           H4*        G 234  32.320  41.886  -3.625
  803    H3*    G 234           H3*        G 234  31.679  42.626  -6.466
  804    H2*    G 234           H2*        G 234  32.230  40.417  -7.168
  805   2HO*    G 234          2HO*        G 234  33.782  39.594  -5.893
  806    H1*    G 234           H1*        G 234  30.628  39.215  -5.224
  807    H8     G 234           H8         G 234  28.956  42.310  -6.454
  808    H1     G 234           H1         G 234  28.072  37.200 -10.325
  809   1H2     G 234          1H2         G 234  29.320  35.667  -9.738
  810   2H2     G 234          2H2         G 234  30.439  35.754  -8.397
  811   1H    GLY  15          1H        GLY  15   6.157  -0.413  -1.992
  812   1HA   GLY  15          1HA       GLY  15   7.417  -1.989  -0.398
  813   2HA   GLY  15          2HA       GLY  15   8.111  -2.615  -1.886
  814    H    ARG  16           H        ARG  16   7.678   0.427  -0.095
  815    HA   ARG  16           HA       ARG  16   9.119   2.143   0.318
  816   1HB   ARG  16          2HB       ARG  16  10.825  -0.126  -0.086
  817   2HB   ARG  16          3HB       ARG  16  11.573   1.291  -0.809
  818   1HG   ARG  16          2HG       ARG  16  12.095   2.149   1.176
  819   2HG   ARG  16          3HG       ARG  16  10.484   1.838   1.825
  820   1HD   ARG  16          2HD       ARG  16  12.139   0.605   3.090
  821   2HD   ARG  16          3HD       ARG  16  11.109  -0.511   2.194
  822    HE   ARG  16           HE       ARG  16  12.932  -1.160   0.958
  823   1HH1  ARG  16          2HH1      ARG  16  13.704   1.725   2.748
  824   2HH1  ARG  16          1HH1      ARG  16  15.395   1.660   2.378
  825   1HH2  ARG  16          2HH2      ARG  16  15.157  -1.258   0.464
  826   2HH2  ARG  16          1HH2      ARG  16  16.221  -0.037   1.078
  827    H    ALA  17           H        ALA  17  10.653   0.825  -2.605
  828    HA   ALA  17           HA       ALA  17  10.964   1.687  -4.689
  829   1HB   ALA  17          1HB       ALA  17   8.523   3.359  -4.109
  830   2HB   ALA  17          2HB       ALA  17   9.190   2.963  -5.694
  831   3HB   ALA  17          3HB       ALA  17   8.484   1.694  -4.693
  832    H    ARG  18           H        ARG  18  11.832   3.128  -2.094
  833    HA   ARG  18           HA       ARG  18  11.960   5.872  -2.497
  834   1HB   ARG  18          2HB       ARG  18  12.688   4.467  -0.462
  835   2HB   ARG  18          3HB       ARG  18  14.231   4.313  -1.290
  836   1HG   ARG  18          2HG       ARG  18  12.997   6.992  -0.761
  837   2HG   ARG  18          3HG       ARG  18  13.985   6.165   0.445
  838   1HD   ARG  18          2HD       ARG  18  15.406   6.024  -1.974
  839   2HD   ARG  18          3HD       ARG  18  14.803   7.676  -1.854
  840    HE   ARG  18           HE       ARG  18  15.859   7.150   0.608
  841   1HH1  ARG  18          2HH1      ARG  18  17.054   7.045  -2.660
  842   2HH1  ARG  18          1HH1      ARG  18  18.684   7.423  -2.214
  843   1HH2  ARG  18          2HH2      ARG  18  18.002   7.647   1.208
  844   2HH2  ARG  18          1HH2      ARG  18  19.224   7.763  -0.013
  845    H    GLY  19           H        GLY  19  13.057   7.162  -3.842
  846   1HA   GLY  19          1HA       GLY  19  14.972   7.816  -5.086
  847   2HA   GLY  19          2HA       GLY  19  15.448   6.127  -5.188
  848    H    LEU  20           H        LEU  20  12.587   5.453  -5.920
  849    HA   LEU  20           HA       LEU  20  12.879   6.069  -8.773
  850   1HB   LEU  20          2HB       LEU  20  11.828   3.801  -7.224
  851   2HB   LEU  20          3HB       LEU  20  10.894   4.226  -8.657
  852    HG   LEU  20           HG       LEU  20  13.751   4.041  -9.192
  853   1HD1  LEU  20          1HD1      LEU  20  12.317   1.723  -7.950
  854   2HD1  LEU  20          2HD1      LEU  20  13.933   2.339  -7.614
  855   3HD1  LEU  20          3HD1      LEU  20  13.613   1.479  -9.120
  856   1HD2  LEU  20          1HD2      LEU  20  12.514   4.028 -11.103
  857   2HD2  LEU  20          2HD2      LEU  20  11.166   3.168 -10.359
  858   3HD2  LEU  20          3HD2      LEU  20  12.621   2.288 -10.831
  859    H    CYS  21           H        CYS  21  11.621   7.673  -9.647
  860    HA   CYS  21           HA       CYS  21   9.545   8.812  -8.143
  861   1HB   CYS  21          2HB       CYS  21  10.930  10.022  -9.837
  862   2HB   CYS  21          3HB       CYS  21  10.110   9.138 -11.108
  863    H    TYR  22           H        TYR  22   7.300   8.767  -8.634
  864    HA   TYR  22           HA       TYR  22   6.404   6.339 -10.042
  865   1HB   TYR  22          2HB       TYR  22   5.746   5.905  -7.878
  866   2HB   TYR  22          3HB       TYR  22   5.533   7.608  -7.486
  867    HD1  TYR  22           HD1      TYR  22   4.039   5.010  -9.725
  868    HD2  TYR  22           HD2      TYR  22   3.376   8.377  -7.211
  869    HE1  TYR  22           HE1      TYR  22   1.614   4.776 -10.061
  870    HE2  TYR  22           HE2      TYR  22   0.950   8.153  -7.539
  871    HH   TYR  22           HH       TYR  22  -0.417   5.448  -9.349
  872    H    THR  23           H        THR  23   6.090   9.760  -9.718
  873    HA   THR  23           HA       THR  23   3.581  10.116 -10.963
  874    HB   THR  23           HB       THR  23   5.888  12.064 -11.058
  875    HG1  THR  23           HG1      THR  23   5.460  12.578  -9.015
  876   1HG2  THR  23          1HG2      THR  23   4.264  13.741 -11.351
  877   2HG2  THR  23          2HG2      THR  23   2.947  12.667 -10.877
  878   3HG2  THR  23          3HG2      THR  23   3.758  12.439 -12.426
  879    H    CYS  24           H        CYS  24   6.955  10.053 -12.289
  880    HA   CYS  24           HA       CYS  24   5.715  10.015 -14.940
  881   1HB   CYS  24          2HB       CYS  24   7.812  10.861 -15.831
  882   2HB   CYS  24          3HB       CYS  24   7.218  11.930 -14.577
  883    H    GLY  25           H        GLY  25   8.014   8.578 -12.700
  884   1HA   GLY  25          1HA       GLY  25   8.312   6.206 -12.553
  885   2HA   GLY  25          2HA       GLY  25   7.958   6.092 -14.271
  886    H    SER  26           H        SER  26  10.163   8.410 -12.809
  887    HA   SER  26           HA       SER  26  12.325   7.259 -14.420
  888   1HB   SER  26          2HB       SER  26  11.655   9.746 -14.523
  889   2HB   SER  26          3HB       SER  26  12.449   9.890 -12.955
  890    HG   SER  26           HG       SER  26  13.974  10.336 -14.494
  891    HA   PRO  27           HA       PRO  27  13.930   5.512 -10.640
  892   1HB   PRO  27          2HB       PRO  27  16.098   4.349 -11.790
  893   2HB   PRO  27          3HB       PRO  27  14.470   3.668 -11.900
  894   1HG   PRO  27          2HG       PRO  27  15.976   5.313 -13.898
  895   2HG   PRO  27          3HG       PRO  27  14.981   3.868 -14.160
  896   1HD   PRO  27          2HD       PRO  27  14.071   6.371 -14.645
  897   2HD   PRO  27          3HD       PRO  27  13.010   5.060 -14.093
  898    H    GLY  28           H        GLY  28  14.472   7.547  -9.684
  899   1HA   GLY  28          1HA       GLY  28  17.133   7.946  -9.083
  900   2HA   GLY  28          2HA       GLY  28  16.808   8.999 -10.452
  901    H    HIS  29           H        HIS  29  14.628  10.259 -10.134
  902    HA   HIS  29           HA       HIS  29  14.883  11.611  -7.551
  903   1HB   HIS  29          2HB       HIS  29  13.752  13.477  -8.574
  904   2HB   HIS  29          3HB       HIS  29  15.024  12.935  -9.664
  905    HD1  HIS  29           HD1      HIS  29  14.333  12.542 -12.012
  906    HD2  HIS  29           HD2      HIS  29  11.101  12.453  -9.404
  907    HE1  HIS  29           HE1      HIS  29  12.297  12.317 -13.472
  908    H    TYR  30           H        TYR  30  12.513  12.756  -7.131
  909    HA   TYR  30           HA       TYR  30  10.544  10.572  -7.078
  910   1HB   TYR  30          2HB       TYR  30  11.937  11.573  -4.846
  911   2HB   TYR  30          3HB       TYR  30  10.311  12.237  -4.736
  912    HD1  TYR  30           HD1      TYR  30  12.012   8.980  -5.425
  913    HD2  TYR  30           HD2      TYR  30   8.701  10.982  -3.658
  914    HE1  TYR  30           HE1      TYR  30  11.207   6.838  -4.524
  915    HE2  TYR  30           HE2      TYR  30   7.886   8.847  -2.750
  916    HH   TYR  30           HH       TYR  30   9.188   5.822  -3.722
  917    H    GLN  31           H        GLN  31   8.358  11.539  -6.210
  918    HA   GLN  31           HA       GLN  31   7.333  13.231  -8.127
  919   1HB   GLN  31          2HB       GLN  31   5.846  11.914  -6.798
  920   2HB   GLN  31          3HB       GLN  31   6.390  12.685  -5.314
  921   1HG   GLN  31          2HG       GLN  31   4.957  14.372  -5.536
  922   2HG   GLN  31          3HG       GLN  31   5.331  14.581  -7.246
  923   1HE2  GLN  31          1HE2      GLN  31   3.718  12.222  -5.137
  924   2HE2  GLN  31          2HE2      GLN  31   2.362  11.967  -6.177
  925    H    ALA  32           H        ALA  32   8.588  14.055  -4.921
  926    HA   ALA  32           HA       ALA  32   7.926  16.768  -4.904
  927   1HB   ALA  32          1HB       ALA  32  10.497  15.995  -3.666
  928   2HB   ALA  32          2HB       ALA  32   9.134  16.891  -2.994
  929   3HB   ALA  32          3HB       ALA  32   9.059  15.133  -3.116
  930    H    GLN  33           H        GLN  33  10.394  15.054  -6.621
  931    HA   GLN  33           HA       GLN  33  11.454  17.619  -7.609
  932   1HB   GLN  33          2HB       GLN  33  12.876  15.660  -6.268
  933   2HB   GLN  33          3HB       GLN  33  13.234  15.334  -7.958
  934   1HG   GLN  33          2HG       GLN  33  13.820  17.782  -8.171
  935   2HG   GLN  33          3HG       GLN  33  13.739  17.856  -6.412
  936   1HE2  GLN  33          1HE2      GLN  33  16.051  18.560  -7.351
  937   2HE2  GLN  33          2HE2      GLN  33  17.246  17.322  -7.193
  938    H    CYS  34           H        CYS  34   9.172  15.879  -8.636
  939    HA   CYS  34           HA       CYS  34  10.265  14.704 -11.006
  940   1HB   CYS  34          2HB       CYS  34   8.279  13.776  -9.784
  941   2HB   CYS  34          3HB       CYS  34   7.355  15.177 -10.288
  942    HA   PRO  35           HA       PRO  35  10.240  18.602 -13.180
  943   1HB   PRO  35          2HB       PRO  35  10.857  17.573 -15.617
  944   2HB   PRO  35          3HB       PRO  35  12.049  17.769 -14.326
  945   1HG   PRO  35          2HG       PRO  35  10.554  15.316 -15.167
  946   2HG   PRO  35          3HG       PRO  35  12.265  15.490 -14.735
  947   1HD   PRO  35          2HD       PRO  35  10.420  14.511 -13.013
  948   2HD   PRO  35          3HD       PRO  35  11.827  15.448 -12.473
  949    H    LYS  36           H        LYS  36   8.131  15.958 -13.655
  950    HA   LYS  36           HA       LYS  36   6.569  17.360 -15.695
  951   1HB   LYS  36          2HB       LYS  36   7.168  14.817 -15.712
  952   2HB   LYS  36          3HB       LYS  36   5.843  14.680 -14.563
  953   1HG   LYS  36          2HG       LYS  36   4.252  15.229 -16.123
  954   2HG   LYS  36          3HG       LYS  36   5.393  16.124 -17.130
  955   1HD   LYS  36          2HD       LYS  36   6.486  13.722 -17.374
  956   2HD   LYS  36          3HD       LYS  36   4.839  13.204 -17.006
  957   1HE   LYS  36          2HE       LYS  36   4.913  13.336 -19.344
  958   2HE   LYS  36          3HE       LYS  36   4.107  14.820 -18.841
  959   1HZ   LYS  36          1HZ       LYS  36   6.545  14.492 -20.272
  960   2HZ   LYS  36          2HZ       LYS  36   6.778  15.439 -18.891
  961   3HZ   LYS  36          3HZ       LYS  36   5.620  15.889 -20.038
  962    H    LYS  37           H        LYS  37   6.803  17.402 -12.446
  963    HA   LYS  37           HA       LYS  37   4.270  17.060 -11.401
  964   1HB   LYS  37          2HB       LYS  37   6.634  18.693 -10.680
  965   2HB   LYS  37          3HB       LYS  37   5.109  19.170  -9.946
  966   1HG   LYS  37          2HG       LYS  37   5.329  16.358  -9.712
  967   2HG   LYS  37          3HG       LYS  37   6.862  17.068  -9.201
  968   1HD   LYS  37          2HD       LYS  37   5.568  17.012  -7.250
  969   2HD   LYS  37          3HD       LYS  37   5.440  18.681  -7.810
  970   1HE   LYS  37          2HE       LYS  37   3.321  17.786  -9.054
  971   2HE   LYS  37          3HE       LYS  37   3.402  16.497  -7.854
  972   1HZ   LYS  37          1HZ       LYS  37   1.986  18.459  -7.256
  973   2HZ   LYS  37          2HZ       LYS  37   3.405  19.369  -7.127
  974   3HZ   LYS  37          3HZ       LYS  37   3.157  18.042  -6.108
  975    H    ARG  38           H        ARG  38   2.399  17.889 -12.032
  976    HA   ARG  38           HA       ARG  38   2.241  20.263 -13.627
  977   1HB   ARG  38          2HB       ARG  38   0.298  18.260 -12.570
  978   2HB   ARG  38          3HB       ARG  38  -0.320  19.820 -13.095
  979   1HG   ARG  38          2HG       ARG  38   1.402  18.976 -15.129
  980   2HG   ARG  38          3HG       ARG  38   0.474  17.550 -14.660
  981   1HD   ARG  38          2HD       ARG  38  -1.556  19.176 -14.766
  982   2HD   ARG  38          3HD       ARG  38  -0.482  20.161 -15.758
  983    HE   ARG  38           HE       ARG  38  -1.747  17.686 -16.499
  984   1HH1  ARG  38          2HH1      ARG  38   0.905  19.853 -17.122
  985   2HH1  ARG  38          1HH1      ARG  38   1.137  19.310 -18.750
  986   1HH2  ARG  38          2HH2      ARG  38  -1.451  16.962 -18.642
  987   2HH2  ARG  38          1HH2      ARG  38  -0.204  17.666 -19.613
  988    H    LYS  39           H        LYS  39   0.383  19.524 -10.685
  989    HA   LYS  39           HA       LYS  39   1.293  21.831  -9.278
  990   1HB   LYS  39          2HB       LYS  39  -1.041  22.076 -11.023
  991   2HB   LYS  39          3HB       LYS  39  -1.382  22.522  -9.356
  992   1HG   LYS  39          2HG       LYS  39   1.048  23.752  -9.949
  993   2HG   LYS  39          3HG       LYS  39   0.049  23.972 -11.388
  994   1HD   LYS  39          2HD       LYS  39  -1.073  24.508  -8.664
  995   2HD   LYS  39          3HD       LYS  39  -0.078  25.719  -9.476
  996   1HE   LYS  39          2HE       LYS  39  -2.086  24.622 -11.248
  997   2HE   LYS  39          3HE       LYS  39  -2.812  25.307  -9.794
  998   1HZ   LYS  39          1HZ       LYS  39  -2.411  27.350 -10.519
  999   2HZ   LYS  39          2HZ       LYS  39  -1.965  26.686 -12.010
 1000   3HZ   LYS  39          3HZ       LYS  39  -0.785  27.007 -10.841
 1001    H    SER  40           H        SER  40  -1.929  20.331  -9.432
 1002    HA   SER  40           HA       SER  40  -1.582  18.505  -7.344
 1003   1HB   SER  40          2HB       SER  40  -1.336  20.071  -5.675
 1004   2HB   SER  40          3HB       SER  40  -2.299  21.281  -6.522
 1005    HG   SER  40           HG       SER  40  -3.740  20.666  -5.095
 1006    H    GLY  41           H        GLY  41  -4.191  20.890  -7.757
 1007   1HA   GLY  41          1HA       GLY  41  -6.113  20.450  -9.166
 1008   2HA   GLY  41          2HA       GLY  41  -5.869  18.735  -8.872
 1009    H    ASN  42           H        ASN  42  -5.368  19.210  -5.990
 1010    HA   ASN  42           HA       ASN  42  -7.643  20.436  -4.833
 1011   1HB   ASN  42          2HB       ASN  42  -8.531  18.269  -5.985
 1012   2HB   ASN  42          3HB       ASN  42  -7.780  17.444  -4.620
 1013   1HD2  ASN  42          1HD2      ASN  42  -9.015  17.137  -2.923
 1014   2HD2  ASN  42          2HD2      ASN  42 -10.423  18.049  -2.507
 1015    H    SER  43           H        SER  43  -7.897  19.665  -2.466
 1016    HA   SER  43           HA       SER  43  -5.793  18.325  -1.165
 1017   1HB   SER  43          2HB       SER  43  -5.374  21.188  -1.716
 1018   2HB   SER  43          3HB       SER  43  -5.129  20.723  -0.033
 1019    HG   SER  43           HG       SER  43  -3.623  19.193  -0.720
 1020    H    ARG  44           H        ARG  44  -5.749  19.113   1.288
 1021    HA   ARG  44           HA       ARG  44  -8.572  19.374   2.080
 1022   1HB   ARG  44          2HB       ARG  44  -6.667  17.444   2.764
 1023   2HB   ARG  44          3HB       ARG  44  -6.810  18.462   4.190
 1024   1HG   ARG  44          2HG       ARG  44  -8.342  16.630   4.374
 1025   2HG   ARG  44          3HG       ARG  44  -9.257  18.120   4.139
 1026   1HD   ARG  44          2HD       ARG  44  -9.170  17.484   1.628
 1027   2HD   ARG  44          3HD       ARG  44  -8.777  15.871   2.224
 1028    HE   ARG  44           HE       ARG  44 -11.329  17.190   2.341
 1029   1HH1  ARG  44          2HH1      ARG  44  -9.304  14.735   3.752
 1030   2HH1  ARG  44          1HH1      ARG  44 -10.631  13.826   4.395
 1031   1HH2  ARG  44          2HH2      ARG  44 -13.084  16.001   3.182
 1032   2HH2  ARG  44          1HH2      ARG  44 -12.781  14.547   4.069
 1033    H    GLU  45           H        GLU  45  -5.392  19.997   3.580
 1034    HA   GLU  45           HA       GLU  45  -6.425  22.621   4.435
 1035   1HB   GLU  45          2HB       GLU  45  -4.637  20.720   5.957
 1036   2HB   GLU  45          3HB       GLU  45  -4.960  22.377   6.449
 1037   1HG   GLU  45          2HG       GLU  45  -7.109  21.923   7.078
 1038   2HG   GLU  45          3HG       GLU  45  -7.264  20.565   5.966
 1039    H    ARG  46           H        ARG  46  -4.857  21.858   2.057
 1040    HA   ARG  46           HA       ARG  46  -2.287  23.157   2.612
 1041   1HB   ARG  46          2HB       ARG  46  -2.514  20.917   1.344
 1042   2HB   ARG  46          3HB       ARG  46  -3.064  21.901  -0.006
 1043   1HG   ARG  46          2HG       ARG  46  -0.991  23.023  -0.159
 1044   2HG   ARG  46          3HG       ARG  46  -0.449  22.377   1.393
 1045   1HD   ARG  46          2HD       ARG  46   0.636  21.188  -0.411
 1046   2HD   ARG  46          3HD       ARG  46  -0.480  20.110   0.426
 1047    HE   ARG  46           HE       ARG  46  -1.592  21.411  -1.894
 1048   1HH1  ARG  46          2HH1      ARG  46   0.151  18.648  -0.688
 1049   2HH1  ARG  46          1HH1      ARG  46  -0.291  17.627  -2.015
 1050   1HH2  ARG  46          2HH2      ARG  46  -2.180  20.076  -3.647
 1051   2HH2  ARG  46          1HH2      ARG  46  -1.616  18.440  -3.698
 1052    H    CYS  47           H        CYS  47  -1.439  24.680   0.781
 1053    HA   CYS  47           HA       CYS  47  -3.719  26.301  -0.093
 1054   1HB   CYS  47          2HB       CYS  47  -2.448  27.422   1.688
 1055   2HB   CYS  47          3HB       CYS  47  -0.967  27.256   0.766
 1056    H    GLN  48           H        GLN  48  -3.890  26.276  -2.230
 1057    HA   GLN  48           HA       GLN  48  -1.642  25.422  -3.888
 1058   1HB   GLN  48          2HB       GLN  48  -4.368  24.863  -3.952
 1059   2HB   GLN  48          3HB       GLN  48  -4.122  25.960  -5.304
 1060   1HG   GLN  48          2HG       GLN  48  -3.888  23.754  -6.130
 1061   2HG   GLN  48          3HG       GLN  48  -2.277  24.470  -6.079
 1062   1HE2  GLN  48          1HE2      GLN  48  -4.421  22.738  -3.836
 1063   2HE2  GLN  48          2HE2      GLN  48  -3.219  21.629  -3.278
 1064    H    LEU  49           H        LEU  49  -1.675  28.075  -2.703
 1065    HA   LEU  49           HA       LEU  49  -1.606  29.653  -5.185
 1066   1HB   LEU  49          2HB       LEU  49  -3.326  30.059  -3.009
 1067   2HB   LEU  49          3HB       LEU  49  -2.085  31.304  -2.878
 1068    HG   LEU  49           HG       LEU  49  -3.376  30.935  -5.526
 1069   1HD1  LEU  49          1HD1      LEU  49  -5.270  32.334  -4.886
 1070   2HD1  LEU  49          2HD1      LEU  49  -4.747  32.280  -3.203
 1071   3HD1  LEU  49          3HD1      LEU  49  -5.278  30.804  -4.009
 1072   1HD2  LEU  49          1HD2      LEU  49  -3.053  33.304  -5.668
 1073   2HD2  LEU  49          2HD2      LEU  49  -1.562  32.578  -5.068
 1074   3HD2  LEU  49          3HD2      LEU  49  -2.654  33.402  -3.953
 1075    H    CYS  50           H        CYS  50  -0.274  29.070  -1.902
 1076    HA   CYS  50           HA       CYS  50   2.132  30.442  -2.840
 1077   1HB   CYS  50          2HB       CYS  50   2.468  31.567  -0.802
 1078   2HB   CYS  50          3HB       CYS  50   0.778  31.832  -1.180
 1079    H    ASN  51           H        ASN  51   0.902  27.637  -2.485
 1080    HA   ASN  51           HA       ASN  51   1.587  25.536  -1.949
 1081   1HB   ASN  51          2HB       ASN  51   4.350  26.611  -1.453
 1082   2HB   ASN  51          3HB       ASN  51   3.875  25.057  -2.133
 1083   1HD2  ASN  51          1HD2      ASN  51   4.716  28.282  -2.775
 1084   2HD2  ASN  51          2HD2      ASN  51   4.499  28.247  -4.489
 1085    H    GLY  52           H        GLY  52   0.880  27.581   0.184
 1086   1HA   GLY  52          1HA       GLY  52   2.377  27.063   2.512
 1087   2HA   GLY  52          2HA       GLY  52   0.722  27.654   2.472
 1088    H    MET  53           H        MET  53   1.768  25.845   4.396
 1089    HA   MET  53           HA       MET  53   0.175  23.448   3.762
 1090   1HB   MET  53          2HB       MET  53   2.683  23.089   3.883
 1091   2HB   MET  53          3HB       MET  53   2.573  23.485   5.593
 1092   1HG   MET  53          2HG       MET  53   1.575  21.525   6.130
 1093   2HG   MET  53          3HG       MET  53   0.750  21.391   4.578
 1094   1HE   MET  53          1HE       MET  53   3.055  20.489   2.117
 1095   2HE   MET  53          2HE       MET  53   2.253  19.040   2.723
 1096   3HE   MET  53          3HE       MET  53   1.391  20.580   2.696
 1097    H    GLY  54           H        GLY  54  -1.697  24.122   4.764
 1098   1HA   GLY  54          1HA       GLY  54  -2.384  23.509   7.239
 1099   2HA   GLY  54          2HA       GLY  54  -1.559  25.032   7.538
 1100    H    HIS  55           H        HIS  55  -2.334  26.731   5.706
 1101    HA   HIS  55           HA       HIS  55  -5.175  27.033   6.230
 1102   1HB   HIS  55          2HB       HIS  55  -4.879  29.301   5.318
 1103   2HB   HIS  55          3HB       HIS  55  -3.711  28.957   6.591
 1104    HD1  HIS  55           HD1      HIS  55  -1.232  28.387   5.742
 1105    HD2  HIS  55           HD2      HIS  55  -3.791  30.056   2.927
 1106    HE1  HIS  55           HE1      HIS  55   0.254  29.212   3.887
 1107    H    ASN  56           H        ASN  56  -6.159  28.409   4.153
 1108    HA   ASN  56           HA       ASN  56  -5.867  26.583   1.857
 1109   1HB   ASN  56          2HB       ASN  56  -8.210  27.273   3.406
 1110   2HB   ASN  56          3HB       ASN  56  -8.428  27.722   1.717
 1111   1HD2  ASN  56          1HD2      ASN  56  -9.509  26.212   0.695
 1112   2HD2  ASN  56          2HD2      ASN  56  -9.292  24.507   0.865
 1113    H    ALA  57           H        ALA  57  -6.243  27.490  -0.235
 1114    HA   ALA  57           HA       ALA  57  -4.991  29.925  -0.707
 1115   1HB   ALA  57          1HB       ALA  57  -6.657  29.546  -2.897
 1116   2HB   ALA  57          2HB       ALA  57  -5.004  28.962  -2.711
 1117   3HB   ALA  57          3HB       ALA  57  -6.360  27.922  -2.277
 1118    H    LYS  58           H        LYS  58  -8.446  29.176  -0.470
 1119    HA   LYS  58           HA       LYS  58  -9.443  31.689  -1.194
 1120   1HB   LYS  58          2HB       LYS  58 -10.652  29.748   0.784
 1121   2HB   LYS  58          3HB       LYS  58 -11.505  31.013  -0.092
 1122   1HG   LYS  58          2HG       LYS  58 -10.164  28.622  -1.339
 1123   2HG   LYS  58          3HG       LYS  58 -11.897  28.805  -1.058
 1124   1HD   LYS  58          2HD       LYS  58 -12.035  30.612  -2.605
 1125   2HD   LYS  58          3HD       LYS  58 -10.277  30.718  -2.731
 1126   1HE   LYS  58          2HE       LYS  58 -11.056  29.617  -4.689
 1127   2HE   LYS  58          3HE       LYS  58 -10.302  28.391  -3.670
 1128   1HZ   LYS  58          1HZ       LYS  58 -13.037  28.583  -3.029
 1129   2HZ   LYS  58          2HZ       LYS  58 -12.189  27.261  -3.657
 1130   3HZ   LYS  58          3HZ       LYS  58 -12.883  28.394  -4.704
 1131    H    GLN  59           H        GLN  59  -7.872  30.631   1.679
 1132    HA   GLN  59           HA       GLN  59  -8.490  33.215   2.952
 1133   1HB   GLN  59          2HB       GLN  59  -9.266  30.843   3.969
 1134   2HB   GLN  59          3HB       GLN  59  -7.661  30.956   4.680
 1135   1HG   GLN  59          2HG       GLN  59  -8.457  33.362   5.334
 1136   2HG   GLN  59          3HG       GLN  59 -10.060  32.659   5.125
 1137   1HE2  GLN  59          1HE2      GLN  59 -10.561  32.826   7.296
 1138   2HE2  GLN  59          2HE2      GLN  59  -9.841  31.815   8.497
 1139    H    CYS  60           H        CYS  60  -6.221  32.390   1.094
 1140    HA   CYS  60           HA       CYS  60  -3.960  32.231   2.837
 1141   1HB   CYS  60          2HB       CYS  60  -3.883  31.095   0.690
 1142   2HB   CYS  60          3HB       CYS  60  -4.177  32.595  -0.169
 1143    H    ARG  61           H        ARG  61  -3.130  33.956   3.802
 1144    HA   ARG  61           HA       ARG  61  -2.631  36.097   4.386
 1145   1HB   ARG  61          2HB       ARG  61  -2.091  35.844   1.559
 1146   2HB   ARG  61          3HB       ARG  61  -2.572  37.489   1.953
 1147   1HG   ARG  61          2HG       ARG  61  -0.463  36.058   3.529
 1148   2HG   ARG  61          3HG       ARG  61  -0.086  36.912   2.031
 1149   1HD   ARG  61          2HD       ARG  61  -1.403  38.865   3.182
 1150   2HD   ARG  61          3HD       ARG  61  -1.002  37.988   4.658
 1151    HE   ARG  61           HE       ARG  61   1.311  38.315   3.078
 1152   1HH1  ARG  61          2HH1      ARG  61  -0.883  40.121   5.089
 1153   2HH1  ARG  61          1HH1      ARG  61   0.301  41.299   5.548
 1154   1HH2  ARG  61          2HH2      ARG  61   2.879  39.860   3.674
 1155   2HH2  ARG  61          1HH2      ARG  61   2.441  41.150   4.742
 1156    H    LYS  62           H        LYS  62  -3.306  38.545   3.730
 1157    HA   LYS  62           HA       LYS  62  -4.957  40.105   3.843
 1158   1HB   LYS  62          2HB       LYS  62  -5.413  39.014   1.552
 1159   2HB   LYS  62          3HB       LYS  62  -6.748  38.198   2.356
 1160   1HG   LYS  62          2HG       LYS  62  -8.032  39.983   2.125
 1161   2HG   LYS  62          3HG       LYS  62  -6.847  40.989   2.961
 1162   1HD   LYS  62          2HD       LYS  62  -6.612  40.252   0.051
 1163   2HD   LYS  62          3HD       LYS  62  -7.447  41.704   0.611
 1164   1HE   LYS  62          2HE       LYS  62  -5.354  42.386   1.768
 1165   2HE   LYS  62          3HE       LYS  62  -4.547  40.996   1.042
 1166   1HZ   LYS  62          1HZ       LYS  62  -5.170  41.921  -1.157
 1167   2HZ   LYS  62          2HZ       LYS  62  -4.101  42.902  -0.288
 1168   3HZ   LYS  62          3HZ       LYS  62  -5.740  43.311  -0.380
 1169    H    ARG  63           H        ARG  63  -4.761  38.880   6.142
 1170    HA   ARG  63           HA       ARG  63  -7.534  38.624   7.032
 1171   1HB   ARG  63          2HB       ARG  63  -6.577  36.325   6.646
 1172   2HB   ARG  63          3HB       ARG  63  -5.400  36.674   7.906
 1173   1HG   ARG  63          2HG       ARG  63  -8.100  37.204   8.795
 1174   2HG   ARG  63          3HG       ARG  63  -7.904  35.542   8.237
 1175   1HD   ARG  63          2HD       ARG  63  -5.683  35.735   9.685
 1176   2HD   ARG  63          3HD       ARG  63  -6.647  36.945  10.530
 1177    HE   ARG  63           HE       ARG  63  -8.188  34.626  10.224
 1178   1HH1  ARG  63          2HH1      ARG  63  -5.373  35.747  11.938
 1179   2HH1  ARG  63          1HH1      ARG  63  -5.590  34.660  13.270
 1180   1HH2  ARG  63          2HH2      ARG  63  -8.485  33.191  11.972
 1181   2HH2  ARG  63          1HH2      ARG  63  -7.359  33.206  13.288
 1182    H    ASP  64           H        ASP  64  -4.304  38.195   8.479
 1183    HA   ASP  64           HA       ASP  64  -4.859  40.493  10.227
 1184   1HB   ASP  64          2HB       ASP  64  -5.326  38.604  11.612
 1185   2HB   ASP  64          3HB       ASP  64  -3.883  37.760  11.059
  Start of MODEL   14
    1   1H5*    C 160          1H5*        C 160  27.842  23.903 -14.286
    2   2H5*    C 160          2H5*        C 160  26.264  23.918 -13.499
    3    H4*    C 160           H4*        C 160  27.344  22.114 -12.520
    4    H3*    C 160           H3*        C 160  27.542  24.525 -10.740
    5    H2*    C 160           H2*        C 160  28.669  23.228  -9.097
    6   2HO*    C 160          2HO*        C 160  27.283  21.396  -9.647
    7    H1*    C 160           H1*        C 160  30.491  22.151 -10.908
    8   1H4     C 160          1H4         C 160  33.265  27.397  -8.484
    9   2H4     C 160          2H4         C 160  32.669  28.288  -9.866
   10    H5     C 160           H5         C 160  31.199  27.386 -11.480
   11    H6     C 160           H6         C 160  29.928  25.385 -12.171
   12   1H5*    U 161          1H5*        U 161  25.902  21.517  -8.204
   13   2H5*    U 161          2H5*        U 161  24.487  22.156  -7.371
   14    H4*    U 161           H4*        U 161  25.931  21.317  -5.704
   15    H3*    U 161           H3*        U 161  25.942  24.319  -5.859
   16    H2*    U 161           H2*        U 161  27.360  24.405  -3.949
   17   2HO*    U 161          2HO*        U 161  27.598  22.484  -2.738
   18    H1*    U 161           H1*        U 161  29.148  22.519  -4.984
   19    H3     U 161           H3         U 161  31.288  26.560  -5.110
   20    H5     U 161           H5         U 161  28.929  26.480  -8.569
   21    H6     U 161           H6         U 161  27.893  24.436  -7.696
   22   1H5*    G 162          1H5*        G 162  25.283  22.867  -2.096
   23   2H5*    G 162          2H5*        G 162  23.843  23.435  -1.251
   24    H4*    G 162           H4*        G 162  25.534  23.551   0.346
   25    H3*    G 162           H3*        G 162  24.924  26.234  -0.826
   26    H2*    G 162           H2*        G 162  26.575  27.268   0.545
   27   2HO*    G 162          2HO*        G 162  27.498  25.981   2.220
   28    H1*    G 162           H1*        G 162  28.564  25.451  -0.174
   29    H8     G 162           H8         G 162  26.491  26.042  -3.186
   30    H1     G 162           H1         G 162  30.729  30.805  -2.070
   31   1H2     G 162          1H2         G 162  31.545  30.573  -0.190
   32   2H2     G 162          2H2         G 162  31.141  29.281   0.919
   33   1H5*    C 163          1H5*        C 163  24.882  26.629   3.306
   34   2H5*    C 163          2H5*        C 163  23.649  27.700   3.973
   35    H4*    C 163           H4*        C 163  25.821  28.498   4.609
   36    H3*    C 163           H3*        C 163  24.359  30.209   2.611
   37    H2*    C 163           H2*        C 163  26.080  31.837   2.766
   38   2HO*    C 163          2HO*        C 163  27.834  30.947   4.441
   39    H1*    C 163           H1*        C 163  28.135  29.946   2.498
   40   1H4     C 163          1H4         C 163  27.200  32.190  -3.411
   41   2H4     C 163          2H4         C 163  25.894  31.044  -3.620
   42    H5     C 163           H5         C 163  25.087  29.642  -1.900
   43    H6     C 163           H6         C 163  25.335  28.987   0.468
   44   1H5*    C 164          1H5*        C 164  25.394  32.695   5.619
   45   2H5*    C 164          2H5*        C 164  24.045  33.557   6.358
   46    H4*    C 164           H4*        C 164  25.547  35.248   5.872
   47    H3*    C 164           H3*        C 164  23.489  35.075   3.686
   48    H2*    C 164           H2*        C 164  24.467  36.956   2.616
   49   2HO*    C 164          2HO*        C 164  26.523  37.614   4.103
   50    H1*    C 164           H1*        C 164  27.067  35.958   2.792
   51   1H4     C 164          1H4         C 164  25.057  34.018  -2.947
   52   2H4     C 164          2H4         C 164  24.219  32.680  -2.194
   53    H5     C 164           H5         C 164  24.060  32.375   0.143
   54    H6     C 164           H6         C 164  24.673  33.288   2.354
   55   1H5*    C 165          1H5*        C 165  23.863  38.914   4.700
   56   2H5*    C 165          2H5*        C 165  22.369  39.799   5.010
   57    H4*    C 165           H4*        C 165  23.495  41.055   3.391
   58    H3*    C 165           H3*        C 165  21.316  39.394   2.146
   59    H2*    C 165           H2*        C 165  21.740  40.445   0.054
   60   2HO*    C 165          2HO*        C 165  23.307  42.242   0.122
   61    H1*    C 165           H1*        C 165  24.517  40.055   0.249
   62   1H4     C 165          1H4         C 165  22.437  35.140  -3.263
   63   2H4     C 165          2H4         C 165  22.004  34.294  -1.794
   64    H5     C 165           H5         C 165  22.143  35.244   0.363
   65    H6     C 165           H6         C 165  22.738  37.261   1.656
   66   1H5*    U 166          1H5*        U 166  20.967  43.157   0.730
   67   2H5*    U 166          2H5*        U 166  19.378  43.873   0.996
   68    H4*    U 166           H4*        U 166  19.832  44.253  -1.262
   69    H3*    U 166           H3*        U 166  17.982  41.904  -0.922
   70    H2*    U 166           H2*        U 166  17.753  41.768  -3.287
   71   2HO*    U 166          2HO*        U 166  18.468  43.552  -4.508
   72    H1*    U 166           H1*        U 166  20.524  41.913  -3.718
   73    H3     U 166           H3         U 166  19.321  37.650  -4.817
   74    H5     U 166           H5         U 166  19.612  37.627  -0.638
   75    H6     U 166           H6         U 166  19.874  40.063  -0.742
   76   1H5*    C 167          1H5*        C 167  15.711  45.005  -3.175
   77   2H5*    C 167          2H5*        C 167  13.998  44.592  -3.237
   78    H4*    C 167           H4*        C 167  15.276  44.487  -5.418
   79    H3*    C 167           H3*        C 167  13.614  42.188  -4.403
   80    H2*    C 167           H2*        C 167  13.987  41.049  -6.452
   81   2HO*    C 167          2HO*        C 167  15.596  42.817  -7.722
   82    H1*    C 167           H1*        C 167  16.751  41.590  -6.436
   83   1H4     C 167          1H4         C 167  16.167  35.701  -4.014
   84   2H4     C 167          2H4         C 167  15.914  36.404  -2.432
   85    H5     C 167           H5         C 167  15.703  38.724  -2.043
   86    H6     C 167           H6         C 167  15.681  40.962  -3.086
   87   1H5*    A 168          1H5*        A 168   9.884  44.800  -8.354
   88   2H5*    A 168          2H5*        A 168   9.295  43.482  -7.341
   89    H4*    A 168           H4*        A 168  10.615  42.228  -9.474
   90    H3*    A 168           H3*        A 168   9.200  44.702 -10.416
   91    H2*    A 168           H2*        A 168   8.349  43.515 -12.296
   92   2HO*    A 168          2HO*        A 168   9.966  42.141 -12.841
   93    H1*    A 168           H1*        A 168   7.413  41.385 -10.760
   94    H8     A 168           H8         A 168   7.324  45.121  -9.859
   95   1H6     A 168          1H6         A 168   1.191  44.704 -10.938
   96   2H6     A 168          2H6         A 168   2.474  45.788 -10.447
   97    H2     A 168           H2         A 168   3.012  40.725 -11.707
   98   1H5*    U 169          1H5*        U 169   9.516  44.418 -14.473
   99   2H5*    U 169          2H5*        U 169   9.479  46.174 -14.636
  100    H4*    U 169           H4*        U 169   7.298  44.275 -13.899
  101    H3*    U 169           H3*        U 169   7.645  46.554 -15.817
  102    H2*    U 169           H2*        U 169   5.322  47.029 -15.732
  103   2HO*    U 169          2HO*        U 169   4.023  45.342 -15.199
  104    H1*    U 169           H1*        U 169   5.276  46.819 -12.891
  105    H3     U 169           H3         U 169   5.218  51.242 -12.218
  106    H5     U 169           H5         U 169   7.255  50.913 -15.861
  107    H6     U 169           H6         U 169   7.111  48.478 -15.611
  108   1H5*    C 170          1H5*        C 170   8.875  45.138 -18.690
  109   2H5*    C 170          2H5*        C 170   8.799  43.898 -19.942
  110    H4*    C 170           H4*        C 170  10.468  43.538 -18.072
  111    H3*    C 170           H3*        C 170   8.459  41.452 -18.894
  112    H2*    C 170           H2*        C 170   9.469  39.913 -17.393
  113   2HO*    C 170          2HO*        C 170  11.601  40.262 -17.199
  114    H1*    C 170           H1*        C 170   9.533  41.751 -15.274
  115   1H4     C 170          1H4         C 170   4.126  38.552 -14.216
  116   2H4     C 170          2H4         C 170   3.367  39.366 -15.566
  117    H5     C 170           H5         C 170   4.493  40.862 -17.005
  118    H6     C 170           H6         C 170   6.649  41.957 -17.507
  119   1H5*    C 171          1H5*        C 171  12.575  41.650 -21.205
  120   2H5*    C 171          2H5*        C 171  12.884  40.459 -22.468
  121    H4*    C 171           H4*        C 171  13.932  39.947 -20.263
  122    H3*    C 171           H3*        C 171  12.021  37.972 -21.516
  123    H2*    C 171           H2*        C 171  12.619  36.412 -19.845
  124   2HO*    C 171          2HO*        C 171  14.654  36.613 -19.057
  125    H1*    C 171           H1*        C 171  12.571  38.428 -17.807
  126   1H4     C 171          1H4         C 171   7.281  34.906 -17.006
  127   2H4     C 171          2H4         C 171   6.459  35.964 -18.131
  128    H5     C 171           H5         C 171   7.535  37.668 -19.361
  129    H6     C 171           H6         C 171   9.686  38.790 -19.821
  130   1H5*    G 172          1H5*        G 172  16.269  36.010 -21.589
  131   2H5*    G 172          2H5*        G 172  16.184  34.943 -22.991
  132    H4*    G 172           H4*        G 172  16.892  33.788 -20.931
  133    H3*    G 172           H3*        G 172  14.395  32.914 -22.352
  134    H2*    G 172           H2*        G 172  14.153  31.103 -20.823
  135   2HO*    G 172          2HO*        G 172  16.105  31.407 -19.094
  136    H1*    G 172           H1*        G 172  14.458  32.737 -18.579
  137    H8     G 172           H8         G 172  12.536  34.759 -20.971
  138    H1     G 172           H1         G 172   8.911  30.216 -18.125
  139   1H2     G 172          1H2         G 172  10.132  28.879 -17.136
  140   2H2     G 172          2H2         G 172  11.878  28.975 -17.087
  141   1H5*    U 173          1H5*        U 173  16.562  29.029 -21.798
  142   2H5*    U 173          2H5*        U 173  16.341  28.293 -23.385
  143    H4*    U 173           H4*        U 173  15.520  26.888 -21.529
  144    H3*    U 173           H3*        U 173  13.580  27.805 -23.644
  145    H2*    U 173           H2*        U 173  11.919  26.401 -22.685
  146   2HO*    U 173          2HO*        U 173  12.619  24.777 -21.281
  147    H1*    U 173           H1*        U 173  12.514  27.292 -20.060
  148    H3     U 173           H3         U 173   8.248  28.633 -21.151
  149    H5     U 173           H5         U 173  10.787  31.594 -22.674
  150    H6     U 173           H6         U 173  12.669  30.110 -22.153
  151   1H5*    C 174          1H5*        C 174  13.439  23.477 -23.886
  152   2H5*    C 174          2H5*        C 174  13.207  23.004 -25.569
  153    H4*    C 174           H4*        C 174  11.405  22.174 -24.165
  154    H3*    C 174           H3*        C 174  10.682  24.239 -26.236
  155    H2*    C 174           H2*        C 174   8.391  23.927 -25.711
  156   2HO*    C 174          2HO*        C 174   7.823  22.031 -24.619
  157    H1*    C 174           H1*        C 174   8.937  23.935 -22.905
  158   1H4     C 174          1H4         C 174   6.431  29.681 -24.144
  159   2H4     C 174          2H4         C 174   7.999  30.224 -24.698
  160    H5     C 174           H5         C 174   9.880  28.813 -24.915
  161    H6     C 174           H6         C 174  10.728  26.509 -24.647
  162   1H5*    U 175          1H5*        U 175  11.231  21.513 -30.673
  163   2H5*    U 175          2H5*        U 175  11.882  23.122 -30.361
  164    H4*    U 175           H4*        U 175   9.178  23.607 -30.609
  165    H3*    U 175           H3*        U 175   9.890  21.303 -32.420
  166    H2*    U 175           H2*        U 175   8.479  22.218 -34.086
  167   2HO*    U 175          2HO*        U 175   7.291  24.258 -33.228
  168    H1*    U 175           H1*        U 175   9.459  24.865 -33.575
  169    H3     U 175           H3         U 175  11.961  25.027 -37.279
  170    H5     U 175           H5         U 175  11.842  20.923 -36.451
  171    H6     U 175           H6         U 175  10.585  21.470 -34.418
  172   1H5*    C 176          1H5*        C 176   7.555  20.614 -28.179
  173   2H5*    C 176          2H5*        C 176   7.125  18.907 -28.078
  174    H4*    C 176           H4*        C 176   4.886  19.320 -28.025
  175    H3*    C 176           H3*        C 176   5.414  21.706 -29.784
  176    H2*    C 176           H2*        C 176   3.337  22.637 -29.113
  177   2HO*    C 176          2HO*        C 176   1.990  21.169 -27.738
  178    H1*    C 176           H1*        C 176   3.799  22.069 -26.381
  179   1H4     C 176          1H4         C 176   5.318  28.236 -27.225
  180   2H4     C 176          2H4         C 176   6.960  27.738 -27.571
  181    H5     C 176           H5         C 176   7.634  25.485 -27.785
  182    H6     C 176           H6         C 176   6.894  23.131 -27.720
  183   1H5*    G 177          1H5*        G 177   1.297  20.173 -31.302
  184   2H5*    G 177          2H5*        G 177   1.567  20.291 -33.040
  185    H4*    G 177           H4*        G 177  -0.488  21.418 -32.367
  186    H3*    G 177           H3*        G 177   1.723  23.082 -33.538
  187    H2*    G 177           H2*        G 177   0.304  24.996 -33.494
  188   2HO*    G 177          2HO*        G 177  -1.938  24.609 -32.935
  189    H1*    G 177           H1*        G 177  -0.425  24.608 -30.829
  190    H8     G 177           H8         G 177   3.139  23.643 -31.155
  191    H1     G 177           H1         G 177   2.281  30.046 -30.790
  192   1H2     G 177          1H2         G 177   0.277  30.486 -30.999
  193   2H2     G 177          2H2         G 177  -0.984  29.297 -31.236
  194   1H5*    C 178          1H5*        C 178  -1.684  23.917 -35.699
  195   2H5*    C 178          2H5*        C 178  -1.476  23.804 -37.447
  196    H4*    C 178           H4*        C 178  -2.419  25.922 -37.023
  197    H3*    C 178           H3*        C 178   0.495  26.035 -37.711
  198    H2*    C 178           H2*        C 178   0.485  28.401 -37.558
  199   2HO*    C 178          2HO*        C 178  -1.898  29.148 -36.941
  200    H1*    C 178           H1*        C 178  -0.951  28.369 -35.111
  201   1H4     C 178          1H4         C 178   5.113  29.283 -33.353
  202   2H4     C 178          2H4         C 178   5.442  27.585 -33.615
  203    H5     C 178           H5         C 178   3.875  26.064 -34.514
  204    H6     C 178           H6         C 178   1.582  25.796 -35.392
  205   1H5*    U 179          1H5*        U 179  -1.500  28.591 -40.590
  206   2H5*    U 179          2H5*        U 179  -0.628  28.644 -42.123
  207    H4*    U 179           H4*        U 179  -0.770  30.838 -41.007
  208    H3*    U 179           H3*        U 179   1.947  29.632 -41.503
  209    H2*    U 179           H2*        U 179   2.945  31.656 -40.775
  210   2HO*    U 179          2HO*        U 179   1.004  33.273 -40.169
  211    H1*    U 179           H1*        U 179   1.210  31.856 -38.536
  212    H3     U 179           H3         U 179   5.570  31.318 -37.109
  213    H5     U 179           H5         U 179   4.048  27.455 -37.663
  214    H6     U 179           H6         U 179   2.100  28.484 -38.738
  215   1H5*    U 180          1H5*        U 180   1.709  33.259 -43.106
  216   2H5*    U 180          2H5*        U 180   2.381  33.595 -44.701
  217    H4*    U 180           H4*        U 180   3.387  35.114 -43.192
  218    H3*    U 180           H3*        U 180   5.205  32.911 -44.102
  219    H2*    U 180           H2*        U 180   6.997  33.808 -42.836
  220   2HO*    U 180          2HO*        U 180   6.671  35.978 -43.150
  221    H1*    U 180           H1*        U 180   5.361  34.189 -40.546
  222    H3     U 180           H3         U 180   8.313  31.051 -39.144
  223    H5     U 180           H5         U 180   5.799  28.964 -41.763
  224    H6     U 180           H6         U 180   4.774  31.117 -42.337
  225   1H5*    A 181          1H5*        A 181   6.581  36.134 -47.528
  226   2H5*    A 181          2H5*        A 181   7.225  34.908 -48.619
  227    H4*    A 181           H4*        A 181   8.895  36.490 -47.564
  228    H3*    A 181           H3*        A 181   9.192  33.499 -47.488
  229    H2*    A 181           H2*        A 181  11.315  33.740 -46.450
  230   2HO*    A 181          2HO*        A 181  11.778  36.250 -46.156
  231    H1*    A 181           H1*        A 181  10.393  35.568 -44.546
  232    H8     A 181           H8         A 181   7.825  32.933 -45.254
  233   1H6     A 181          1H6         A 181  10.611  29.510 -40.841
  234   2H6     A 181          2H6         A 181   9.211  29.608 -41.886
  235    H2     A 181           H2         A 181  13.148  33.067 -41.649
  236   1H5*    U 182          1H5*        U 182  10.484  31.075 -47.824
  237   2H5*    U 182          2H5*        U 182  11.539  30.997 -49.235
  238    H4*    U 182           H4*        U 182   8.752  29.885 -48.923
  239    H3*    U 182           H3*        U 182  11.478  28.674 -49.295
  240    H2*    U 182           H2*        U 182  10.540  26.881 -50.507
  241   2HO*    U 182          2HO*        U 182   8.501  26.341 -49.928
  242    H1*    U 182           H1*        U 182   8.752  28.669 -51.903
  243    H3     U 182           H3         U 182  11.182  26.388 -55.067
  244    H5     U 182           H5         U 182  13.681  29.482 -53.758
  245    H6     U 182           H6         U 182  12.045  29.921 -51.984
  246   1H5*    U 183          1H5*        U 183  11.377  24.370 -46.686
  247   2H5*    U 183          2H5*        U 183  11.457  23.779 -48.345
  248    H4*    U 183           H4*        U 183   9.244  23.635 -46.369
  249    H3*    U 183           H3*        U 183  10.485  21.798 -48.400
  250    H2*    U 183           H2*        U 183   8.484  20.632 -48.642
  251   2HO*    U 183          2HO*        U 183   7.106  21.809 -46.547
  252    H1*    U 183           H1*        U 183   6.970  23.109 -48.091
  253    H3     U 183           H3         U 183   8.508  21.453 -52.924
  254    H5     U 183           H5         U 183   4.563  22.465 -51.948
  255    H6     U 183           H6         U 183   5.347  22.918 -49.669
  256   1H5*    C 184          1H5*        C 184  12.224  18.694 -44.714
  257   2H5*    C 184          2H5*        C 184  13.620  18.790 -45.788
  258    H4*    C 184           H4*        C 184  11.531  16.721 -45.558
  259    H3*    C 184           H3*        C 184  14.459  16.804 -46.265
  260    H2*    C 184           H2*        C 184  14.267  14.707 -47.302
  261   2HO*    C 184          2HO*        C 184  11.747  13.983 -46.785
  262    H1*    C 184           H1*        C 184  11.625  15.385 -48.315
  263   1H4     C 184          1H4         C 184  15.552  14.882 -53.368
  264   2H4     C 184          2H4         C 184  15.860  16.598 -53.216
  265    H5     C 184           H5         C 184  15.078  17.921 -51.424
  266    H6     C 184           H6         C 184  13.795  17.924 -49.314
  267   1H5*    G 185          1H5*        G 185  16.201  15.750 -41.278
  268   2H5*    G 185          2H5*        G 185  14.517  15.407 -41.677
  269    H4*    G 185           H4*        G 185  15.711  18.150 -42.050
  270    H3*    G 185           H3*        G 185  14.786  16.896 -39.495
  271    H2*    G 185           H2*        G 185  13.681  18.905 -38.851
  272   2HO*    G 185          2HO*        G 185  14.466  20.064 -41.338
  273    H1*    G 185           H1*        G 185  12.328  19.146 -41.278
  274    H8     G 185           H8         G 185  11.704  18.560 -38.213
  275    H1     G 185           H1         G 185   9.272  13.328 -41.145
  276   1H2     G 185          1H2         G 185  10.097  13.147 -43.026
  277   2H2     G 185          2H2         G 185  11.273  14.248 -43.708
  278   1H5*    G 186          1H5*        G 186  16.714  21.146 -36.912
  279   2H5*    G 186          2H5*        G 186  17.068  19.728 -35.924
  280    H4*    G 186           H4*        G 186  14.545  21.370 -36.021
  281    H3*    G 186           H3*        G 186  16.660  20.858 -33.981
  282    H2*    G 186           H2*        G 186  15.067  20.855 -32.208
  283   2HO*    G 186          2HO*        G 186  12.733  21.107 -33.343
  284    H1*    G 186           H1*        G 186  13.396  19.019 -33.481
  285    H8     G 186           H8         G 186  17.055  18.340 -34.068
  286    H1     G 186           H1         G 186  14.700  15.680 -28.658
  287   1H2     G 186          1H2         G 186  12.789  16.377 -28.324
  288   2H2     G 186          2H2         G 186  11.949  17.514 -29.355
  289   1H5*    G 187          1H5*        G 187  16.720  26.133 -32.281
  290   2H5*    G 187          2H5*        G 187  15.358  26.260 -33.396
  291    H4*    G 187           H4*        G 187  18.122  27.367 -33.622
  292    H3*    G 187           H3*        G 187  15.339  28.416 -33.828
  293    H2*    G 187           H2*        G 187  15.972  30.028 -35.465
  294   2HO*    G 187          2HO*        G 187  18.608  29.078 -35.623
  295    H1*    G 187           H1*        G 187  17.238  28.143 -37.084
  296    H8     G 187           H8         G 187  14.310  26.396 -35.709
  297    H1     G 187           H1         G 187  12.724  30.511 -40.445
  298   1H2     G 187          1H2         G 187  14.331  31.734 -40.864
  299   2H2     G 187          2H2         G 187  15.879  31.655 -40.051
  300   1H5*    G 188          1H5*        G 188  17.557  31.939 -34.268
  301   2H5*    G 188          2H5*        G 188  17.287  32.780 -32.741
  302    H4*    G 188           H4*        G 188  16.938  34.433 -34.321
  303    H3*    G 188           H3*        G 188  14.293  33.268 -33.492
  304    H2*    G 188           H2*        G 188  13.172  34.863 -34.862
  305   2HO*    G 188          2HO*        G 188  14.800  36.368 -36.007
  306    H1*    G 188           H1*        G 188  14.769  34.315 -37.090
  307    H8     G 188           H8         G 188  14.226  31.068 -35.448
  308    H1     G 188           H1         G 188   9.046  33.043 -38.788
  309   1H2     G 188          1H2         G 188   9.282  35.022 -39.318
  310   2H2     G 188          2H2         G 188  10.676  36.000 -38.916
  311   1H5*    A 189          1H5*        A 189  13.528  37.747 -33.414
  312   2H5*    A 189          2H5*        A 189  12.688  37.850 -31.867
  313    H4*    A 189           H4*        A 189  11.391  38.801 -33.728
  314    H3*    A 189           H3*        A 189  10.270  36.454 -32.215
  315    H2*    A 189           H2*        A 189   8.238  36.654 -33.439
  316   2HO*    A 189          2HO*        A 189   8.166  38.557 -34.929
  317    H1*    A 189           H1*        A 189   9.556  36.801 -35.909
  318    H8     A 189           H8         A 189  11.198  34.363 -33.579
  319   1H6     A 189          1H6         A 189   7.259  30.079 -35.835
  320   2H6     A 189          2H6         A 189   8.667  30.318 -34.824
  321    H2     A 189           H2         A 189   6.024  34.057 -37.384
  322   1H5*    G 190          1H5*        G 190   7.607  39.510 -32.434
  323   2H5*    G 190          2H5*        G 190   6.960  40.106 -30.905
  324    H4*    G 190           H4*        G 190   5.076  39.889 -32.234
  325    H3*    G 190           H3*        G 190   5.362  37.468 -30.478
  326    H2*    G 190           H2*        G 190   3.301  36.619 -31.321
  327   2HO*    G 190          2HO*        G 190   3.100  38.870 -33.050
  328    H1*    G 190           H1*        G 190   4.040  36.998 -33.986
  329    H8     G 190           H8         G 190   7.023  35.936 -32.018
  330    H1     G 190           H1         G 190   3.230  31.004 -33.799
  331   1H2     G 190          1H2         G 190   1.458  31.737 -34.558
  332   2H2     G 190          2H2         G 190   1.060  33.436 -34.692
  333   1H5*    C 191          1H5*        C 191   1.486  39.022 -29.743
  334   2H5*    C 191          2H5*        C 191   0.942  38.777 -28.084
  335    H4*    C 191           H4*        C 191  -0.525  37.654 -29.663
  336    H3*    C 191           H3*        C 191   1.065  35.901 -27.799
  337    H2*    C 191           H2*        C 191  -0.147  34.016 -28.586
  338   2HO*    C 191          2HO*        C 191  -2.009  34.466 -29.934
  339    H1*    C 191           H1*        C 191   0.180  34.751 -31.290
  340   1H4     C 191          1H4         C 191   4.748  30.426 -30.133
  341   2H4     C 191          2H4         C 191   5.782  31.714 -29.558
  342    H5     C 191           H5         C 191   5.076  33.952 -29.295
  343    H6     C 191           H6         C 191   3.183  35.521 -29.521
  344   1H5*    G 192          1H5*        G 192  -3.076  34.840 -27.261
  345   2H5*    G 192          2H5*        G 192  -3.430  34.925 -25.535
  346    H4*    G 192           H4*        G 192  -4.250  32.845 -26.283
  347    H3*    G 192           H3*        G 192  -1.693  32.610 -24.726
  348    H2*    G 192           H2*        G 192  -1.813  30.235 -24.876
  349   2HO*    G 192          2HO*        G 192  -4.096  30.241 -26.489
  350    H1*    G 192           H1*        G 192  -2.227  30.258 -27.635
  351    H8     G 192           H8         G 192   0.138  33.001 -26.877
  352    H1     G 192           H1         G 192   2.976  27.185 -26.946
  353   1H2     G 192          1H2         G 192   1.531  25.715 -26.985
  354   2H2     G 192          2H2         G 192  -0.192  26.013 -26.997
  355   1H5*    G 193          1H5*        G 193  -4.405  29.877 -22.603
  356   2H5*    G 193          2H5*        G 193  -4.020  30.040 -20.890
  357    H4*    G 193           H4*        G 193  -3.757  27.739 -21.725
  358    H3*    G 193           H3*        G 193  -1.380  29.181 -20.590
  359    H2*    G 193           H2*        G 193  -0.076  27.198 -20.802
  360   2HO*    G 193          2HO*        G 193  -2.186  25.788 -22.020
  361    H1*    G 193           H1*        G 193  -0.822  26.788 -23.460
  362    H8     G 193           H8         G 193  -0.500  30.433 -23.116
  363    H1     G 193           H1         G 193   5.246  27.479 -23.478
  364   1H2     G 193          1H2         G 193   4.991  25.446 -23.246
  365   2H2     G 193          2H2         G 193   3.450  24.659 -22.992
  366   1H5*    A 194          1H5*        A 194  -1.691  25.570 -17.967
  367   2H5*    A 194          2H5*        A 194  -1.310  26.160 -16.350
  368    H4*    A 194           H4*        A 194   0.163  24.332 -17.036
  369    H3*    A 194           H3*        A 194   1.389  27.033 -16.524
  370    H2*    A 194           H2*        A 194   3.553  26.081 -16.797
  371   2HO*    A 194          2HO*        A 194   3.241  23.586 -17.358
  372    H1*    A 194           H1*        A 194   2.847  24.777 -19.182
  373    H8     A 194           H8         A 194   1.285  28.161 -19.049
  374   1H6     A 194          1H6         A 194   6.604  30.377 -21.447
  375   2H6     A 194          2H6         A 194   4.952  30.787 -21.043
  376    H2     A 194           H2         A 194   7.249  26.126 -20.328
  377   1H5*    C 195          1H5*        C 195   3.414  24.372 -14.466
  378   2H5*    C 195          2H5*        C 195   3.603  24.612 -12.729
  379    H4*    C 195           H4*        C 195   5.774  24.268 -13.440
  380    H3*    C 195           H3*        C 195   5.269  27.234 -13.284
  381    H2*    C 195           H2*        C 195   7.551  27.624 -13.813
  382   2HO*    C 195          2HO*        C 195   8.522  25.165 -14.153
  383    H1*    C 195           H1*        C 195   7.525  25.760 -15.935
  384   1H4     C 195          1H4         C 195   6.732  31.451 -18.727
  385   2H4     C 195          2H4         C 195   5.021  31.367 -18.372
  386    H5     C 195           H5         C 195   4.027  29.655 -17.083
  387    H6     C 195           H6         C 195   4.435  27.581 -15.807
  388   1H5*    G 196          1H5*        G 196   8.713  26.252 -11.019
  389   2H5*    G 196          2H5*        G 196   8.614  26.900  -9.382
  390    H4*    G 196           H4*        G 196  10.755  27.462 -10.176
  391    H3*    G 196           H3*        G 196   8.859  29.776 -10.135
  392    H2*    G 196           H2*        G 196  10.550  31.241 -10.956
  393   2HO*    G 196          2HO*        G 196  12.650  30.566 -10.734
  394    H1*    G 196           H1*        G 196  11.231  29.525 -13.063
  395    H8     G 196           H8         G 196   7.540  29.476 -12.530
  396    H1     G 196           H1         G 196   9.561  34.500 -16.073
  397   1H2     G 196          1H2         G 196  11.619  34.613 -15.997
  398   2H2     G 196          2H2         G 196  12.644  33.510 -15.107
  399   1H5*    A 197          1H5*        A 197   9.894  28.454  -4.772
  400   2H5*    A 197          2H5*        A 197   8.427  29.415  -4.958
  401    H4*    A 197           H4*        A 197  10.876  29.998  -3.501
  402    H3*    A 197           H3*        A 197   8.043  31.046  -3.485
  403    H2*    A 197           H2*        A 197   8.756  32.930  -2.379
  404   2HO*    A 197          2HO*        A 197  10.755  32.548  -0.991
  405    H1*    A 197           H1*        A 197  11.554  32.406  -3.322
  406    H8     A 197           H8         A 197   8.638  33.989  -5.204
  407   1H6     A 197          1H6         A 197  11.684  39.385  -4.451
  408   2H6     A 197          2H6         A 197  10.291  38.635  -5.199
  409    H2     A 197           H2         A 197  13.892  36.223  -2.243
  410   1H5*    U 198          1H5*        U 198  10.097  30.366   1.275
  411   2H5*    U 198          2H5*        U 198   8.932  29.047   1.155
  412    H4*    U 198           H4*        U 198   7.398  30.387   2.638
  413    H3*    U 198           H3*        U 198   9.528  32.377   2.439
  414    H2*    U 198           H2*        U 198  10.405  31.847   4.497
  415   2HO*    U 198          2HO*        U 198   9.109  32.968   6.027
  416    H1*    U 198           H1*        U 198   7.763  30.400   5.077
  417    H3     U 198           H3         U 198   8.949  27.935   8.622
  418    H5     U 198           H5         U 198  12.618  29.472   7.316
  419    H6     U 198           H6         U 198  11.414  30.476   5.431
  420   1H5*    G 199          1H5*        G 199   9.237  34.399   0.038
  421   2H5*    G 199          2H5*        G 199  10.573  33.941   1.095
  422    H4*    G 199           H4*        G 199  10.665  36.172  -0.233
  423    H3*    G 199           H3*        G 199  11.534  35.710   2.597
  424    H2*    G 199           H2*        G 199  12.187  37.985   2.811
  425   2HO*    G 199          2HO*        G 199  11.899  39.255   0.724
  426    H1*    G 199           H1*        G 199   9.808  39.010   1.854
  427    H8     G 199           H8         G 199  10.020  35.782   3.922
  428    H1     G 199           H1         G 199   8.047  41.038   7.140
  429   1H2     G 199          1H2         G 199   8.091  42.672   5.884
  430   2H2     G 199          2H2         G 199   8.589  42.625   4.208
  431   1H5*    A 200          1H5*        A 200  12.625  36.495   4.069
  432   2H5*    A 200          2H5*        A 200  14.317  36.745   4.497
  433    H4*    A 200           H4*        A 200  13.350  35.631   6.325
  434    H3*    A 200           H3*        A 200  15.090  33.892   4.637
  435    H2*    A 200           H2*        A 200  14.630  31.979   5.978
  436   2HO*    A 200          2HO*        A 200  12.852  33.545   7.558
  437    H1*    A 200           H1*        A 200  11.910  32.196   5.814
  438    H8     A 200           H8         A 200  12.514  33.593   2.590
  439   1H6     A 200          1H6         A 200  14.181  27.972   0.450
  440   2H6     A 200          2H6         A 200  13.730  29.594  -0.027
  441    H2     A 200           H2         A 200  14.112  27.805   4.890
  442   1H5*    C 201          1H5*        C 201  18.373  33.429   8.301
  443   2H5*    C 201          2H5*        C 201  18.222  31.748   7.792
  444    H4*    C 201           H4*        C 201  15.970  33.635   8.515
  445    H3*    C 201           H3*        C 201  17.240  31.308   9.951
  446    H2*    C 201           H2*        C 201  15.147  30.869  10.997
  447   2HO*    C 201          2HO*        C 201  13.428  32.509  10.450
  448    H1*    C 201           H1*        C 201  13.753  31.088   8.540
  449   1H4     C 201          1H4         C 201  14.634  24.837   9.726
  450   2H4     C 201          2H4         C 201  16.018  24.903   8.658
  451    H5     C 201           H5         C 201  16.879  26.901   7.740
  452    H6     C 201           H6         C 201  16.619  29.355   7.621
  453   1H5*    C 202          1H5*        C 202  15.544  33.675  13.339
  454   2H5*    C 202          2H5*        C 202  16.741  33.530  14.626
  455    H4*    C 202           H4*        C 202  14.504  32.736  15.287
  456    H3*    C 202           H3*        C 202  16.805  30.793  15.308
  457    H2*    C 202           H2*        C 202  15.396  29.174  16.321
  458   2HO*    C 202          2HO*        C 202  13.181  30.919  16.312
  459    H1*    C 202           H1*        C 202  13.275  29.690  14.520
  460   1H4     C 202          1H4         C 202  16.202  24.451  12.301
  461   2H4     C 202          2H4         C 202  17.304  25.481  11.416
  462    H5     C 202           H5         C 202  17.353  27.834  11.612
  463    H6     C 202           H6         C 202  16.344  29.798  12.718
  464   1H5*    C 203          1H5*        C 203  15.762  31.144  19.758
  465   2H5*    C 203          2H5*        C 203  17.242  30.657  20.583
  466    H4*    C 203           H4*        C 203  15.246  29.207  21.010
  467    H3*    C 203           H3*        C 203  17.823  28.059  19.960
  468    H2*    C 203           H2*        C 203  16.917  25.871  20.196
  469   2HO*    C 203          2HO*        C 203  15.402  25.692  21.750
  470    H1*    C 203           H1*        C 203  14.514  26.562  18.915
  471   1H4     C 203          1H4         C 203  18.203  23.967  14.376
  472   2H4     C 203          2H4         C 203  18.866  25.553  14.054
  473    H5     C 203           H5         C 203  18.381  27.469  15.348
  474    H6     C 203           H6         C 203  17.128  28.342  17.288
  475   1H5*    U 204          1H5*        U 204  16.658  26.106  23.322
  476   2H5*    U 204          2H5*        U 204  17.870  25.780  24.560
  477    H4*    U 204           H4*        U 204  16.774  23.731  24.020
  478    H3*    U 204           H3*        U 204  19.609  23.939  23.047
  479    H2*    U 204           H2*        U 204  19.510  21.687  22.282
  480   2HO*    U 204          2HO*        U 204  16.852  21.256  22.913
  481    H1*    U 204           H1*        U 204  17.107  22.064  20.920
  482    H3     U 204           H3         U 204  20.560  21.664  17.890
  483    H5     U 204           H5         U 204  20.298  25.744  18.796
  484    H6     U 204           H6         U 204  18.739  25.145  20.592
  485   1H5*    A 205          1H5*        A 205  20.515  21.678  27.131
  486   2H5*    A 205          2H5*        A 205  22.247  21.977  27.270
  487    H4*    A 205           H4*        A 205  21.500  19.640  26.582
  488    H3*    A 205           H3*        A 205  23.606  21.219  25.123
  489    H2*    A 205           H2*        A 205  24.031  19.340  23.735
  490   2HO*    A 205          2HO*        A 205  22.804  17.346  24.374
  491    H1*    A 205           H1*        A 205  21.316  18.879  23.216
  492    H8     A 205           H8         A 205  21.749  22.536  23.218
  493   1H6     A 205          1H6         A 205  23.818  22.079  17.348
  494   2H6     A 205          2H6         A 205  23.290  23.202  18.582
  495    H2     A 205           H2         A 205  23.596  17.987  19.065
  496   1H5*    G 206          1H5*        G 206  25.988  19.364  23.323
  497   2H5*    G 206          2H5*        G 206  27.378  19.243  24.402
  498    H4*    G 206           H4*        G 206  26.579  21.633  22.730
  499    H3*    G 206           H3*        G 206  28.627  19.494  22.384
  500    H2*    G 206           H2*        G 206  30.248  21.051  21.594
  501   2HO*    G 206          2HO*        G 206  28.551  23.251  22.045
  502    H1*    G 206           H1*        G 206  29.892  22.781  23.754
  503    H8     G 206           H8         G 206  30.512  19.126  22.962
  504    H1     G 206           H1         G 206  34.078  21.477  27.823
  505   1H2     G 206          1H2         G 206  33.445  23.385  28.283
  506   2H2     G 206          2H2         G 206  32.141  24.223  27.471
  507   1H5*    U 207          1H5*        U 207  26.558  20.271  17.615
  508   2H5*    U 207          2H5*        U 207  27.996  20.064  16.616
  509    H4*    U 207           H4*        U 207  26.491  22.055  16.116
  510    H3*    U 207           H3*        U 207  29.473  22.261  16.464
  511    H2*    U 207           H2*        U 207  29.374  24.559  15.877
  512   2HO*    U 207          2HO*        U 207  27.839  24.669  14.320
  513    H1*    U 207           H1*        U 207  27.242  25.106  17.603
  514    H3     U 207           H3         U 207  30.507  27.128  19.935
  515    H5     U 207           H5         U 207  31.583  23.086  20.133
  516    H6     U 207           H6         U 207  29.713  22.615  18.618
  517   1H5*    A 208          1H5*        A 208  30.676  22.983  11.284
  518   2H5*    A 208          2H5*        A 208  29.198  22.815  10.336
  519    H4*    A 208           H4*        A 208  30.822  21.274   9.501
  520    H3*    A 208           H3*        A 208  28.470  20.090  10.909
  521    H2*    A 208           H2*        A 208  29.291  17.883  10.598
  522   2HO*    A 208          2HO*        A 208  31.677  18.656   9.393
  523    H1*    A 208           H1*        A 208  31.848  18.502  11.549
  524    H8     A 208           H8         A 208  28.636  19.926  13.079
  525   1H6     A 208          1H6         A 208  29.442  15.628  17.532
  526   2H6     A 208          2H6         A 208  28.441  16.969  17.021
  527    H2     A 208           H2         A 208  32.625  15.083  14.482
  528   1H5*    G 209          1H5*        G 209  27.618  18.483   7.656
  529   2H5*    G 209          2H5*        G 209  25.910  18.283   7.261
  530    H4*    G 209           H4*        G 209  26.820  16.493   8.710
  531    H3*    G 209           H3*        G 209  24.505  18.168   9.634
  532    H2*    G 209           H2*        G 209  24.307  16.821  11.590
  533   2HO*    G 209          2HO*        G 209  26.406  15.165  11.320
  534    H1*    G 209           H1*        G 209  27.029  17.019  12.199
  535    H8     G 209           H8         G 209  25.836  20.270  10.826
  536    H1     G 209           H1         G 209  24.480  19.487  17.105
  537   1H2     G 209          1H2         G 209  24.858  17.535  17.653
  538   2H2     G 209          2H2         G 209  25.454  16.295  16.572
  539   1H5*    A 210          1H5*        A 210  23.622  14.097  10.879
  540   2H5*    A 210          2H5*        A 210  22.008  13.824  10.222
  541    H4*    A 210           H4*        A 210  22.014  13.297  12.564
  542    H3*    A 210           H3*        A 210  20.472  15.772  11.808
  543    H2*    A 210           H2*        A 210  19.690  15.941  14.044
  544   2HO*    A 210          2HO*        A 210  19.772  14.093  15.295
  545    H1*    A 210           H1*        A 210  22.244  15.543  15.147
  546    H8     A 210           H8         A 210  22.342  17.700  12.083
  547   1H6     A 210          1H6         A 210  21.362  22.552  15.884
  548   2H6     A 210          2H6         A 210  21.758  22.095  14.243
  549    H2     A 210           H2         A 210  20.865  18.818  18.240
  550   1H5*    G 211          1H5*        G 211  17.387  12.978  14.055
  551   2H5*    G 211          2H5*        G 211  15.952  13.405  13.123
  552    H4*    G 211           H4*        G 211  15.742  13.684  15.601
  553    H3*    G 211           H3*        G 211  15.197  15.948  13.702
  554    H2*    G 211           H2*        G 211  14.487  17.304  15.528
  555   2HO*    G 211          2HO*        G 211  15.108  15.235  17.363
  556    H1*    G 211           H1*        G 211  16.761  16.748  17.048
  557    H8     G 211           H8         G 211  17.966  16.968  13.583
  558    H1     G 211           H1         G 211  16.751  22.787  16.140
  559   1H2     G 211          1H2         G 211  15.700  22.560  17.899
  560   2H2     G 211          2H2         G 211  15.218  21.023  18.580
  561   1H5*    G 212          1H5*        G 212  10.857  15.394  15.680
  562   2H5*    G 212          2H5*        G 212   9.952  15.822  14.229
  563    H4*    G 212           H4*        G 212   9.433  17.185  16.266
  564    H3*    G 212           H3*        G 212  10.271  18.454  13.675
  565    H2*    G 212           H2*        G 212   9.901  20.613  14.614
  566   2HO*    G 212          2HO*        G 212   8.081  20.051  15.834
  567    H1*    G 212           H1*        G 212  11.398  20.065  16.902
  568    H8     G 212           H8         G 212  13.175  18.354  14.175
  569    H1     G 212           H1         G 212  14.172  24.748  14.132
  570   1H2     G 212          1H2         G 212  12.832  25.663  15.405
  571   2H2     G 212          2H2         G 212  11.619  24.823  16.346
  572   1H5*    G 213          1H5*        G 213   5.841  20.243  14.109
  573   2H5*    G 213          2H5*        G 213   5.514  20.329  12.379
  574    H4*    G 213           H4*        G 213   5.297  22.492  13.617
  575    H3*    G 213           H3*        G 213   7.103  22.209  11.233
  576    H2*    G 213           H2*        G 213   7.585  24.541  11.322
  577   2HO*    G 213          2HO*        G 213   5.473  25.144  11.946
  578    H1*    G 213           H1*        G 213   8.199  24.486  14.042
  579    H8     G 213           H8         G 213   9.503  21.307  12.764
  580    H1     G 213           H1         G 213  13.243  26.322  11.106
  581   1H2     G 213          1H2         G 213  12.239  28.083  11.480
  582   2H2     G 213          2H2         G 213  10.624  28.186  12.145
  583   1H5*    G 214          1H5*        G 214   6.645  25.907  10.057
  584   2H5*    G 214          2H5*        G 214   5.529  25.687   8.710
  585    H4*    G 214           H4*        G 214   7.352  26.791   7.773
  586    H3*    G 214           H3*        G 214   7.452  23.850   7.188
  587    H2*    G 214           H2*        G 214   9.425  24.155   5.890
  588   2HO*    G 214          2HO*        G 214   9.976  26.288   5.317
  589    H1*    G 214           H1*        G 214  10.744  25.591   7.863
  590    H8     G 214           H8         G 214   8.734  23.130   9.717
  591    H1     G 214           H1         G 214  13.989  20.489   7.018
  592   1H2     G 214          1H2         G 214  14.817  21.819   5.677
  593   2H2     G 214          2H2         G 214  14.182  23.413   5.334
  594   1H5*    G 215          1H5*        G 215   8.530  25.235   3.402
  595   2H5*    G 215          2H5*        G 215   7.015  25.071   2.513
  596    H4*    G 215           H4*        G 215   8.593  24.230   1.042
  597    H3*    G 215           H3*        G 215   7.245  21.984   2.505
  598    H2*    G 215           H2*        G 215   8.505  20.393   1.260
  599   2HO*    G 215          2HO*        G 215   8.908  21.171  -0.726
  600    H1*    G 215           H1*        G 215  10.942  21.615   1.785
  601    H8     G 215           H8         G 215   8.665  21.980   4.734
  602    H1     G 215           H1         G 215  11.794  16.319   4.548
  603   1H2     G 215          1H2         G 215  12.741  16.115   2.728
  604   2H2     G 215          2H2         G 215  12.694  17.301   1.443
  605   1H5*    C 216          1H5*        C 216   4.795  21.868  -1.507
  606   2H5*    C 216          2H5*        C 216   3.451  20.803  -1.097
  607    H4*    C 216           H4*        C 216   5.443  19.841  -2.410
  608    H3*    C 216           H3*        C 216   4.159  18.522  -0.027
  609    H2*    C 216           H2*        C 216   5.547  16.624  -0.356
  610   2HO*    C 216          2HO*        C 216   6.081  16.303  -2.438
  611    H1*    C 216           H1*        C 216   7.876  18.157  -0.655
  612   1H4     C 216          1H4         C 216   7.690  16.379   5.497
  613   2H4     C 216          2H4         C 216   6.847  17.869   5.856
  614    H5     C 216           H5         C 216   6.094  19.385   4.208
  615    H6     C 216           H6         C 216   5.963  19.848   1.786
  616   1H5*    U 217          1H5*        U 217   3.945  15.766  -3.095
  617   2H5*    U 217          2H5*        U 217   2.441  14.849  -3.176
  618    H4*    U 217           H4*        U 217   4.343  13.369  -2.908
  619    H3*    U 217           H3*        U 217   2.393  13.503  -0.619
  620    H2*    U 217           H2*        U 217   3.558  11.717   0.444
  621   2HO*    U 217          2HO*        U 217   5.386  10.821  -0.882
  622    H1*    U 217           H1*        U 217   6.058  12.937   0.080
  623    H3     U 217           H3         U 217   5.323  13.230   4.557
  624    H5     U 217           H5         U 217   2.931  16.254   2.921
  625    H6     U 217           H6         U 217   3.491  15.362   0.706
  626   1H5*    G 218          1H5*        G 218   0.462   9.130  -2.647
  627   2H5*    G 218          2H5*        G 218   0.084   8.440  -1.069
  628    H4*    G 218           H4*        G 218   1.695   6.962  -1.448
  629    H3*    G 218           H3*        G 218   3.382   9.405  -0.976
  630    H2*    G 218           H2*        G 218   5.326   8.203  -1.557
  631   2HO*    G 218          2HO*        G 218   4.526   5.746  -2.035
  632    H1*    G 218           H1*        G 218   3.981   6.897  -3.742
  633    H8     G 218           H8         G 218   3.547  10.594  -3.761
  634    H1     G 218           H1         G 218   9.096   8.656  -6.470
  635   1H2     G 218          1H2         G 218   9.391   6.654  -6.079
  636   2H2     G 218          2H2         G 218   8.298   5.648  -5.154
  637   1H5*    C 219          1H5*        C 219   4.544   6.454   1.794
  638   2H5*    C 219          2H5*        C 219   4.043   5.003   2.662
  639    H4*    C 219           H4*        C 219   4.935   6.193   4.383
  640    H3*    C 219           H3*        C 219   2.024   6.884   4.254
  641    H2*    C 219           H2*        C 219   2.241   8.475   5.972
  642   2HO*    C 219          2HO*        C 219   3.594   7.635   7.453
  643    H1*    C 219           H1*        C 219   4.625   9.593   5.000
  644   1H4     C 219          1H4         C 219  -0.360  13.120   2.922
  645   2H4     C 219          2H4         C 219  -0.003  12.478   1.334
  646    H5     C 219           H5         C 219   1.569  10.763   0.931
  647    H6     C 219           H6         C 219   3.202   9.225   1.963
  648   1H5*    G 220          1H5*        G 220   5.178   3.059   6.135
  649   2H5*    G 220          2H5*        G 220   5.085   4.810   5.952
  650    H4*    G 220           H4*        G 220   6.907   2.895   4.738
  651    H3*    G 220           H3*        G 220   6.885   5.889   5.152
  652    H2*    G 220           H2*        G 220   8.683   6.067   3.685
  653   2HO*    G 220          2HO*        G 220   9.468   3.535   3.326
  654    H1*    G 220           H1*        G 220   7.715   3.691   2.213
  655    H8     G 220           H8         G 220   7.502   4.450  -0.176
  656    H1     G 220           H1         G 220   6.706  10.645   1.521
  657   1H2     G 220          1H2         G 220   6.624  10.790   3.577
  658   2H2     G 220          2H2         G 220   6.750   9.436   4.677
  659   1H5*    G 221          1H5*        G 221  10.313   5.103   6.251
  660   2H5*    G 221          2H5*        G 221  11.252   6.271   7.180
  661    H4*    G 221           H4*        G 221  10.837   6.344   4.478
  662    H3*    G 221           H3*        G 221  11.615   8.521   6.422
  663    H2*    G 221           H2*        G 221  11.784  10.012   4.588
  664   2HO*    G 221          2HO*        G 221  11.091   8.176   2.630
  665    H1*    G 221           H1*        G 221   9.364   9.064   3.434
  666    H8     G 221           H8         G 221   8.986   9.599   7.094
  667    H1     G 221           H1         G 221   8.360  15.038   3.643
  668   1H2     G 221          1H2         G 221   8.947  14.690   1.697
  669   2H2     G 221          2H2         G 221   9.523  13.154   1.091
  670   1H5*    C 222          1H5*        C 222  15.733   7.996   4.445
  671   2H5*    C 222          2H5*        C 222  16.700   9.219   5.270
  672    H4*    C 222           H4*        C 222  15.444   9.620   2.924
  673    H3*    C 222           H3*        C 222  16.123  11.607   5.094
  674    H2*    C 222           H2*        C 222  15.289  13.330   3.703
  675   2HO*    C 222          2HO*        C 222  14.749  12.607   1.448
  676    H1*    C 222           H1*        C 222  13.014  11.813   2.936
  677   1H4     C 222          1H4         C 222  11.065  15.950   7.431
  678   2H4     C 222          2H4         C 222  11.370  14.710   8.627
  679    H5     C 222           H5         C 222  12.403  12.641   8.146
  680    H6     C 222           H6         C 222  13.408  11.239   6.379
  681   1H5*    U 223          1H5*        U 223  16.559  14.054   2.043
  682   2H5*    U 223          2H5*        U 223  18.260  14.519   2.063
  683    H4*    U 223           H4*        U 223  16.973  16.512   2.118
  684    H3*    U 223           H3*        U 223  18.284  15.837   4.739
  685    H2*    U 223           H2*        U 223  17.414  17.775   5.720
  686   2HO*    U 223          2HO*        U 223  17.521  19.448   4.345
  687    H1*    U 223           H1*        U 223  14.949  17.529   4.175
  688    H3     U 223           H3         U 223  13.565  18.087   8.492
  689    H5     U 223           H5         U 223  14.958  14.142   8.318
  690    H6     U 223           H6         U 223  15.808  14.645   6.074
  691   1H5*    U 224          1H5*        U 224  21.181  16.660  -0.101
  692   2H5*    U 224          2H5*        U 224  20.312  17.892   0.815
  693    H4*    U 224           H4*        U 224  19.411  16.208  -1.459
  694    H3*    U 224           H3*        U 224  19.165  19.076  -0.626
  695    H2*    U 224           H2*        U 224  17.150  19.306  -1.861
  696   2HO*    U 224          2HO*        U 224  17.732  18.043  -3.625
  697    H1*    U 224           H1*        U 224  16.108  16.875  -0.812
  698    H3     U 224           H3         U 224  13.239  19.182   1.699
  699    H5     U 224           H5         U 224  16.787  21.343   2.227
  700    H6     U 224           H6         U 224  17.875  19.730   0.734
  701   1H5*    A 225          1H5*        A 225  20.389  19.992  -5.099
  702   2H5*    A 225          2H5*        A 225  20.208  21.746  -5.044
  703    H4*    A 225           H4*        A 225  18.305  20.108  -5.950
  704    H3*    A 225           H3*        A 225  17.991  22.746  -4.518
  705    H2*    A 225           H2*        A 225  15.652  22.597  -4.863
  706   2HO*    A 225          2HO*        A 225  16.096  20.163  -6.293
  707    H1*    A 225           H1*        A 225  15.551  19.881  -4.088
  708    H8     A 225           H8         A 225  17.793  21.835  -1.838
  709   1H6     A 225          1H6         A 225  12.708  23.275   1.482
  710   2H6     A 225          2H6         A 225  14.455  23.348   1.461
  711    H2     A 225           H2         A 225  11.400  21.304  -2.280
  712   1H5*    G 226          1H5*        G 226  15.911  22.760  -7.976
  713   2H5*    G 226          2H5*        G 226  16.068  24.159  -9.038
  714    H4*    G 226           H4*        G 226  13.781  23.963  -8.781
  715    H3*    G 226           H3*        G 226  14.807  25.991  -6.806
  716    H2*    G 226           H2*        G 226  12.562  26.463  -6.169
  717   2HO*    G 226          2HO*        G 226  11.064  26.052  -7.704
  718    H1*    G 226           H1*        G 226  11.926  23.732  -5.901
  719    H8     G 226           H8         G 226  15.342  24.615  -4.605
  720    H1     G 226           H1         G 226  10.588  25.466  -0.295
  721   1H2     G 226          1H2         G 226   8.764  25.243  -1.229
  722   2H2     G 226          2H2         G 226   8.553  24.880  -2.929
  723   1H5*    G 227          1H5*        G 227  13.857  28.133 -11.752
  724   2H5*    G 227          2H5*        G 227  15.592  27.821 -11.775
  725    H4*    G 227           H4*        G 227  14.890  29.958 -12.857
  726    H3*    G 227           H3*        G 227  16.891  29.945 -10.609
  727    H2*    G 227           H2*        G 227  17.255  32.273 -10.954
  728   2HO*    G 227          2HO*        G 227  15.336  32.543 -12.949
  729    H1*    G 227           H1*        G 227  14.505  32.845 -10.990
  730    H8     G 227           H8         G 227  15.358  30.265  -8.412
  731    H1     G 227           H1         G 227  16.207  36.352  -6.385
  732   1H2     G 227          1H2         G 227  16.024  37.642  -7.983
  733   2H2     G 227          2H2         G 227  15.690  37.148  -9.628
  734   1H5*    A 228          1H5*        A 228  18.713  31.898 -14.198
  735   2H5*    A 228          2H5*        A 228  20.462  31.957 -13.978
  736    H4*    A 228           H4*        A 228  19.270  34.178 -14.108
  737    H3*    A 228           H3*        A 228  21.110  33.474 -11.827
  738    H2*    A 228           H2*        A 228  20.906  35.696 -11.015
  739   2HO*    A 228          2HO*        A 228  20.670  37.104 -12.647
  740    H1*    A 228           H1*        A 228  18.104  35.714 -11.304
  741    H8     A 228           H8         A 228  19.005  32.402  -9.976
  742   1H6     A 228          1H6         A 228  19.269  34.981  -4.299
  743   2H6     A 228          2H6         A 228  19.260  33.462  -5.167
  744    H2     A 228           H2         A 228  18.998  38.248  -7.299
  745   1H5*    G 229          1H5*        G 229  22.850  37.225 -13.918
  746   2H5*    G 229          2H5*        G 229  24.582  36.896 -13.870
  747    H4*    G 229           H4*        G 229  24.062  39.120 -13.017
  748    H3*    G 229           H3*        G 229  25.283  37.118 -11.148
  749    H2*    G 229           H2*        G 229  25.389  38.760  -9.424
  750   2HO*    G 229          2HO*        G 229  25.634  40.750 -10.250
  751    H1*    G 229           H1*        G 229  22.715  39.505  -9.740
  752    H8     G 229           H8         G 229  22.750  35.867 -10.253
  753    H1     G 229           H1         G 229  23.270  37.471  -4.005
  754   1H2     G 229          1H2         G 229  23.663  39.490  -3.842
  755   2H2     G 229          2H2         G 229  23.829  40.583  -5.197
  756   1H5*    G 230          1H5*        G 230  28.168  40.967 -10.886
  757   2H5*    G 230          2H5*        G 230  29.660  40.042 -10.726
  758    H4*    G 230           H4*        G 230  29.261  41.749  -8.940
  759    H3*    G 230           H3*        G 230  29.759  38.859  -8.286
  760    H2*    G 230           H2*        G 230  29.764  39.387  -5.963
  761   2HO*    G 230          2HO*        G 230  29.174  42.098  -6.548
  762    H1*    G 230           H1*        G 230  27.363  40.798  -6.099
  763    H8     G 230           H8         G 230  26.948  37.991  -8.437
  764    H1     G 230           H1         G 230  26.384  36.155  -2.257
  765   1H2     G 230          1H2         G 230  27.036  37.674  -1.024
  766   2H2     G 230          2H2         G 230  27.645  39.216  -1.583
  767   1H5*    G 231          1H5*        G 231  32.990  41.336  -5.412
  768   2H5*    G 231          2H5*        G 231  34.225  40.153  -5.841
  769    H4*    G 231           H4*        G 231  33.868  40.490  -3.386
  770    H3*    G 231           H3*        G 231  33.677  37.773  -4.655
  771    H2*    G 231           H2*        G 231  33.399  36.791  -2.502
  772   2HO*    G 231          2HO*        G 231  33.413  39.300  -1.222
  773    H1*    G 231           H1*        G 231  31.381  38.570  -1.762
  774    H8     G 231           H8         G 231  30.899  37.853  -5.357
  775    H1     G 231           H1         G 231  28.726  33.100  -1.540
  776   1H2     G 231          1H2         G 231  29.387  33.409   0.389
  777   2H2     G 231          2H2         G 231  30.383  34.755   0.896
  778   1H5*    C 232          1H5*        C 232  36.074  37.656  -1.499
  779   2H5*    C 232          2H5*        C 232  37.684  36.954  -1.649
  780    H4*    C 232           H4*        C 232  36.754  35.874   0.192
  781    H3*    C 232           H3*        C 232  36.558  34.142  -2.259
  782    H2*    C 232           H2*        C 232  35.649  32.388  -0.942
  783   2HO*    C 232          2HO*        C 232  35.568  33.700   1.466
  784    H1*    C 232           H1*        C 232  33.785  34.045   0.322
  785   1H4     C 232          1H4         C 232  30.557  31.606  -4.611
  786   2H4     C 232          2H4         C 232  31.317  32.766  -5.678
  787    H5     C 232           H5         C 232  33.004  34.271  -4.996
  788    H6     C 232           H6         C 232  34.392  35.042  -3.105
  789   1H5*    A 233          1H5*        A 233  38.251  32.015   0.841
  790   2H5*    A 233          2H5*        A 233  39.701  31.100   0.428
  791    H4*    A 233           H4*        A 233  38.234  29.590   1.489
  792    H3*    A 233           H3*        A 233  38.356  29.203  -1.489
  793    H2*    A 233           H2*        A 233  36.946  27.296  -1.295
  794   2HO*    A 233          2HO*        A 233  36.359  27.184   1.281
  795    H1*    A 233           H1*        A 233  35.071  28.622   0.297
  796    H8     A 233           H8         A 233  36.339  31.024  -2.235
  797   1H6     A 233          1H6         A 233  32.130  28.660  -6.189
  798   2H6     A 233          2H6         A 233  33.279  29.957  -5.951
  799    H2     A 233           H2         A 233  32.275  26.054  -2.593
  800   1H5*    G 234          1H5*        G 234  39.093  25.221   0.124
  801   2H5*    G 234          2H5*        G 234  40.671  24.777  -0.525
  802    H4*    G 234           H4*        G 234  39.332  22.929  -0.972
  803    H3*    G 234           H3*        G 234  39.601  24.655  -3.415
  804    H2*    G 234           H2*        G 234  38.343  23.070  -4.674
  805   2HO*    G 234          2HO*        G 234  38.512  21.039  -3.918
  806    H1*    G 234           H1*        G 234  36.290  22.943  -2.787
  807    H8     G 234           H8         G 234  37.663  26.420  -3.067
  808    H1     G 234           H1         G 234  33.176  25.018  -7.514
  809   1H2     G 234          1H2         G 234  32.752  23.002  -7.454
  810   2H2     G 234          2H2         G 234  33.501  21.860  -6.360
  811   1H    GLY  15          1H        GLY  15   3.965  -1.166  -3.484
  812   1HA   GLY  15          1HA       GLY  15   5.559  -1.469  -1.755
  813   2HA   GLY  15          2HA       GLY  15   6.506  -1.632  -3.226
  814    H    ARG  16           H        ARG  16   8.376  -0.919  -2.131
  815    HA   ARG  16           HA       ARG  16   8.560   1.504  -0.715
  816   1HB   ARG  16          2HB       ARG  16  10.744   0.064  -2.233
  817   2HB   ARG  16          3HB       ARG  16  10.977   1.266  -0.970
  818   1HG   ARG  16          2HG       ARG  16  11.196  -0.523   0.356
  819   2HG   ARG  16          3HG       ARG  16   9.432  -0.531   0.330
  820   1HD   ARG  16          2HD       ARG  16   9.588  -2.619  -0.438
  821   2HD   ARG  16          3HD       ARG  16  10.118  -1.905  -1.961
  822    HE   ARG  16           HE       ARG  16  12.253  -2.629  -1.528
  823   1HH1  ARG  16          2HH1      ARG  16  10.315  -2.922   1.350
  824   2HH1  ARG  16          1HH1      ARG  16  11.511  -3.826   2.220
  825   1HH2  ARG  16          2HH2      ARG  16  13.835  -3.817  -0.393
  826   2HH2  ARG  16          1HH2      ARG  16  13.513  -4.333   1.228
  827    H    ALA  17           H        ALA  17  10.013   0.848  -3.905
  828    HA   ALA  17           HA       ALA  17  10.290   2.151  -5.750
  829   1HB   ALA  17          1HB       ALA  17   8.600   3.766  -6.311
  830   2HB   ALA  17          2HB       ALA  17   7.825   2.350  -5.598
  831   3HB   ALA  17          3HB       ALA  17   8.036   3.816  -4.641
  832    H    ARG  18           H        ARG  18  11.323   2.895  -2.898
  833    HA   ARG  18           HA       ARG  18  11.740   5.687  -2.879
  834   1HB   ARG  18          2HB       ARG  18  11.998   4.088  -0.930
  835   2HB   ARG  18          3HB       ARG  18  13.545   3.621  -1.623
  836   1HG   ARG  18          2HG       ARG  18  14.014   5.219   0.043
  837   2HG   ARG  18          3HG       ARG  18  14.202   6.048  -1.502
  838   1HD   ARG  18          2HD       ARG  18  11.842   6.869  -1.230
  839   2HD   ARG  18          3HD       ARG  18  11.881   6.218   0.408
  840    HE   ARG  18           HE       ARG  18  14.067   7.808   0.324
  841   1HH1  ARG  18          2HH1      ARG  18  10.711   8.309  -0.455
  842   2HH1  ARG  18          1HH1      ARG  18  10.731   9.991  -0.040
  843   1HH2  ARG  18          2HH2      ARG  18  14.105  10.020   0.874
  844   2HH2  ARG  18          1HH2      ARG  18  12.663  10.964   0.716
  845    H    GLY  19           H        GLY  19  12.435   6.316  -4.940
  846   1HA   GLY  19          1HA       GLY  19  14.924   6.957  -5.495
  847   2HA   GLY  19          2HA       GLY  19  14.985   5.248  -5.901
  848    H    LEU  20           H        LEU  20  11.960   5.865  -6.654
  849    HA   LEU  20           HA       LEU  20  12.611   6.792  -9.375
  850   1HB   LEU  20          2HB       LEU  20  11.031   4.522  -8.381
  851   2HB   LEU  20          3HB       LEU  20  10.279   5.441  -9.685
  852    HG   LEU  20           HG       LEU  20  13.083   4.677 -10.149
  853   1HD1  LEU  20          1HD1      LEU  20  12.621   2.374 -10.638
  854   2HD1  LEU  20          2HD1      LEU  20  10.928   2.572 -10.187
  855   3HD1  LEU  20          3HD1      LEU  20  12.187   2.692  -8.959
  856   1HD2  LEU  20          1HD2      LEU  20  10.845   4.017 -11.976
  857   2HD2  LEU  20          2HD2      LEU  20  12.440   4.684 -12.327
  858   3HD2  LEU  20          3HD2      LEU  20  11.172   5.724 -11.677
  859    H    CYS  21           H        CYS  21  11.769   8.779  -9.884
  860    HA   CYS  21           HA       CYS  21   9.991  10.073  -8.198
  861   1HB   CYS  21          2HB       CYS  21  11.484  11.281  -9.699
  862   2HB   CYS  21          3HB       CYS  21  10.670  10.624 -11.104
  863    H    TYR  22           H        TYR  22   7.782  10.378  -8.342
  864    HA   TYR  22           HA       TYR  22   6.321   8.507 -10.084
  865   1HB   TYR  22          2HB       TYR  22   6.151   8.191  -7.585
  866   2HB   TYR  22          3HB       TYR  22   5.322   9.742  -7.513
  867    HD1  TYR  22           HD1      TYR  22   4.969   7.051 -10.058
  868    HD2  TYR  22           HD2      TYR  22   3.154   9.173  -6.849
  869    HE1  TYR  22           HE1      TYR  22   2.834   5.926 -10.530
  870    HE2  TYR  22           HE2      TYR  22   1.014   8.053  -7.311
  871    HH   TYR  22           HH       TYR  22   0.758   5.367  -9.397
  872    H    THR  23           H        THR  23   7.154  11.010 -11.069
  873    HA   THR  23           HA       THR  23   4.540  12.224 -11.592
  874    HB   THR  23           HB       THR  23   7.017  13.774 -10.818
  875    HG1  THR  23           HG1      THR  23   4.413  13.850  -9.675
  876   1HG2  THR  23          1HG2      THR  23   5.611  15.785 -11.182
  877   2HG2  THR  23          2HG2      THR  23   4.369  14.753 -11.892
  878   3HG2  THR  23          3HG2      THR  23   5.945  14.901 -12.670
  879    H    CYS  24           H        CYS  24   8.057  12.194 -12.512
  880    HA   CYS  24           HA       CYS  24   7.145  12.652 -15.257
  881   1HB   CYS  24          2HB       CYS  24   9.401  13.484 -15.732
  882   2HB   CYS  24          3HB       CYS  24   8.644  14.403 -14.446
  883    H    GLY  25           H        GLY  25   9.089  10.727 -13.048
  884   1HA   GLY  25          1HA       GLY  25   9.214   8.331 -13.334
  885   2HA   GLY  25          2HA       GLY  25   9.220   8.588 -15.073
  886    H    SER  26           H        SER  26  11.147  10.512 -12.881
  887    HA   SER  26           HA       SER  26  13.556   9.432 -14.154
  888   1HB   SER  26          2HB       SER  26  12.941  11.969 -14.028
  889   2HB   SER  26          3HB       SER  26  13.545  11.851 -12.375
  890    HG   SER  26           HG       SER  26  15.529  11.578 -13.100
  891    HA   PRO  27           HA       PRO  27  14.294   7.199 -10.361
  892   1HB   PRO  27          2HB       PRO  27  16.614   6.053 -11.179
  893   2HB   PRO  27          3HB       PRO  27  15.024   5.477 -11.695
  894   1HG   PRO  27          2HG       PRO  27  16.959   7.245 -13.141
  895   2HG   PRO  27          3HG       PRO  27  15.996   5.893 -13.766
  896   1HD   PRO  27          2HD       PRO  27  15.283   8.480 -14.126
  897   2HD   PRO  27          3HD       PRO  27  14.091   7.176 -13.957
  898    H    GLY  28           H        GLY  28  14.746   8.862  -8.916
  899   1HA   GLY  28          1HA       GLY  28  17.219   9.115  -7.820
  900   2HA   GLY  28          2HA       GLY  28  17.212  10.347  -9.073
  901    H    HIS  29           H        HIS  29  15.161  11.763  -9.024
  902    HA   HIS  29           HA       HIS  29  14.906  12.750  -6.291
  903   1HB   HIS  29          2HB       HIS  29  14.065  14.783  -7.261
  904   2HB   HIS  29          3HB       HIS  29  15.486  14.293  -8.177
  905    HD1  HIS  29           HD1      HIS  29  15.206  14.170 -10.641
  906    HD2  HIS  29           HD2      HIS  29  11.562  14.068  -8.646
  907    HE1  HIS  29           HE1      HIS  29  13.451  14.252 -12.441
  908    H    TYR  30           H        TYR  30  12.675  13.707  -5.752
  909    HA   TYR  30           HA       TYR  30  10.634  11.693  -6.432
  910   1HB   TYR  30          2HB       TYR  30  11.536  12.775  -3.894
  911   2HB   TYR  30          3HB       TYR  30   9.801  12.989  -4.103
  912    HD1  TYR  30           HD1      TYR  30  12.313  10.295  -4.784
  913    HD2  TYR  30           HD2      TYR  30   8.514  11.329  -3.171
  914    HE1  TYR  30           HE1      TYR  30  11.954   7.948  -4.143
  915    HE2  TYR  30           HE2      TYR  30   8.145   8.985  -2.523
  916    HH   TYR  30           HH       TYR  30   9.113   6.965  -2.289
  917    H    GLN  31           H        GLN  31   8.338  12.605  -5.982
  918    HA   GLN  31           HA       GLN  31   7.709  14.485  -7.886
  919   1HB   GLN  31          2HB       GLN  31   5.981  13.095  -7.020
  920   2HB   GLN  31          3HB       GLN  31   6.236  13.682  -5.382
  921   1HG   GLN  31          2HG       GLN  31   5.246  15.754  -5.853
  922   2HG   GLN  31          3HG       GLN  31   5.334  15.493  -7.594
  923   1HE2  GLN  31          1HE2      GLN  31   3.221  15.743  -5.220
  924   2HE2  GLN  31          2HE2      GLN  31   1.993  14.648  -5.746
  925    H    ALA  32           H        ALA  32   8.380  14.993  -4.455
  926    HA   ALA  32           HA       ALA  32   7.695  17.705  -4.306
  927   1HB   ALA  32          1HB       ALA  32   9.869  16.325  -2.741
  928   2HB   ALA  32          2HB       ALA  32   8.978  17.775  -2.280
  929   3HB   ALA  32          3HB       ALA  32   8.150  16.220  -2.363
  930    H    GLN  33           H        GLN  33  10.565  16.104  -5.499
  931    HA   GLN  33           HA       GLN  33  11.806  18.724  -6.002
  932   1HB   GLN  33          2HB       GLN  33  12.899  16.032  -5.394
  933   2HB   GLN  33          3HB       GLN  33  13.812  17.022  -6.523
  934   1HG   GLN  33          2HG       GLN  33  14.631  18.271  -4.890
  935   2HG   GLN  33          3HG       GLN  33  13.027  18.553  -4.214
  936   1HE2  GLN  33          1HE2      GLN  33  12.446  17.522  -2.400
  937   2HE2  GLN  33          2HE2      GLN  33  13.414  16.349  -1.580
  938    H    CYS  34           H        CYS  34   9.671  17.057  -7.613
  939    HA   CYS  34           HA       CYS  34  11.069  16.338  -9.972
  940   1HB   CYS  34          2HB       CYS  34   8.892  15.330  -9.231
  941   2HB   CYS  34          3HB       CYS  34   8.095  16.840  -9.622
  942    HA   PRO  35           HA       PRO  35  11.484  20.531 -11.444
  943   1HB   PRO  35          2HB       PRO  35  12.435  19.879 -13.902
  944   2HB   PRO  35          3HB       PRO  35  13.422  19.799 -12.438
  945   1HG   PRO  35          2HG       PRO  35  12.002  17.597 -13.886
  946   2HG   PRO  35          3HG       PRO  35  13.632  17.608 -13.187
  947   1HD   PRO  35          2HD       PRO  35  11.518  16.462 -11.940
  948   2HD   PRO  35          3HD       PRO  35  12.854  17.224 -11.051
  949    H    LYS  36           H        LYS  36   9.393  18.118 -12.650
  950    HA   LYS  36           HA       LYS  36   8.201  19.915 -14.631
  951   1HB   LYS  36          2HB       LYS  36   8.345  17.018 -14.274
  952   2HB   LYS  36          3HB       LYS  36   6.725  17.578 -14.667
  953   1HG   LYS  36          2HG       LYS  36   7.652  18.754 -16.635
  954   2HG   LYS  36          3HG       LYS  36   9.233  18.064 -16.260
  955   1HD   LYS  36          2HD       LYS  36   8.338  15.818 -16.532
  956   2HD   LYS  36          3HD       LYS  36   6.731  16.480 -16.844
  957   1HE   LYS  36          2HE       LYS  36   7.431  17.449 -18.890
  958   2HE   LYS  36          3HE       LYS  36   9.132  17.166 -18.523
  959   1HZ   LYS  36          1HZ       LYS  36   8.978  14.965 -19.049
  960   2HZ   LYS  36          2HZ       LYS  36   7.831  15.590 -20.124
  961   3HZ   LYS  36          3HZ       LYS  36   7.330  14.859 -18.683
  962    H    LYS  37           H        LYS  37   7.942  19.422 -11.425
  963    HA   LYS  37           HA       LYS  37   5.019  19.723 -11.357
  964   1HB   LYS  37          2HB       LYS  37   7.000  18.510  -9.566
  965   2HB   LYS  37          3HB       LYS  37   5.827  19.523  -8.736
  966   1HG   LYS  37          2HG       LYS  37   4.753  17.609 -10.712
  967   2HG   LYS  37          3HG       LYS  37   5.434  16.930  -9.231
  968   1HD   LYS  37          2HD       LYS  37   3.430  19.173  -9.202
  969   2HD   LYS  37          3HD       LYS  37   2.946  17.476  -9.215
  970   1HE   LYS  37          2HE       LYS  37   3.333  17.293  -7.033
  971   2HE   LYS  37          3HE       LYS  37   4.970  17.919  -7.224
  972   1HZ   LYS  37          1HZ       LYS  37   2.488  19.387  -6.621
  973   2HZ   LYS  37          2HZ       LYS  37   3.793  20.187  -7.341
  974   3HZ   LYS  37          3HZ       LYS  37   3.982  19.449  -5.830
  975    H    ARG  38           H        ARG  38   4.428  21.090  -9.230
  976    HA   ARG  38           HA       ARG  38   5.853  23.653  -9.523
  977   1HB   ARG  38          2HB       ARG  38   3.792  24.794  -9.087
  978   2HB   ARG  38          3HB       ARG  38   3.491  23.604 -10.346
  979   1HG   ARG  38          2HG       ARG  38   2.717  22.085  -8.412
  980   2HG   ARG  38          3HG       ARG  38   2.618  23.585  -7.487
  981   1HD   ARG  38          2HD       ARG  38   1.181  24.507  -9.326
  982   2HD   ARG  38          3HD       ARG  38   1.152  22.889 -10.025
  983    HE   ARG  38           HE       ARG  38   0.352  22.808  -7.313
  984   1HH1  ARG  38          2HH1      ARG  38  -0.759  23.762 -10.472
  985   2HH1  ARG  38          1HH1      ARG  38  -2.435  23.528 -10.096
  986   1HH2  ARG  38          2HH2      ARG  38  -1.850  22.496  -6.806
  987   2HH2  ARG  38          1HH2      ARG  38  -3.054  22.809  -8.010
  988    H    LYS  39           H        LYS  39   4.848  25.045  -7.421
  989    HA   LYS  39           HA       LYS  39   5.789  23.502  -5.092
  990   1HB   LYS  39          2HB       LYS  39   5.925  26.502  -5.361
  991   2HB   LYS  39          3HB       LYS  39   6.752  25.480  -4.191
  992   1HG   LYS  39          2HG       LYS  39   7.288  25.480  -7.154
  993   2HG   LYS  39          3HG       LYS  39   8.240  26.353  -5.950
  994   1HD   LYS  39          2HD       LYS  39   9.119  24.416  -5.048
  995   2HD   LYS  39          3HD       LYS  39   7.781  23.419  -5.622
  996   1HE   LYS  39          2HE       LYS  39   9.560  24.745  -7.614
  997   2HE   LYS  39          3HE       LYS  39  10.144  23.312  -6.770
  998   1HZ   LYS  39          1HZ       LYS  39   9.133  22.517  -8.702
  999   2HZ   LYS  39          2HZ       LYS  39   7.805  23.555  -8.562
 1000   3HZ   LYS  39          3HZ       LYS  39   7.975  22.252  -7.496
 1001    H    SER  40           H        SER  40   5.091  25.137  -3.053
 1002    HA   SER  40           HA       SER  40   2.506  26.225  -3.134
 1003   1HB   SER  40          2HB       SER  40   2.345  23.505  -3.347
 1004   2HB   SER  40          3HB       SER  40   2.237  23.722  -1.600
 1005    HG   SER  40           HG       SER  40   0.179  23.881  -2.376
 1006    H    GLY  41           H        GLY  41   1.544  25.776  -0.630
 1007   1HA   GLY  41          1HA       GLY  41   3.186  25.566   1.536
 1008   2HA   GLY  41          2HA       GLY  41   3.453  27.210   0.975
 1009    H    ASN  42           H        ASN  42   2.602  27.941   2.998
 1010    HA   ASN  42           HA       ASN  42  -0.077  28.729   2.891
 1011   1HB   ASN  42          2HB       ASN  42  -0.779  27.375   5.011
 1012   2HB   ASN  42          3HB       ASN  42  -0.895  26.619   3.425
 1013   1HD2  ASN  42          1HD2      ASN  42   0.221  24.810   3.032
 1014   2HD2  ASN  42          2HD2      ASN  42   1.327  24.074   4.138
 1015    H    SER  43           H        SER  43  -0.163  30.552   4.020
 1016    HA   SER  43           HA       SER  43   0.676  30.892   6.663
 1017   1HB   SER  43          2HB       SER  43   2.784  31.209   4.672
 1018   2HB   SER  43          3HB       SER  43   2.559  32.661   5.647
 1019    HG   SER  43           HG       SER  43   3.621  30.251   6.337
 1020    H    ARG  44           H        ARG  44   1.202  33.076   3.907
 1021    HA   ARG  44           HA       ARG  44  -1.268  34.435   4.167
 1022   1HB   ARG  44          2HB       ARG  44   0.381  35.105   6.205
 1023   2HB   ARG  44          3HB       ARG  44   0.882  36.286   5.001
 1024   1HG   ARG  44          2HG       ARG  44  -1.069  37.423   5.101
 1025   2HG   ARG  44          3HG       ARG  44  -2.026  35.974   5.416
 1026   1HD   ARG  44          2HD       ARG  44  -1.810  36.163   7.654
 1027   2HD   ARG  44          3HD       ARG  44  -0.146  36.736   7.548
 1028    HE   ARG  44           HE       ARG  44  -0.921  38.893   7.580
 1029   1HH1  ARG  44          2HH1      ARG  44  -3.570  36.728   6.937
 1030   2HH1  ARG  44          1HH1      ARG  44  -4.782  37.957   7.090
 1031   1HH2  ARG  44          2HH2      ARG  44  -2.507  40.519   7.785
 1032   2HH2  ARG  44          1HH2      ARG  44  -4.176  40.114   7.571
 1033    H    GLU  45           H        GLU  45  -1.634  35.749   2.438
 1034    HA   GLU  45           HA       GLU  45  -1.329  36.732   0.409
 1035   1HB   GLU  45          2HB       GLU  45   1.588  36.974   1.139
 1036   2HB   GLU  45          3HB       GLU  45   0.684  37.957  -0.005
 1037   1HG   GLU  45          2HG       GLU  45   0.431  37.930   2.989
 1038   2HG   GLU  45          3HG       GLU  45   1.017  39.241   1.967
 1039    H    ARG  46           H        ARG  46  -1.649  35.283  -1.160
 1040    HA   ARG  46           HA       ARG  46   0.336  33.206  -1.659
 1041   1HB   ARG  46          2HB       ARG  46  -2.244  32.882  -1.586
 1042   2HB   ARG  46          3HB       ARG  46  -2.208  33.546  -3.213
 1043   1HG   ARG  46          2HG       ARG  46  -0.926  31.751  -4.032
 1044   2HG   ARG  46          3HG       ARG  46  -0.529  31.195  -2.404
 1045   1HD   ARG  46          2HD       ARG  46  -3.243  31.142  -3.718
 1046   2HD   ARG  46          3HD       ARG  46  -2.208  29.753  -3.388
 1047    HE   ARG  46           HE       ARG  46  -2.590  30.900  -0.946
 1048   1HH1  ARG  46          2HH1      ARG  46  -4.694  29.727  -3.461
 1049   2HH1  ARG  46          1HH1      ARG  46  -5.962  29.278  -2.370
 1050   1HH2  ARG  46          2HH2      ARG  46  -4.254  30.311   0.500
 1051   2HH2  ARG  46          1HH2      ARG  46  -5.711  29.611  -0.118
 1052    H    CYS  47           H        CYS  47   0.797  32.674  -4.101
 1053    HA   CYS  47           HA       CYS  47   1.175  35.241  -5.465
 1054   1HB   CYS  47          2HB       CYS  47   3.315  34.378  -4.625
 1055   2HB   CYS  47          3HB       CYS  47   3.051  32.853  -5.446
 1056    H    GLN  48           H        GLN  48  -0.004  35.296  -7.254
 1057    HA   GLN  48           HA       GLN  48  -1.026  32.829  -8.436
 1058   1HB   GLN  48          2HB       GLN  48  -2.173  35.312  -7.958
 1059   2HB   GLN  48          3HB       GLN  48  -1.896  35.305  -9.694
 1060   1HG   GLN  48          2HG       GLN  48  -3.246  33.404 -10.007
 1061   2HG   GLN  48          3HG       GLN  48  -3.275  33.047  -8.281
 1062   1HE2  GLN  48          1HE2      GLN  48  -5.639  32.988  -9.062
 1063   2HE2  GLN  48          2HE2      GLN  48  -6.528  34.453  -8.843
 1064    H    LEU  49           H        LEU  49   1.759  33.571  -8.777
 1065    HA   LEU  49           HA       LEU  49   1.794  33.783 -11.712
 1066   1HB   LEU  49          2HB       LEU  49   2.874  35.626  -9.882
 1067   2HB   LEU  49          3HB       LEU  49   4.241  34.748 -10.566
 1068    HG   LEU  49           HG       LEU  49   2.210  35.849 -12.439
 1069   1HD1  LEU  49          1HD1      LEU  49   2.780  38.033 -12.228
 1070   2HD1  LEU  49          2HD1      LEU  49   4.401  37.669 -11.634
 1071   3HD1  LEU  49          3HD1      LEU  49   3.015  37.545 -10.549
 1072   1HD2  LEU  49          1HD2      LEU  49   5.180  35.388 -12.449
 1073   2HD2  LEU  49          2HD2      LEU  49   4.353  36.299 -13.712
 1074   3HD2  LEU  49          3HD2      LEU  49   3.947  34.603 -13.436
 1075    H    CYS  50           H        CYS  50   3.319  32.488  -8.730
 1076    HA   CYS  50           HA       CYS  50   4.517  30.452 -10.454
 1077   1HB   CYS  50          2HB       CYS  50   6.580  30.490  -9.323
 1078   2HB   CYS  50          3HB       CYS  50   6.213  32.175  -9.631
 1079    H    ASN  51           H        ASN  51   2.110  30.972  -8.603
 1080    HA   ASN  51           HA       ASN  51   0.811  29.808  -7.144
 1081   1HB   ASN  51          2HB       ASN  51   2.091  27.907  -8.731
 1082   2HB   ASN  51          3HB       ASN  51   2.319  27.322  -7.085
 1083   1HD2  ASN  51          1HD2      ASN  51   0.464  26.934  -5.792
 1084   2HD2  ASN  51          2HD2      ASN  51  -1.062  26.585  -6.526
 1085    H    GLY  52           H        GLY  52   3.453  31.105  -6.312
 1086   1HA   GLY  52          1HA       GLY  52   4.548  29.675  -4.151
 1087   2HA   GLY  52          2HA       GLY  52   4.634  31.417  -4.370
 1088    H    MET  53           H        MET  53   4.408  30.255  -1.857
 1089    HA   MET  53           HA       MET  53   1.743  31.208  -1.065
 1090   1HB   MET  53          2HB       MET  53   2.984  28.585  -0.546
 1091   2HB   MET  53          3HB       MET  53   2.264  29.358   0.862
 1092   1HG   MET  53          2HG       MET  53   0.757  29.066  -1.711
 1093   2HG   MET  53          3HG       MET  53   0.816  27.772  -0.516
 1094   1HE   MET  53          1HE       MET  53  -2.681  28.813   0.476
 1095   2HE   MET  53          2HE       MET  53  -1.912  28.229  -1.000
 1096   3HE   MET  53          3HE       MET  53  -1.496  27.509   0.556
 1097    H    GLY  54           H        GLY  54   2.582  33.195  -0.418
 1098   1HA   GLY  54          1HA       GLY  54   3.186  33.724   2.126
 1099   2HA   GLY  54          2HA       GLY  54   4.763  33.254   1.508
 1100    H    HIS  55           H        HIS  55   4.763  34.364  -0.997
 1101    HA   HIS  55           HA       HIS  55   4.859  37.214  -0.333
 1102   1HB   HIS  55          2HB       HIS  55   6.282  37.411  -2.351
 1103   2HB   HIS  55          3HB       HIS  55   6.929  36.265  -1.180
 1104    HD1  HIS  55           HD1      HIS  55   6.542  33.678  -1.781
 1105    HD2  HIS  55           HD2      HIS  55   5.872  36.393  -4.854
 1106    HE1  HIS  55           HE1      HIS  55   6.556  32.318  -3.896
 1107    H    ASN  56           H        ASN  56   4.683  38.471  -2.680
 1108    HA   ASN  56           HA       ASN  56   1.992  37.779  -3.663
 1109   1HB   ASN  56          2HB       ASN  56   3.271  40.454  -3.130
 1110   2HB   ASN  56          3HB       ASN  56   1.877  40.296  -4.193
 1111   1HD2  ASN  56          1HD2      ASN  56   2.796  40.971  -1.135
 1112   2HD2  ASN  56          2HD2      ASN  56   1.342  40.570  -0.291
 1113    H    ALA  57           H        ALA  57   1.536  38.129  -5.873
 1114    HA   ALA  57           HA       ALA  57   3.502  37.345  -7.671
 1115   1HB   ALA  57          1HB       ALA  57   0.750  37.960  -7.773
 1116   2HB   ALA  57          2HB       ALA  57   1.536  38.876  -9.060
 1117   3HB   ALA  57          3HB       ALA  57   1.727  37.125  -8.981
 1118    H    LYS  58           H        LYS  58   2.372  40.590  -6.838
 1119    HA   LYS  58           HA       LYS  58   3.788  42.013  -8.794
 1120   1HB   LYS  58          2HB       LYS  58   2.944  42.843  -6.013
 1121   2HB   LYS  58          3HB       LYS  58   3.561  43.952  -7.232
 1122   1HG   LYS  58          2HG       LYS  58   1.663  43.231  -8.707
 1123   2HG   LYS  58          3HG       LYS  58   1.009  42.362  -7.316
 1124   1HD   LYS  58          2HD       LYS  58  -0.082  44.466  -7.366
 1125   2HD   LYS  58          3HD       LYS  58   1.103  44.551  -6.060
 1126   1HE   LYS  58          2HE       LYS  58   2.585  45.451  -8.130
 1127   2HE   LYS  58          3HE       LYS  58   0.985  46.008  -8.620
 1128   1HZ   LYS  58          1HZ       LYS  58   2.686  47.188  -6.784
 1129   2HZ   LYS  58          2HZ       LYS  58   1.407  46.551  -5.878
 1130   3HZ   LYS  58          3HZ       LYS  58   1.093  47.633  -7.140
 1131    H    GLN  59           H        GLN  59   4.834  40.491  -5.877
 1132    HA   GLN  59           HA       GLN  59   7.499  41.705  -6.207
 1133   1HB   GLN  59          2HB       GLN  59   6.009  41.937  -3.992
 1134   2HB   GLN  59          3HB       GLN  59   6.780  40.397  -3.638
 1135   1HG   GLN  59          2HG       GLN  59   8.946  41.362  -3.742
 1136   2HG   GLN  59          3HG       GLN  59   8.309  42.870  -4.399
 1137   1HE2  GLN  59          1HE2      GLN  59   9.685  41.754  -1.785
 1138   2HE2  GLN  59          2HE2      GLN  59   8.869  42.646  -0.550
 1139    H    CYS  60           H        CYS  60   6.222  39.205  -7.492
 1140    HA   CYS  60           HA       CYS  60   7.668  37.074  -6.239
 1141   1HB   CYS  60          2HB       CYS  60   5.500  36.607  -7.243
 1142   2HB   CYS  60          3HB       CYS  60   6.051  37.181  -8.805
 1143    H    ARG  61           H        ARG  61   9.822  37.270  -6.434
 1144    HA   ARG  61           HA       ARG  61  11.912  37.496  -7.309
 1145   1HB   ARG  61          2HB       ARG  61  10.522  36.470  -9.791
 1146   2HB   ARG  61          3HB       ARG  61  12.262  36.506  -9.542
 1147   1HG   ARG  61          2HG       ARG  61  10.643  35.102  -7.504
 1148   2HG   ARG  61          3HG       ARG  61  10.788  34.343  -9.090
 1149   1HD   ARG  61          2HD       ARG  61  13.113  34.164  -8.921
 1150   2HD   ARG  61          3HD       ARG  61  13.198  35.351  -7.620
 1151    HE   ARG  61           HE       ARG  61  12.729  33.690  -6.106
 1152   1HH1  ARG  61          2HH1      ARG  61  12.128  32.533  -9.333
 1153   2HH1  ARG  61          1HH1      ARG  61  11.914  30.885  -8.843
 1154   1HH2  ARG  61          2HH2      ARG  61  12.448  31.524  -5.447
 1155   2HH2  ARG  61          1HH2      ARG  61  12.094  30.312  -6.633
 1156    H    LYS  62           H        LYS  62  13.014  38.299  -9.602
 1157    HA   LYS  62           HA       LYS  62  11.687  40.777 -10.423
 1158   1HB   LYS  62          2HB       LYS  62  13.561  42.154  -9.955
 1159   2HB   LYS  62          3HB       LYS  62  13.268  41.219  -8.495
 1160   1HG   LYS  62          2HG       LYS  62  15.487  40.892  -8.593
 1161   2HG   LYS  62          3HG       LYS  62  15.038  39.613  -9.723
 1162   1HD   LYS  62          2HD       LYS  62  15.632  40.877 -11.583
 1163   2HD   LYS  62          3HD       LYS  62  15.533  42.402 -10.699
 1164   1HE   LYS  62          2HE       LYS  62  17.582  42.064  -9.647
 1165   2HE   LYS  62          3HE       LYS  62  17.557  40.327  -9.944
 1166   1HZ   LYS  62          1HZ       LYS  62  17.624  41.112 -12.420
 1167   2HZ   LYS  62          2HZ       LYS  62  19.046  41.009 -11.510
 1168   3HZ   LYS  62          3HZ       LYS  62  18.305  42.510 -11.751
 1169    H    ARG  63           H        ARG  63  12.944  41.841 -12.253
 1170    HA   ARG  63           HA       ARG  63  14.818  40.455 -13.794
 1171   1HB   ARG  63          2HB       ARG  63  12.413  39.154 -13.925
 1172   2HB   ARG  63          3HB       ARG  63  12.314  40.225 -15.317
 1173   1HG   ARG  63          2HG       ARG  63  14.514  38.245 -14.763
 1174   2HG   ARG  63          3HG       ARG  63  13.210  38.055 -15.937
 1175   1HD   ARG  63          2HD       ARG  63  14.753  38.883 -17.362
 1176   2HD   ARG  63          3HD       ARG  63  14.193  40.428 -16.723
 1177    HE   ARG  63           HE       ARG  63  16.225  39.605 -15.051
 1178   1HH1  ARG  63          2HH1      ARG  63  15.863  40.356 -18.431
 1179   2HH1  ARG  63          1HH1      ARG  63  17.496  40.902 -18.620
 1180   1HH2  ARG  63          2HH2      ARG  63  18.378  40.320 -15.286
 1181   2HH2  ARG  63          1HH2      ARG  63  18.926  40.880 -16.829
 1182    H    ASP  64           H        ASP  64  15.751  42.276 -14.482
 1183    HA   ASP  64           HA       ASP  64  16.098  44.221 -15.609
 1184   1HB   ASP  64          2HB       ASP  64  14.858  42.900 -17.400
 1185   2HB   ASP  64          3HB       ASP  64  13.416  43.792 -16.924
  Start of MODEL   15
    1   1H5*    C 160          1H5*        C 160  25.671  17.774 -13.527
    2   2H5*    C 160          2H5*        C 160  24.290  18.425 -12.643
    3    H4*    C 160           H4*        C 160  25.617  17.499 -10.981
    4    H3*    C 160           H3*        C 160  26.109  20.462 -11.144
    5    H2*    C 160           H2*        C 160  27.560  20.316  -9.269
    6   2HO*    C 160          2HO*        C 160  27.558  18.295  -8.104
    7    H1*    C 160           H1*        C 160  28.969  18.126 -10.300
    8   1H4     C 160          1H4         C 160  32.314  23.310 -12.008
    9   2H4     C 160          2H4         C 160  31.387  23.372 -13.491
   10    H5     C 160           H5         C 160  29.544  21.969 -13.950
   11    H6     C 160           H6         C 160  28.123  20.141 -13.091
   12   1H5*    U 161          1H5*        U 161  25.307  19.755  -7.129
   13   2H5*    U 161          2H5*        U 161  23.954  20.744  -6.581
   14    H4*    U 161           H4*        U 161  25.592  21.161  -4.999
   15    H3*    U 161           H3*        U 161  25.601  23.354  -7.056
   16    H2*    U 161           H2*        U 161  27.276  24.501  -5.816
   17   2HO*    U 161          2HO*        U 161  27.858  23.088  -3.758
   18    H1*    U 161           H1*        U 161  28.879  22.222  -5.544
   19    H3     U 161           H3         U 161  31.177  24.813  -8.481
   20    H5     U 161           H5         U 161  28.092  23.156 -10.778
   21    H6     U 161           H6         U 161  27.156  22.261  -8.695
   22   1H5*    G 162          1H5*        G 162  25.353  24.679  -3.164
   23   2H5*    G 162          2H5*        G 162  24.162  25.920  -2.772
   24    H4*    G 162           H4*        G 162  26.201  26.627  -1.821
   25    H3*    G 162           H3*        G 162  25.446  28.143  -4.293
   26    H2*    G 162           H2*        G 162  27.372  29.528  -4.069
   27   2HO*    G 162          2HO*        G 162  28.484  29.452  -2.091
   28    H1*    G 162           H1*        G 162  29.109  27.363  -3.784
   29    H8     G 162           H8         G 162  26.542  26.329  -6.233
   30    H1     G 162           H1         G 162  31.030  30.218  -8.804
   31   1H2     G 162          1H2         G 162  32.167  31.048  -7.298
   32   2H2     G 162          2H2         G 162  31.939  30.737  -5.592
   33   1H5*    C 163          1H5*        C 163  26.548  30.679  -1.433
   34   2H5*    C 163          2H5*        C 163  25.483  32.023  -1.015
   35    H4*    C 163           H4*        C 163  27.558  33.015  -1.395
   36    H3*    C 163           H3*        C 163  25.749  33.335  -3.768
   37    H2*    C 163           H2*        C 163  27.409  34.613  -4.887
   38   2HO*    C 163          2HO*        C 163  29.042  35.500  -3.632
   39    H1*    C 163           H1*        C 163  29.454  32.775  -4.312
   40   1H4     C 163          1H4         C 163  27.492  31.192 -10.179
   41   2H4     C 163          2H4         C 163  26.161  30.297  -9.479
   42    H5     C 163           H5         C 163  25.663  30.268  -7.171
   43    H6     C 163           H6         C 163  26.327  31.098  -4.942
   44   1H5*    C 164          1H5*        C 164  27.266  37.036  -2.943
   45   2H5*    C 164          2H5*        C 164  26.041  38.282  -2.705
   46    H4*    C 164           H4*        C 164  27.470  39.222  -4.269
   47    H3*    C 164           H3*        C 164  25.086  38.022  -5.651
   48    H2*    C 164           H2*        C 164  25.889  38.828  -7.740
   49   2HO*    C 164          2HO*        C 164  28.234  39.938  -7.016
   50    H1*    C 164           H1*        C 164  28.474  37.834  -7.329
   51   1H4     C 164          1H4         C 164  25.575  33.199 -10.617
   52   2H4     C 164          2H4         C 164  24.776  32.664  -9.155
   53    H5     C 164           H5         C 164  24.934  33.784  -7.082
   54    H6     C 164           H6         C 164  25.907  35.715  -5.890
   55   1H5*    C 165          1H5*        C 165  25.439  41.897  -6.997
   56   2H5*    C 165          2H5*        C 165  23.919  42.772  -7.184
   57    H4*    C 165           H4*        C 165  25.026  42.748  -9.293
   58    H3*    C 165           H3*        C 165  22.619  40.942  -9.153
   59    H2*    C 165           H2*        C 165  22.839  40.510 -11.480
   60   2HO*    C 165          2HO*        C 165  25.024  41.885 -12.144
   61    H1*    C 165           H1*        C 165  25.613  40.034 -11.272
   62   1H4     C 165          1H4         C 165  22.921  34.238 -11.218
   63   2H4     C 165          2H4         C 165  22.649  34.403  -9.498
   64    H5     C 165           H5         C 165  23.092  36.376  -8.279
   65    H6     C 165           H6         C 165  23.913  38.702  -8.412
   66   1H5*    U 166          1H5*        U 166  22.271  43.548 -12.309
   67   2H5*    U 166          2H5*        U 166  20.713  44.350 -12.503
   68    H4*    U 166           H4*        U 166  21.292  43.362 -14.588
   69    H3*    U 166           H3*        U 166  19.069  41.968 -13.128
   70    H2*    U 166           H2*        U 166  18.784  40.479 -14.955
   71   2HO*    U 166          2HO*        U 166  19.260  41.437 -16.843
   72    H1*    U 166           H1*        U 166  21.541  39.951 -15.161
   73    H3     U 166           H3         U 166  19.397  36.148 -13.705
   74    H5     U 166           H5         U 166  20.216  38.375 -10.255
   75    H6     U 166           H6         U 166  20.870  40.225 -11.724
   76   1H5*    C 167          1H5*        C 167  17.141  43.024 -17.062
   77   2H5*    C 167          2H5*        C 167  15.597  43.717 -16.566
   78    H4*    C 167           H4*        C 167  15.184  41.978 -18.154
   79    H3*    C 167           H3*        C 167  14.376  41.323 -15.330
   80    H2*    C 167           H2*        C 167  13.391  39.300 -16.103
   81   2HO*    C 167          2HO*        C 167  12.635  40.329 -18.044
   82    H1*    C 167           H1*        C 167  15.656  38.602 -17.616
   83   1H4     C 167          1H4         C 167  16.256  35.502 -12.049
   84   2H4     C 167          2H4         C 167  17.100  36.894 -11.406
   85    H5     C 167           H5         C 167  17.344  38.936 -12.566
   86    H6     C 167           H6         C 167  16.831  40.160 -14.648
   87   1H5*    A 168          1H5*        A 168  10.836  42.404 -17.647
   88   2H5*    A 168          2H5*        A 168  10.357  44.100 -17.567
   89    H4*    A 168           H4*        A 168   9.022  41.694 -16.364
   90    H3*    A 168           H3*        A 168   8.166  43.917 -18.216
   91    H2*    A 168           H2*        A 168   5.920  43.546 -17.547
   92   2HO*    A 168          2HO*        A 168   6.357  41.531 -15.742
   93    H1*    A 168           H1*        A 168   6.667  43.363 -14.801
   94    H8     A 168           H8         A 168   6.654  45.670 -17.813
   95   1H6     A 168          1H6         A 168   4.716  50.106 -13.875
   96   2H6     A 168          2H6         A 168   5.020  49.740 -15.559
   97    H2     A 168           H2         A 168   5.705  46.479 -11.506
   98   1H5*    U 169          1H5*        U 169   9.538  44.311 -19.787
   99   2H5*    U 169          2H5*        U 169   9.605  44.319 -21.549
  100    H4*    U 169           H4*        U 169  11.669  43.093 -19.705
  101    H3*    U 169           H3*        U 169  11.511  45.769 -21.026
  102    H2*    U 169           H2*        U 169  13.823  45.717 -21.573
  103   2HO*    U 169          2HO*        U 169  14.765  43.459 -20.755
  104    H1*    U 169           H1*        U 169  13.740  43.221 -22.741
  105    H3     U 169           H3         U 169  13.878  46.460 -26.022
  106    H5     U 169           H5         U 169   9.818  45.746 -25.287
  107    H6     U 169           H6         U 169  10.504  44.417 -23.344
  108   1H5*    C 170          1H5*        C 170  10.367  46.037 -18.126
  109   2H5*    C 170          2H5*        C 170   9.984  47.750 -17.964
  110    H4*    C 170           H4*        C 170   9.077  46.451 -16.114
  111    H3*    C 170           H3*        C 170  11.217  48.469 -15.467
  112    H2*    C 170           H2*        C 170  10.886  48.055 -13.160
  113   2HO*    C 170          2HO*        C 170   8.628  47.925 -13.269
  114    H1*    C 170           H1*        C 170  10.790  45.235 -13.561
  115   1H4     C 170          1H4         C 170  16.664  46.218 -11.294
  116   2H4     C 170          2H4         C 170  17.136  46.952 -12.810
  117    H5     C 170           H5         C 170  15.649  47.341 -14.603
  118    H6     C 170           H6         C 170  13.318  47.120 -15.389
  119   1H5*    C 171          1H5*        C 171  11.008  52.218 -14.591
  120   2H5*    C 171          2H5*        C 171  11.004  50.458 -14.482
  121    H4*    C 171           H4*        C 171   8.702  51.864 -13.242
  122    H3*    C 171           H3*        C 171  11.511  52.291 -12.300
  123    H2*    C 171           H2*        C 171  10.853  52.006 -10.035
  124   2HO*    C 171          2HO*        C 171   8.177  51.554 -10.907
  125    H1*    C 171           H1*        C 171   9.441  49.651 -10.531
  126   1H4     C 171          1H4         C 171  15.267  47.642  -8.868
  127   2H4     C 171          2H4         C 171  15.824  47.934 -10.501
  128    H5     C 171           H5         C 171  14.504  48.936 -12.182
  129    H6     C 171           H6         C 171  12.301  49.916 -12.717
  130   1H5*    G 172          1H5*        G 172   9.231  54.559  -9.588
  131   2H5*    G 172          2H5*        G 172   9.633  56.246  -9.909
  132    H4*    G 172           H4*        G 172   9.736  56.091  -7.597
  133    H3*    G 172           H3*        G 172  12.478  55.918  -8.792
  134    H2*    G 172           H2*        G 172  13.449  55.746  -6.622
  135   2HO*    G 172          2HO*        G 172  12.131  56.257  -4.851
  136    H1*    G 172           H1*        G 172  11.734  53.693  -5.828
  137    H8     G 172           H8         G 172  12.714  53.454  -9.456
  138    H1     G 172           H1         G 172  16.900  50.650  -5.394
  139   1H2     G 172          1H2         G 172  16.393  51.118  -3.451
  140   2H2     G 172          2H2         G 172  15.036  52.121  -2.991
  141   1H5*    U 173          1H5*        U 173  12.741  58.464  -5.782
  142   2H5*    U 173          2H5*        U 173  13.351  60.082  -6.128
  143    H4*    U 173           H4*        U 173  14.695  59.388  -4.383
  144    H3*    U 173           H3*        U 173  16.123  58.857  -6.979
  145    H2*    U 173           H2*        U 173  18.034  58.144  -5.760
  146   2HO*    U 173          2HO*        U 173  17.489  58.326  -3.254
  147    H1*    U 173           H1*        U 173  16.526  56.495  -4.053
  148    H3     U 173           H3         U 173  18.854  53.521  -6.563
  149    H5     U 173           H5         U 173  15.868  54.910  -9.151
  150    H6     U 173           H6         U 173  15.274  56.549  -7.427
  151   1H5*    C 174          1H5*        C 174  18.652  61.024  -4.545
  152   2H5*    C 174          2H5*        C 174  19.366  62.442  -5.315
  153    H4*    C 174           H4*        C 174  21.191  61.306  -4.436
  154    H3*    C 174           H3*        C 174  20.896  60.742  -7.366
  155    H2*    C 174           H2*        C 174  22.846  59.381  -7.331
  156   2HO*    C 174          2HO*        C 174  24.084  59.404  -5.328
  157    H1*    C 174           H1*        C 174  21.979  57.968  -5.046
  158   1H4     C 174          1H4         C 174  20.340  54.183  -9.912
  159   2H4     C 174          2H4         C 174  18.967  55.213 -10.248
  160    H5     C 174           H5         C 174  18.533  57.239  -9.116
  161    H6     C 174           H6         C 174  19.317  58.792  -7.364
  162   1H5*    U 175          1H5*        U 175  23.330  65.293  -5.802
  163   2H5*    U 175          2H5*        U 175  22.011  65.938  -6.779
  164    H4*    U 175           H4*        U 175  23.449  66.858  -8.358
  165    H3*    U 175           H3*        U 175  25.511  64.867  -7.432
  166    H2*    U 175           H2*        U 175  27.222  66.309  -8.231
  167   2HO*    U 175          2HO*        U 175  25.381  68.263  -9.076
  168    H1*    U 175           H1*        U 175  26.034  68.587  -7.041
  169    H3     U 175           H3         U 175  29.851  68.162  -4.649
  170    H5     U 175           H5         U 175  27.494  64.962  -3.330
  171    H6     U 175           H6         U 175  25.884  65.554  -5.082
  172   1H5*    C 176          1H5*        C 176  25.264  61.898  -9.015
  173   2H5*    C 176          2H5*        C 176  25.830  62.250  -7.382
  174    H4*    C 176           H4*        C 176  28.094  61.420  -8.056
  175    H3*    C 176           H3*        C 176  26.725  60.964 -10.672
  176    H2*    C 176           H2*        C 176  27.820  58.879 -10.971
  177   2HO*    C 176          2HO*        C 176  29.676  58.535  -9.792
  178    H1*    C 176           H1*        C 176  27.185  57.923  -8.445
  179   1H4     C 176          1H4         C 176  22.402  56.008 -12.246
  180   2H4     C 176          2H4         C 176  21.538  57.471 -11.830
  181    H5     C 176           H5         C 176  22.460  59.224 -10.544
  182    H6     C 176           H6         C 176  24.458  60.011  -9.325
  183   1H5*    G 177          1H5*        G 177  30.777  60.096 -11.439
  184   2H5*    G 177          2H5*        G 177  31.369  61.165 -12.710
  185    H4*    G 177           H4*        G 177  32.019  58.987 -13.325
  186    H3*    G 177           H3*        G 177  29.714  60.040 -14.919
  187    H2*    G 177           H2*        G 177  29.636  58.040 -16.213
  188   2HO*    G 177          2HO*        G 177  31.413  56.433 -15.297
  189    H1*    G 177           H1*        G 177  29.615  56.384 -13.966
  190    H8     G 177           H8         G 177  27.596  59.344 -13.080
  191    H1     G 177           H1         G 177  24.389  55.176 -16.851
  192   1H2     G 177          1H2         G 177  25.705  53.783 -17.613
  193   2H2     G 177          2H2         G 177  27.422  53.750 -17.279
  194   1H5*    C 178          1H5*        C 178  32.592  58.663 -17.663
  195   2H5*    C 178          2H5*        C 178  32.797  59.703 -19.072
  196    H4*    C 178           H4*        C 178  32.215  57.490 -19.797
  197    H3*    C 178           H3*        C 178  30.119  59.599 -20.217
  198    H2*    C 178           H2*        C 178  28.732  58.024 -21.325
  199   2HO*    C 178          2HO*        C 178  29.838  56.455 -22.348
  200    H1*    C 178           H1*        C 178  29.131  56.055 -19.336
  201   1H4     C 178          1H4         C 178  23.507  58.754 -17.938
  202   2H4     C 178          2H4         C 178  24.354  60.013 -17.068
  203    H5     C 178           H5         C 178  26.705  60.229 -17.024
  204    H6     C 178           H6         C 178  28.844  59.279 -17.812
  205   1H5*    U 179          1H5*        U 179  30.960  58.142 -24.406
  206   2H5*    U 179          2H5*        U 179  30.754  59.564 -25.428
  207    H4*    U 179           H4*        U 179  29.264  57.671 -26.017
  208    H3*    U 179           H3*        U 179  28.092  60.336 -25.257
  209    H2*    U 179           H2*        U 179  25.928  59.527 -25.808
  210   2HO*    U 179          2HO*        U 179  25.812  57.704 -27.115
  211    H1*    U 179           H1*        U 179  26.260  57.137 -24.384
  212    H3     U 179           H3         U 179  23.201  59.847 -22.235
  213    H5     U 179           H5         U 179  26.950  60.884 -20.685
  214    H6     U 179           H6         U 179  27.951  59.509 -22.451
  215   1H5*    U 180          1H5*        U 180  26.578  59.317 -28.770
  216   2H5*    U 180          2H5*        U 180  26.459  60.519 -30.054
  217    H4*    U 180           H4*        U 180  24.275  59.674 -29.641
  218    H3*    U 180           H3*        U 180  24.740  62.480 -28.696
  219    H2*    U 180           H2*        U 180  22.495  62.650 -27.956
  220   2HO*    U 180          2HO*        U 180  21.746  61.450 -29.804
  221    H1*    U 180           H1*        U 180  22.583  60.113 -26.687
  222    H3     U 180           H3         U 180  22.093  62.907 -23.162
  223    H5     U 180           H5         U 180  26.028  63.584 -24.424
  224    H6     U 180           H6         U 180  25.555  62.138 -26.347
  225   1H5*    A 181          1H5*        A 181  22.887  63.696 -33.042
  226   2H5*    A 181          2H5*        A 181  23.581  65.317 -33.071
  227    H4*    A 181           H4*        A 181  21.068  65.163 -32.857
  228    H3*    A 181           H3*        A 181  22.769  66.773 -30.969
  229    H2*    A 181           H2*        A 181  20.805  67.595 -29.914
  230   2HO*    A 181          2HO*        A 181  18.745  66.770 -31.015
  231    H1*    A 181           H1*        A 181  19.644  65.057 -29.689
  232    H8     A 181           H8         A 181  23.344  64.946 -29.096
  233   1H6     A 181          1H6         A 181  22.078  66.184 -23.111
  234   2H6     A 181          2H6         A 181  23.347  65.728 -24.227
  235    H2     A 181           H2         A 181  18.324  66.625 -25.446
  236   1H5*    U 182          1H5*        U 182  20.038  70.110 -34.889
  237   2H5*    U 182          2H5*        U 182  21.742  69.661 -34.941
  238    H4*    U 182           H4*        U 182  21.893  71.981 -33.541
  239    H3*    U 182           H3*        U 182  19.381  72.169 -35.163
  240    H2*    U 182           H2*        U 182  20.242  73.917 -36.336
  241   2HO*    U 182          2HO*        U 182  20.155  75.646 -34.995
  242    H1*    U 182           H1*        U 182  22.762  73.733 -34.623
  243    H3     U 182           H3         U 182  24.376  76.720 -37.664
  244    H5     U 182           H5         U 182  23.647  73.247 -39.887
  245    H6     U 182           H6         U 182  22.559  72.319 -37.895
  246   1H5*    U 183          1H5*        U 183  18.265  72.987 -30.576
  247   2H5*    U 183          2H5*        U 183  17.970  74.050 -31.951
  248    H4*    U 183           H4*        U 183  18.492  75.924 -30.121
  249    H3*    U 183           H3*        U 183  17.595  73.543 -28.490
  250    H2*    U 183           H2*        U 183  16.389  74.983 -27.107
  251   2HO*    U 183          2HO*        U 183  17.300  76.962 -26.744
  252    H1*    U 183           H1*        U 183  15.884  76.780 -29.385
  253    H3     U 183           H3         U 183  12.823  72.600 -28.116
  254    H5     U 183           H5         U 183  11.390  76.520 -28.473
  255    H6     U 183           H6         U 183  13.691  77.210 -28.965
  256   1H5*    C 184          1H5*        C 184  18.293  73.552 -24.195
  257   2H5*    C 184          2H5*        C 184  17.596  75.125 -23.806
  258    H4*    C 184           H4*        C 184  20.508  74.326 -23.689
  259    H3*    C 184           H3*        C 184  18.451  74.975 -21.575
  260    H2*    C 184           H2*        C 184  20.117  75.879 -20.249
  261   2HO*    C 184          2HO*        C 184  21.952  74.423 -21.922
  262    H1*    C 184           H1*        C 184  21.722  76.491 -22.676
  263   1H4     C 184          1H4         C 184  21.332  82.053 -19.544
  264   2H4     C 184          2H4         C 184  19.685  82.225 -20.109
  265    H5     C 184           H5         C 184  18.525  80.556 -21.311
  266    H6     C 184           H6         C 184  18.660  78.287 -22.276
  267   1H5*    G 185          1H5*        G 185  21.715  72.355 -19.774
  268   2H5*    G 185          2H5*        G 185  21.892  70.796 -20.580
  269    H4*    G 185           H4*        G 185  20.674  70.172 -18.151
  270    H3*    G 185           H3*        G 185  22.486  72.520 -17.778
  271    H2*    G 185           H2*        G 185  23.477  71.527 -15.852
  272   2HO*    G 185          2HO*        G 185  22.251  69.108 -15.881
  273    H1*    G 185           H1*        G 185  23.983  69.108 -17.148
  274    H8     G 185           H8         G 185  24.808  71.181 -19.895
  275    H1     G 185           H1         G 185  29.012  72.184 -15.079
  276   1H2     G 185          1H2         G 185  28.252  71.406 -13.327
  277   2H2     G 185          2H2         G 185  26.705  70.601 -13.185
  278   1H5*    G 186          1H5*        G 186  19.748  73.750 -12.636
  279   2H5*    G 186          2H5*        G 186  21.411  74.061 -13.131
  280    H4*    G 186           H4*        G 186  21.934  71.671 -12.461
  281    H3*    G 186           H3*        G 186  19.089  71.786 -11.518
  282    H2*    G 186           H2*        G 186  19.657  70.509  -9.588
  283   2HO*    G 186          2HO*        G 186  21.605  69.401  -9.627
  284    H1*    G 186           H1*        G 186  21.816  72.147  -8.926
  285    H8     G 186           H8         G 186  19.688  74.778  -9.928
  286    H1     G 186           H1         G 186  17.183  71.843  -4.732
  287   1H2     G 186          1H2         G 186  18.100  70.015  -4.466
  288   2H2     G 186          2H2         G 186  19.360  69.373  -5.496
  289   1H5*    G 187          1H5*        G 187  17.042  67.393 -13.381
  290   2H5*    G 187          2H5*        G 187  18.331  67.117 -14.553
  291    H4*    G 187           H4*        G 187  15.718  68.542 -14.901
  292    H3*    G 187           H3*        G 187  17.090  66.221 -16.175
  293    H2*    G 187           H2*        G 187  16.171  66.740 -18.311
  294   2HO*    G 187          2HO*        G 187  14.745  68.779 -18.214
  295    H1*    G 187           H1*        G 187  16.994  69.404 -18.211
  296    H8     G 187           H8         G 187  19.704  67.510 -16.601
  297    H1     G 187           H1         G 187  19.794  66.944 -23.048
  298   1H2     G 187          1H2         G 187  18.030  67.674 -23.828
  299   2H2     G 187          2H2         G 187  16.721  68.340 -22.877
  300   1H5*    G 188          1H5*        G 188  13.465  66.287 -18.225
  301   2H5*    G 188          2H5*        G 188  12.604  64.872 -17.620
  302    H4*    G 188           H4*        G 188  12.328  64.715 -19.911
  303    H3*    G 188           H3*        G 188  14.627  62.975 -19.061
  304    H2*    G 188           H2*        G 188  14.853  62.196 -21.302
  305   2HO*    G 188          2HO*        G 188  13.135  62.590 -22.714
  306    H1*    G 188           H1*        G 188  14.840  64.778 -22.373
  307    H8     G 188           H8         G 188  16.738  65.059 -19.242
  308    H1     G 188           H1         G 188  20.184  62.277 -23.960
  309   1H2     G 188          1H2         G 188  18.935  61.777 -25.523
  310   2H2     G 188          2H2         G 188  17.211  62.069 -25.551
  311   1H5*    A 189          1H5*        A 189  12.250  59.985 -21.421
  312   2H5*    A 189          2H5*        A 189  12.487  58.539 -20.440
  313    H4*    A 189           H4*        A 189  13.307  58.394 -22.807
  314    H3*    A 189           H3*        A 189  15.126  57.828 -20.475
  315    H2*    A 189           H2*        A 189  16.813  57.128 -21.993
  316   2HO*    A 189          2HO*        A 189  15.994  57.220 -24.355
  317    H1*    A 189           H1*        A 189  16.468  59.367 -23.661
  318    H8     A 189           H8         A 189  16.254  60.288 -20.040
  319   1H6     A 189          1H6         A 189  22.460  60.937 -20.173
  320   2H6     A 189          2H6         A 189  21.028  61.201 -19.205
  321    H2     A 189           H2         A 189  21.172  59.098 -24.008
  322   1H5*    G 190          1H5*        G 190  15.214  54.170 -23.178
  323   2H5*    G 190          2H5*        G 190  15.098  52.845 -22.020
  324    H4*    G 190           H4*        G 190  16.947  52.475 -23.525
  325    H3*    G 190           H3*        G 190  17.636  53.020 -20.653
  326    H2*    G 190           H2*        G 190  19.937  52.618 -21.129
  327   2HO*    G 190          2HO*        G 190  20.405  51.837 -23.318
  328    H1*    G 190           H1*        G 190  19.959  54.332 -23.329
  329    H8     G 190           H8         G 190  17.747  55.844 -20.769
  330    H1     G 190           H1         G 190  24.032  56.800 -19.558
  331   1H2     G 190          1H2         G 190  25.162  55.610 -20.807
  332   2H2     G 190          2H2         G 190  24.505  54.517 -22.004
  333   1H5*    C 191          1H5*        C 191  19.433  49.179 -21.572
  334   2H5*    C 191          2H5*        C 191  19.489  48.169 -20.128
  335    H4*    C 191           H4*        C 191  21.718  48.648 -21.040
  336    H3*    C 191           H3*        C 191  21.050  49.602 -18.265
  337    H2*    C 191           H2*        C 191  23.302  50.306 -17.980
  338   2HO*    C 191          2HO*        C 191  24.552  49.789 -20.183
  339    H1*    C 191           H1*        C 191  23.360  51.612 -20.478
  340   1H4     C 191          1H4         C 191  22.115  56.174 -16.167
  341   2H4     C 191          2H4         C 191  20.409  55.823 -16.337
  342    H5     C 191           H5         C 191  19.556  54.030 -17.617
  343    H6     C 191           H6         C 191  20.135  52.115 -19.063
  344   1H5*    G 192          1H5*        G 192  24.747  47.213 -18.032
  345   2H5*    G 192          2H5*        G 192  24.514  46.089 -16.694
  346    H4*    G 192           H4*        G 192  26.635  47.170 -16.439
  347    H3*    G 192           H3*        G 192  24.535  47.954 -14.440
  348    H2*    G 192           H2*        G 192  26.130  49.295 -13.284
  349   2HO*    G 192          2HO*        G 192  28.166  48.820 -15.147
  350    H1*    G 192           H1*        G 192  26.965  50.604 -15.603
  351    H8     G 192           H8         G 192  23.330  50.102 -15.977
  352    H1     G 192           H1         G 192  24.768  54.999 -11.997
  353   1H2     G 192          1H2         G 192  26.778  54.945 -11.537
  354   2H2     G 192          2H2         G 192  27.905  53.750 -12.139
  355   1H5*    G 193          1H5*        G 193  27.959  46.868 -12.129
  356   2H5*    G 193          2H5*        G 193  27.457  45.742 -10.868
  357    H4*    G 193           H4*        G 193  28.688  47.546  -9.874
  358    H3*    G 193           H3*        G 193  25.749  47.471  -9.253
  359    H2*    G 193           H2*        G 193  26.016  49.308  -7.759
  360   2HO*    G 193          2HO*        G 193  28.160  49.901  -7.205
  361    H1*    G 193           H1*        G 193  27.409  50.845  -9.626
  362    H8     G 193           H8         G 193  24.803  48.950 -11.460
  363    H1     G 193           H1         G 193  22.475  54.186  -8.452
  364   1H2     G 193          1H2         G 193  23.906  54.937  -7.170
  365   2H2     G 193          2H2         G 193  25.499  54.250  -6.944
  366   1H5*    A 194          1H5*        A 194  27.464  47.352  -5.072
  367   2H5*    A 194          2H5*        A 194  26.626  45.944  -4.421
  368    H4*    A 194           H4*        A 194  26.332  47.814  -2.939
  369    H3*    A 194           H3*        A 194  23.878  46.885  -4.398
  370    H2*    A 194           H2*        A 194  22.557  48.463  -3.212
  371   2HO*    A 194          2HO*        A 194  23.397  49.260  -1.308
  372    H1*    A 194           H1*        A 194  24.336  50.578  -3.692
  373    H8     A 194           H8         A 194  23.921  48.240  -6.618
  374   1H6     A 194          1H6         A 194  19.240  51.946  -8.435
  375   2H6     A 194          2H6         A 194  20.237  50.589  -8.905
  376    H2     A 194           H2         A 194  20.552  53.245  -4.393
  377   1H5*    C 195          1H5*        C 195  22.829  46.234  -0.045
  378   2H5*    C 195          2H5*        C 195  21.622  44.949  -0.027
  379    H4*    C 195           H4*        C 195  20.833  47.132   0.877
  380    H3*    C 195           H3*        C 195  19.407  45.828  -1.432
  381    H2*    C 195           H2*        C 195  17.722  47.496  -1.304
  382   2HO*    C 195          2HO*        C 195  17.470  48.455   0.656
  383    H1*    C 195           H1*        C 195  19.584  49.599  -1.137
  384   1H4     C 195          1H4         C 195  18.005  49.320  -7.320
  385   2H4     C 195          2H4         C 195  19.166  48.030  -7.544
  386    H5     C 195           H5         C 195  20.375  47.029  -5.778
  387    H6     C 195           H6         C 195  20.772  47.018  -3.342
  388   1H5*    G 196          1H5*        G 196  16.146  45.947   1.809
  389   2H5*    G 196          2H5*        G 196  15.506  44.309   1.676
  390    H4*    G 196           H4*        G 196  13.723  45.948   1.542
  391    H3*    G 196           H3*        G 196  14.273  44.304  -0.913
  392    H2*    G 196           H2*        G 196  12.386  45.283  -1.989
  393   2HO*    G 196          2HO*        G 196  11.004  45.450  -0.249
  394    H1*    G 196           H1*        G 196  13.170  47.889  -1.365
  395    H8     G 196           H8         G 196  16.184  45.824  -2.122
  396    H1     G 196           H1         G 196  13.197  48.058  -7.411
  397   1H2     G 196          1H2         G 196  11.377  48.870  -6.883
  398   2H2     G 196          2H2         G 196  10.754  48.938  -5.249
  399   1H5*    A 197          1H5*        A 197  10.599  41.578   2.063
  400   2H5*    A 197          2H5*        A 197  11.417  40.312   1.148
  401    H4*    A 197           H4*        A 197   9.083  39.780   1.340
  402    H3*    A 197           H3*        A 197  10.010  40.536  -1.423
  403    H2*    A 197           H2*        A 197   7.872  40.310  -2.246
  404   2HO*    A 197          2HO*        A 197   6.759  38.521  -1.533
  405    H1*    A 197           H1*        A 197   6.777  40.726   0.507
  406    H8     A 197           H8         A 197   7.695  42.370  -2.814
  407   1H6     A 197          1H6         A 197   2.594  45.861  -1.960
  408   2H6     A 197          2H6         A 197   3.888  45.493  -3.078
  409    H2     A 197           H2         A 197   3.172  43.338   1.651
  410   1H5*    U 198          1H5*        U 198  10.431  36.643   0.467
  411   2H5*    U 198          2H5*        U 198  12.030  36.357  -0.220
  412    H4*    U 198           H4*        U 198  10.468  34.111  -0.914
  413    H3*    U 198           H3*        U 198   9.885  35.046   1.888
  414    H2*    U 198           H2*        U 198   9.963  32.822   2.652
  415   2HO*    U 198          2HO*        U 198   9.646  31.173   1.112
  416    H1*    U 198           H1*        U 198  12.187  32.233   0.881
  417    H3     U 198           H3         U 198  15.149  31.780   4.201
  418    H5     U 198           H5         U 198  12.306  34.356   5.879
  419    H6     U 198           H6         U 198  11.152  34.334   3.716
  420   1H5*    G 199          1H5*        G 199   5.181  35.637  -1.288
  421   2H5*    G 199          2H5*        G 199   5.325  36.912  -0.077
  422    H4*    G 199           H4*        G 199   3.105  36.280   0.083
  423    H3*    G 199           H3*        G 199   4.705  34.884   2.210
  424    H2*    G 199           H2*        G 199   2.706  33.922   3.077
  425   2HO*    G 199          2HO*        G 199   0.959  34.871   1.192
  426    H1*    G 199           H1*        G 199   1.853  33.016   0.578
  427    H8     G 199           H8         G 199   5.476  33.011   1.855
  428    H1     G 199           H1         G 199   2.510  27.258   1.816
  429   1H2     G 199          1H2         G 199   0.567  27.491   1.168
  430   2H2     G 199          2H2         G 199  -0.152  29.016   0.705
  431   1H5*    A 200          1H5*        A 200   6.931  35.637   3.580
  432   2H5*    A 200          2H5*        A 200   5.503  34.709   4.036
  433    H4*    A 200           H4*        A 200   6.343  36.209   6.315
  434    H3*    A 200           H3*        A 200   8.621  35.137   4.751
  435    H2*    A 200           H2*        A 200   9.551  33.960   6.579
  436   2HO*    A 200          2HO*        A 200   7.480  34.780   8.315
  437    H1*    A 200           H1*        A 200   7.261  32.677   7.334
  438    H8     A 200           H8         A 200   6.913  33.192   3.674
  439   1H6     A 200          1H6         A 200  10.339  28.033   2.895
  440   2H6     A 200          2H6         A 200   9.337  29.207   2.072
  441    H2     A 200           H2         A 200  10.496  29.172   7.187
  442   1H5*    C 201          1H5*        C 201  11.741  37.817   7.452
  443   2H5*    C 201          2H5*        C 201  12.786  36.397   7.405
  444    H4*    C 201           H4*        C 201  10.139  36.779   8.734
  445    H3*    C 201           H3*        C 201  12.832  35.706   9.521
  446    H2*    C 201           H2*        C 201  11.835  34.322  11.155
  447   2HO*    C 201          2HO*        C 201  10.356  35.933  11.831
  448    H1*    C 201           H1*        C 201   9.707  33.611   9.343
  449   1H4     C 201          1H4         C 201  13.391  28.406   9.852
  450   2H4     C 201          2H4         C 201  14.447  29.071   8.626
  451    H5     C 201           H5         C 201  14.213  31.242   7.725
  452    H6     C 201           H6         C 201  12.894  33.328   7.778
  453   1H5*    C 202          1H5*        C 202  11.431  37.686  13.443
  454   2H5*    C 202          2H5*        C 202  12.935  37.938  14.329
  455    H4*    C 202           H4*        C 202  11.286  36.358  15.382
  456    H3*    C 202           H3*        C 202  14.126  35.508  14.820
  457    H2*    C 202           H2*        C 202  13.718  33.511  16.029
  458   2HO*    C 202          2HO*        C 202  11.252  33.660  16.871
  459    H1*    C 202           H1*        C 202  11.192  33.124  14.783
  460   1H4     C 202          1H4         C 202  15.214  29.150  11.793
  461   2H4     C 202          2H4         C 202  15.688  30.465  10.742
  462    H5     C 202           H5         C 202  14.961  32.696  11.013
  463    H6     C 202           H6         C 202  13.587  34.229  12.376
  464   1H5*    C 203          1H5*        C 203  13.693  35.662  19.330
  465   2H5*    C 203          2H5*        C 203  15.307  35.655  20.041
  466    H4*    C 203           H4*        C 203  13.827  33.671  20.560
  467    H3*    C 203           H3*        C 203  16.616  33.368  19.463
  468    H2*    C 203           H2*        C 203  16.449  31.018  19.752
  469   2HO*    C 203          2HO*        C 203  14.872  30.264  21.161
  470    H1*    C 203           H1*        C 203  13.896  30.887  18.575
  471   1H4     C 203          1H4         C 203  18.069  29.424  13.941
  472   2H4     C 203          2H4         C 203  18.129  31.120  13.518
  473    H5     C 203           H5         C 203  17.074  32.827  14.765
  474    H6     C 203           H6         C 203  15.688  33.329  16.745
  475   1H5*    U 204          1H5*        U 204  16.185  31.189  22.785
  476   2H5*    U 204          2H5*        U 204  17.383  31.356  24.069
  477    H4*    U 204           H4*        U 204  17.159  29.045  23.662
  478    H3*    U 204           H3*        U 204  19.687  30.194  22.515
  479    H2*    U 204           H2*        U 204  20.375  28.014  21.847
  480   2HO*    U 204          2HO*        U 204  19.402  26.299  22.864
  481    H1*    U 204           H1*        U 204  17.947  27.428  20.611
  482    H3     U 204           H3         U 204  21.111  28.116  17.349
  483    H5     U 204           H5         U 204  19.569  31.908  18.230
  484    H6     U 204           H6         U 204  18.407  30.885  20.132
  485   1H5*    A 205          1H5*        A 205  21.492  28.593  26.576
  486   2H5*    A 205          2H5*        A 205  23.024  29.466  26.628
  487    H4*    A 205           H4*        A 205  23.091  27.003  25.988
  488    H3*    A 205           H3*        A 205  24.446  29.170  24.395
  489    H2*    A 205           H2*        A 205  25.427  27.510  23.011
  490   2HO*    A 205          2HO*        A 205  24.131  25.563  24.669
  491    H1*    A 205           H1*        A 205  23.010  26.118  22.674
  492    H8     A 205           H8         A 205  22.193  29.711  22.551
  493   1H6     A 205          1H6         A 205  23.956  29.682  16.564
  494   2H6     A 205          2H6         A 205  23.157  30.625  17.803
  495    H2     A 205           H2         A 205  25.205  25.833  18.400
  496   1H5*    G 206          1H5*        G 206  27.253  28.146  22.504
  497   2H5*    G 206          2H5*        G 206  28.644  28.602  23.488
  498    H4*    G 206           H4*        G 206  26.940  30.433  21.786
  499    H3*    G 206           H3*        G 206  29.612  29.172  21.385
  500    H2*    G 206           H2*        G 206  30.509  31.164  20.433
  501   2HO*    G 206          2HO*        G 206  28.260  32.727  20.876
  502    H1*    G 206           H1*        G 206  29.651  32.768  22.546
  503    H8     G 206           H8         G 206  30.881  29.221  23.237
  504    H1     G 206           H1         G 206  35.327  33.867  23.961
  505   1H2     G 206          1H2         G 206  34.533  35.678  23.375
  506   2H2     G 206          2H2         G 206  32.905  35.903  22.777
  507   1H5*    U 207          1H5*        U 207  27.178  28.915  16.732
  508   2H5*    U 207          2H5*        U 207  28.553  29.163  15.656
  509    H4*    U 207           H4*        U 207  26.431  30.487  15.183
  510    H3*    U 207           H3*        U 207  29.171  31.720  15.340
  511    H2*    U 207           H2*        U 207  28.258  33.811  14.684
  512   2HO*    U 207          2HO*        U 207  26.103  33.800  13.856
  513    H1*    U 207           H1*        U 207  26.152  33.685  16.521
  514    H3     U 207           H3         U 207  28.623  36.820  18.580
  515    H5     U 207           H5         U 207  31.035  33.406  18.842
  516    H6     U 207           H6         U 207  29.374  32.247  17.462
  517   1H5*    A 208          1H5*        A 208  29.817  32.543  10.079
  518   2H5*    A 208          2H5*        A 208  28.437  31.849   9.228
  519    H4*    A 208           H4*        A 208  30.443  30.899   8.341
  520    H3*    A 208           H3*        A 208  28.688  29.068   9.916
  521    H2*    A 208           H2*        A 208  30.182  27.245   9.619
  522   2HO*    A 208          2HO*        A 208  32.214  28.370   8.292
  523    H1*    A 208           H1*        A 208  32.429  28.721  10.397
  524    H8     A 208           H8         A 208  29.003  29.067  12.078
  525   1H6     A 208          1H6         A 208  31.406  25.486  16.589
  526   2H6     A 208          2H6         A 208  29.993  26.395  16.103
  527    H2     A 208           H2         A 208  34.441  25.889  13.369
  528   1H5*    G 209          1H5*        G 209  28.272  27.125   6.760
  529   2H5*    G 209          2H5*        G 209  26.713  26.354   6.468
  530    H4*    G 209           H4*        G 209  28.230  25.030   7.907
  531    H3*    G 209           H3*        G 209  25.536  25.886   8.923
  532    H2*    G 209           H2*        G 209  25.889  24.635  10.920
  533   2HO*    G 209          2HO*        G 209  28.228  23.593  10.805
  534    H1*    G 209           H1*        G 209  28.417  25.748  11.362
  535    H8     G 209           H8         G 209  26.142  28.355   9.979
  536    H1     G 209           H1         G 209  25.438  27.451  16.349
  537   1H2     G 209          1H2         G 209  26.472  25.764  16.924
  538   2H2     G 209          2H2         G 209  27.394  24.744  15.841
  539   1H5*    A 210          1H5*        A 210  26.136  21.750  10.262
  540   2H5*    A 210          2H5*        A 210  24.651  20.956   9.739
  541    H4*    A 210           H4*        A 210  25.021  20.539  12.081
  542    H3*    A 210           H3*        A 210  22.680  22.314  11.424
  543    H2*    A 210           H2*        A 210  22.049  22.295  13.714
  544   2HO*    A 210          2HO*        A 210  24.111  20.778  14.691
  545    H1*    A 210           H1*        A 210  24.655  22.835  14.614
  546    H8     A 210           H8         A 210  23.825  24.774  11.518
  547   1H6     A 210          1H6         A 210  21.463  29.148  15.292
  548   2H6     A 210          2H6         A 210  21.898  28.789  13.635
  549    H2     A 210           H2         A 210  22.405  25.561  17.740
  550   1H5*    G 211          1H5*        G 211  20.788  18.747  13.865
  551   2H5*    G 211          2H5*        G 211  19.263  18.645  12.986
  552    H4*    G 211           H4*        G 211  19.053  18.938  15.461
  553    H3*    G 211           H3*        G 211  17.740  20.830  13.531
  554    H2*    G 211           H2*        G 211  16.686  21.949  15.351
  555   2HO*    G 211          2HO*        G 211  17.670  20.719  17.487
  556    H1*    G 211           H1*        G 211  19.065  22.215  16.787
  557    H8     G 211           H8         G 211  19.983  22.682  13.250
  558    H1     G 211           H1         G 211  17.119  27.906  15.776
  559   1H2     G 211          1H2         G 211  16.284  27.421  17.598
  560   2H2     G 211          2H2         G 211  16.348  25.834  18.331
  561   1H5*    G 212          1H5*        G 212  14.209  18.947  15.901
  562   2H5*    G 212          2H5*        G 212  12.913  18.957  14.705
  563    H4*    G 212           H4*        G 212  12.404  20.147  16.847
  564    H3*    G 212           H3*        G 212  12.156  21.509  14.181
  565    H2*    G 212           H2*        G 212  11.265  23.441  15.253
  566   2HO*    G 212          2HO*        G 212  11.048  23.150  17.688
  567    H1*    G 212           H1*        G 212  13.320  23.559  17.134
  568    H8     G 212           H8         G 212  14.935  22.454  14.020
  569    H1     G 212           H1         G 212  13.608  28.788  13.997
  570   1H2     G 212          1H2         G 212  12.351  29.234  15.570
  571   2H2     G 212          2H2         G 212  11.746  28.066  16.723
  572   1H5*    G 213          1H5*        G 213   7.619  20.289  14.675
  573   2H5*    G 213          2H5*        G 213   7.137  20.133  12.986
  574    H4*    G 213           H4*        G 213   6.129  22.066  14.213
  575    H3*    G 213           H3*        G 213   7.673  22.453  11.662
  576    H2*    G 213           H2*        G 213   7.082  24.761  11.672
  577   2HO*    G 213          2HO*        G 213   4.976  24.387  12.489
  578    H1*    G 213           H1*        G 213   7.858  25.113  14.337
  579    H8     G 213           H8         G 213  10.356  22.828  12.921
  580    H1     G 213           H1         G 213  11.266  28.942  11.005
  581   1H2     G 213          1H2         G 213   9.607  30.069  11.485
  582   2H2     G 213          2H2         G 213   8.181  29.449  12.286
  583   1H5*    G 214          1H5*        G 214   6.048  25.512  10.028
  584   2H5*    G 214          2H5*        G 214   5.241  24.723   8.674
  585    H4*    G 214           H4*        G 214   7.024  26.251   7.956
  586    H3*    G 214           H3*        G 214   7.215  23.334   7.285
  587    H2*    G 214           H2*        G 214   9.211  23.728   6.046
  588   2HO*    G 214          2HO*        G 214   9.442  26.414   6.642
  589    H1*    G 214           H1*        G 214  10.409  25.175   8.115
  590    H8     G 214           H8         G 214   8.586  22.485   9.813
  591    H1     G 214           H1         G 214  14.007  20.356   6.993
  592   1H2     G 214          1H2         G 214  14.737  21.805   5.719
  593   2H2     G 214          2H2         G 214  13.990  23.364   5.455
  594   1H5*    G 215          1H5*        G 215   8.048  25.012   3.591
  595   2H5*    G 215          2H5*        G 215   6.604  24.766   2.610
  596    H4*    G 215           H4*        G 215   8.322  24.190   1.172
  597    H3*    G 215           H3*        G 215   7.154  21.721   2.415
  598    H2*    G 215           H2*        G 215   8.630  20.358   1.136
  599   2HO*    G 215          2HO*        G 215   8.645  21.549  -0.756
  600    H1*    G 215           H1*        G 215  10.897  21.782   1.866
  601    H8     G 215           H8         G 215   8.428  21.680   4.688
  602    H1     G 215           H1         G 215  12.241  16.461   4.355
  603   1H2     G 215          1H2         G 215  13.312  16.502   2.594
  604   2H2     G 215          2H2         G 215  13.194  17.763   1.386
  605   1H5*    C 216          1H5*        C 216   5.070  21.575  -1.719
  606   2H5*    C 216          2H5*        C 216   3.673  20.530  -1.474
  607    H4*    C 216           H4*        C 216   5.688  19.539  -2.672
  608    H3*    C 216           H3*        C 216   4.325  18.203  -0.341
  609    H2*    C 216           H2*        C 216   5.708  16.300  -0.656
  610   2HO*    C 216          2HO*        C 216   6.532  16.015  -2.681
  611    H1*    C 216           H1*        C 216   8.054  17.831  -0.891
  612   1H4     C 216          1H4         C 216   7.770  15.906   5.213
  613   2H4     C 216          2H4         C 216   6.931  17.393   5.594
  614    H5     C 216           H5         C 216   6.209  18.951   3.973
  615    H6     C 216           H6         C 216   6.114  19.470   1.561
  616   1H5*    U 217          1H5*        U 217   4.524  15.663  -3.242
  617   2H5*    U 217          2H5*        U 217   3.115  14.751  -3.786
  618    H4*    U 217           H4*        U 217   4.688  13.113  -3.297
  619    H3*    U 217           H3*        U 217   2.765  13.422  -1.006
  620    H2*    U 217           H2*        U 217   3.816  11.593   0.105
  621   2HO*    U 217          2HO*        U 217   5.567  10.534  -1.176
  622    H1*    U 217           H1*        U 217   6.380  12.649  -0.239
  623    H3     U 217           H3         U 217   5.764  13.355   4.174
  624    H5     U 217           H5         U 217   3.189  16.128   2.380
  625    H6     U 217           H6         U 217   3.750  15.104   0.223
  626   1H5*    G 218          1H5*        G 218   0.458   9.166  -2.783
  627   2H5*    G 218          2H5*        G 218   0.028   8.639  -1.156
  628    H4*    G 218           H4*        G 218   1.544   7.036  -1.384
  629    H3*    G 218           H3*        G 218   3.387   9.398  -1.130
  630    H2*    G 218           H2*        G 218   5.248   8.023  -1.587
  631   2HO*    G 218          2HO*        G 218   3.497   5.765  -1.643
  632    H1*    G 218           H1*        G 218   3.827   6.617  -3.655
  633    H8     G 218           H8         G 218   3.597  10.309  -4.024
  634    H1     G 218           H1         G 218   9.063   7.842  -6.457
  635   1H2     G 218          1H2         G 218   9.250   5.873  -5.872
  636   2H2     G 218          2H2         G 218   8.097   5.018  -4.872
  637   1H5*    C 219          1H5*        C 219   4.356   6.710   1.928
  638   2H5*    C 219          2H5*        C 219   3.787   5.340   2.881
  639    H4*    C 219           H4*        C 219   4.669   6.577   4.558
  640    H3*    C 219           H3*        C 219   1.833   7.477   4.266
  641    H2*    C 219           H2*        C 219   2.116   9.188   5.859
  642   2HO*    C 219          2HO*        C 219   4.787   8.303   6.320
  643    H1*    C 219           H1*        C 219   4.587  10.061   4.861
  644   1H4     C 219          1H4         C 219  -0.101  13.703   2.341
  645   2H4     C 219          2H4         C 219   0.241  12.895   0.827
  646    H5     C 219           H5         C 219   1.699  11.049   0.621
  647    H6     C 219           H6         C 219   3.203   9.508   1.829
  648   1H5*    G 220          1H5*        G 220   4.590   3.570   6.536
  649   2H5*    G 220          2H5*        G 220   4.713   5.300   6.216
  650    H4*    G 220           H4*        G 220   6.368   3.125   5.282
  651    H3*    G 220           H3*        G 220   6.578   6.142   5.254
  652    H2*    G 220           H2*        G 220   8.459   5.946   3.880
  653   2HO*    G 220          2HO*        G 220   9.756   4.229   4.313
  654    H1*    G 220           H1*        G 220   7.301   3.558   2.618
  655    H8     G 220           H8         G 220   7.135   4.128   0.169
  656    H1     G 220           H1         G 220   6.862  10.486   1.348
  657   1H2     G 220          1H2         G 220   6.790  10.807   3.384
  658   2H2     G 220          2H2         G 220   6.802   9.541   4.592
  659   1H5*    G 221          1H5*        G 221   9.929   5.054   6.267
  660   2H5*    G 221          2H5*        G 221  11.045   6.007   7.246
  661    H4*    G 221           H4*        G 221  11.246   5.923   4.627
  662    H3*    G 221           H3*        G 221  11.715   8.276   6.439
  663    H2*    G 221           H2*        G 221  12.340   9.593   4.562
  664   2HO*    G 221          2HO*        G 221  11.863   7.352   2.867
  665    H1*    G 221           H1*        G 221  10.117   8.866   3.052
  666    H8     G 221           H8         G 221   9.597   9.267   6.796
  667    H1     G 221           H1         G 221   8.475  14.602   3.308
  668   1H2     G 221          1H2         G 221   9.020  14.269   1.347
  669   2H2     G 221          2H2         G 221   9.681  12.769   0.738
  670   1H5*    C 222          1H5*        C 222  15.512   8.046   3.785
  671   2H5*    C 222          2H5*        C 222  16.593   9.126   4.664
  672    H4*    C 222           H4*        C 222  15.658   9.749   2.285
  673    H3*    C 222           H3*        C 222  16.109  11.599   4.619
  674    H2*    C 222           H2*        C 222  15.484  13.435   3.254
  675   2HO*    C 222          2HO*        C 222  14.944  11.953   0.974
  676    H1*    C 222           H1*        C 222  13.212  12.146   2.232
  677   1H4     C 222          1H4         C 222  11.254  15.737   7.177
  678   2H4     C 222          2H4         C 222  11.356  14.304   8.178
  679    H5     C 222           H5         C 222  12.256  12.247   7.444
  680    H6     C 222           H6         C 222  13.289  11.046   5.551
  681   1H5*    U 223          1H5*        U 223  17.018  14.132   1.680
  682   2H5*    U 223          2H5*        U 223  18.671  14.659   1.994
  683    H4*    U 223           H4*        U 223  17.131  16.545   1.864
  684    H3*    U 223           H3*        U 223  18.470  16.028   4.515
  685    H2*    U 223           H2*        U 223  17.504  17.982   5.382
  686   2HO*    U 223          2HO*        U 223  17.434  19.592   3.926
  687    H1*    U 223           H1*        U 223  15.040  17.537   3.930
  688    H3     U 223           H3         U 223  13.927  18.014   8.358
  689    H5     U 223           H5         U 223  15.281  14.070   7.975
  690    H6     U 223           H6         U 223  16.012  14.646   5.706
  691   1H5*    U 224          1H5*        U 224  21.577  19.488   1.910
  692   2H5*    U 224          2H5*        U 224  20.764  21.053   1.892
  693    H4*    U 224           H4*        U 224  20.325  18.866   0.194
  694    H3*    U 224           H3*        U 224  18.934  21.513   0.584
  695    H2*    U 224           H2*        U 224  17.337  20.868  -1.044
  696   2HO*    U 224          2HO*        U 224  17.947  19.289  -2.494
  697    H1*    U 224           H1*        U 224  16.999  18.295   0.035
  698    H3     U 224           H3         U 224  13.056  19.750   1.541
  699    H5     U 224           H5         U 224  15.710  22.563   3.150
  700    H6     U 224           H6         U 224  17.513  21.386   1.975
  701   1H5*    A 225          1H5*        A 225  20.145  21.220  -3.727
  702   2H5*    A 225          2H5*        A 225  19.827  22.739  -4.565
  703    H4*    A 225           H4*        A 225  18.383  20.729  -5.170
  704    H3*    A 225           H3*        A 225  17.264  23.440  -4.486
  705    H2*    A 225           H2*        A 225  15.092  22.663  -5.045
  706   2HO*    A 225          2HO*        A 225  15.518  20.113  -5.706
  707    H1*    A 225           H1*        A 225  15.370  20.286  -3.577
  708    H8     A 225           H8         A 225  16.948  23.006  -1.628
  709   1H6     A 225          1H6         A 225  11.263  24.434   0.515
  710   2H6     A 225          2H6         A 225  12.973  24.741   0.719
  711    H2     A 225           H2         A 225  10.805  21.521  -2.809
  712   1H5*    G 226          1H5*        G 226  15.763  22.081  -8.023
  713   2H5*    G 226          2H5*        G 226  16.041  23.135  -9.409
  714    H4*    G 226           H4*        G 226  13.814  22.545  -9.630
  715    H3*    G 226           H3*        G 226  14.029  25.233  -8.309
  716    H2*    G 226           H2*        G 226  11.653  25.418  -8.289
  717   2HO*    G 226          2HO*        G 226  10.548  23.486  -9.333
  718    H1*    G 226           H1*        G 226  11.298  22.890  -7.157
  719    H8     G 226           H8         G 226  14.330  24.409  -5.644
  720    H1     G 226           H1         G 226   8.824  26.592  -3.034
  721   1H2     G 226          1H2         G 226   7.226  25.981  -4.185
  722   2H2     G 226          2H2         G 226   7.358  25.019  -5.640
  723   1H5*    G 227          1H5*        G 227  12.879  25.233 -12.940
  724   2H5*    G 227          2H5*        G 227  14.508  24.691 -13.344
  725    H4*    G 227           H4*        G 227  13.491  25.732 -15.264
  726    H3*    G 227           H3*        G 227  15.803  27.192 -14.020
  727    H2*    G 227           H2*        G 227  15.726  28.807 -15.772
  728   2HO*    G 227          2HO*        G 227  15.136  27.694 -17.558
  729    H1*    G 227           H1*        G 227  12.981  29.230 -15.490
  730    H8     G 227           H8         G 227  14.537  28.669 -12.141
  731    H1     G 227           H1         G 227  15.113  34.752 -14.273
  732   1H2     G 227          1H2         G 227  14.532  34.847 -16.250
  733   2H2     G 227          2H2         G 227  13.973  33.482 -17.189
  734   1H5*    A 228          1H5*        A 228  16.801  26.640 -18.209
  735   2H5*    A 228          2H5*        A 228  18.523  26.287 -18.362
  736    H4*    A 228           H4*        A 228  17.878  28.229 -19.688
  737    H3*    A 228           H3*        A 228  19.810  28.631 -17.425
  738    H2*    A 228           H2*        A 228  20.072  30.913 -18.039
  739   2HO*    A 228          2HO*        A 228  18.212  30.847 -20.106
  740    H1*    A 228           H1*        A 228  17.300  31.342 -18.223
  741    H8     A 228           H8         A 228  18.003  29.161 -15.300
  742   1H6     A 228          1H6         A 228  19.081  34.363 -12.026
  743   2H6     A 228          2H6         A 228  18.859  32.632 -11.904
  744    H2     A 228           H2         A 228  18.746  35.466 -16.317
  745   1H5*    G 229          1H5*        G 229  21.609  30.132 -21.178
  746   2H5*    G 229          2H5*        G 229  23.310  29.669 -21.207
  747    H4*    G 229           H4*        G 229  23.043  32.042 -21.644
  748    H3*    G 229           H3*        G 229  24.468  31.237 -19.129
  749    H2*    G 229           H2*        G 229  24.935  33.523 -18.647
  750   2HO*    G 229          2HO*        G 229  24.486  35.054 -20.320
  751    H1*    G 229           H1*        G 229  22.287  34.320 -19.017
  752    H8     G 229           H8         G 229  22.081  31.010 -17.424
  753    H1     G 229           H1         G 229  23.657  35.676 -13.225
  754   1H2     G 229          1H2         G 229  24.154  37.392 -14.256
  755   2H2     G 229          2H2         G 229  24.145  37.544 -15.999
  756   1H5*    G 230          1H5*        G 230  27.441  34.105 -21.383
  757   2H5*    G 230          2H5*        G 230  28.951  33.280 -20.995
  758    H4*    G 230           H4*        G 230  28.938  35.688 -20.408
  759    H3*    G 230           H3*        G 230  29.425  33.606 -18.297
  760    H2*    G 230           H2*        G 230  29.847  35.324 -16.699
  761   2HO*    G 230          2HO*        G 230  29.277  37.481 -18.294
  762    H1*    G 230           H1*        G 230  27.512  36.717 -17.328
  763    H8     G 230           H8         G 230  26.596  33.167 -17.585
  764    H1     G 230           H1         G 230  27.031  35.161 -11.442
  765   1H2     G 230          1H2         G 230  27.943  37.009 -11.381
  766   2H2     G 230          2H2         G 230  28.506  37.888 -12.785
  767   1H5*    G 231          1H5*        G 231  32.819  36.451 -17.906
  768   2H5*    G 231          2H5*        G 231  34.236  35.402 -17.895
  769    H4*    G 231           H4*        G 231  34.360  36.882 -16.021
  770    H3*    G 231           H3*        G 231  33.816  34.006 -15.356
  771    H2*    G 231           H2*        G 231  33.928  34.513 -13.030
  772   2HO*    G 231          2HO*        G 231  34.854  36.478 -12.447
  773    H1*    G 231           H1*        G 231  32.156  36.659 -13.239
  774    H8     G 231           H8         G 231  30.990  34.043 -15.588
  775    H1     G 231           H1         G 231  29.347  32.832  -9.447
  776   1H2     G 231          1H2         G 231  30.360  34.121  -8.196
  777   2H2     G 231          2H2         G 231  31.487  35.347  -8.731
  778   1H5*    C 232          1H5*        C 232  36.768  35.376 -13.023
  779   2H5*    C 232          2H5*        C 232  38.249  34.424 -12.937
  780    H4*    C 232           H4*        C 232  37.609  34.786 -10.712
  781    H3*    C 232           H3*        C 232  36.903  32.013 -11.636
  782    H2*    C 232           H2*        C 232  36.153  31.477  -9.445
  783   2HO*    C 232          2HO*        C 232  36.676  34.062  -8.470
  784    H1*    C 232           H1*        C 232  34.626  33.819  -9.212
  785   1H4     C 232          1H4         C 232  30.429  29.451 -11.213
  786   2H4     C 232          2H4         C 232  31.040  29.613 -12.844
  787    H5     C 232           H5         C 232  32.898  30.950 -13.426
  788    H6     C 232           H6         C 232  34.646  32.474 -12.576
  789   1H5*    A 233          1H5*        A 233  39.661  31.486  -8.066
  790   2H5*    A 233          2H5*        A 233  40.679  30.111  -8.490
  791    H4*    A 233           H4*        A 233  39.596  29.816  -6.320
  792    H3*    A 233           H3*        A 233  38.918  27.894  -8.529
  793    H2*    A 233           H2*        A 233  37.602  26.618  -7.014
  794   2HO*    A 233          2HO*        A 233  37.784  28.072  -4.765
  795    H1*    A 233           H1*        A 233  36.229  28.841  -6.035
  796    H8     A 233           H8         A 233  36.686  29.493  -9.627
  797   1H6     A 233          1H6         A 233  31.773  25.798 -10.709
  798   2H6     A 233          2H6         A 233  32.864  26.956 -11.438
  799    H2     A 233           H2         A 233  32.971  25.307  -6.459
  800   1H5*    G 234          1H5*        G 234  40.514  25.131  -5.150
  801   2H5*    G 234          2H5*        G 234  41.590  24.120  -6.115
  802    H4*    G 234           H4*        G 234  40.120  22.731  -4.808
  803    H3*    G 234           H3*        G 234  39.691  22.692  -7.782
  804    H2*    G 234           H2*        G 234  38.052  20.983  -7.520
  805   2HO*    G 234          2HO*        G 234  37.956  20.801  -4.823
  806    H1*    G 234           H1*        G 234  36.674  22.371  -5.529
  807    H8     G 234           H8         G 234  37.951  24.801  -8.048
  808    H1     G 234           H1         G 234  32.459  21.889  -9.849
  809   1H2     G 234          1H2         G 234  32.052  20.330  -8.562
  810   2H2     G 234          2H2         G 234  33.051  19.879  -7.198
  811   1H    GLY  15          1H        GLY  15   3.762  -0.579  -2.352
  812   1HA   GLY  15          1HA       GLY  15   4.503  -1.591  -0.087
  813   2HA   GLY  15          2HA       GLY  15   5.583  -2.526  -1.109
  814    H    ARG  16           H        ARG  16   7.577  -1.759  -1.180
  815    HA   ARG  16           HA       ARG  16   8.039   1.062  -0.563
  816   1HB   ARG  16          2HB       ARG  16  10.429   0.355  -0.360
  817   2HB   ARG  16          3HB       ARG  16   9.341  -0.455   0.761
  818   1HG   ARG  16          2HG       ARG  16   9.748  -1.865  -1.775
  819   2HG   ARG  16          3HG       ARG  16  11.193  -1.699  -0.777
  820   1HD   ARG  16          2HD       ARG  16  10.457  -3.197   0.706
  821   2HD   ARG  16          3HD       ARG  16   8.859  -2.455   0.775
  822    HE   ARG  16           HE       ARG  16   9.012  -3.830  -1.630
  823   1HH1  ARG  16          2HH1      ARG  16   9.113  -4.548   1.775
  824   2HH1  ARG  16          1HH1      ARG  16   8.439  -6.134   1.594
  825   1HH2  ARG  16          2HH2      ARG  16   8.122  -5.916  -1.881
  826   2HH2  ARG  16          1HH2      ARG  16   7.876  -6.911  -0.486
  827    H    ALA  17           H        ALA  17   9.444   2.357  -1.849
  828    HA   ALA  17           HA       ALA  17  10.347   1.449  -4.414
  829   1HB   ALA  17          1HB       ALA  17   8.944   3.183  -5.652
  830   2HB   ALA  17          2HB       ALA  17   8.133   1.700  -5.145
  831   3HB   ALA  17          3HB       ALA  17   7.906   3.188  -4.225
  832    H    ARG  18           H        ARG  18  11.269   2.856  -1.953
  833    HA   ARG  18           HA       ARG  18  11.765   5.571  -2.499
  834   1HB   ARG  18          2HB       ARG  18  12.743   3.555  -0.585
  835   2HB   ARG  18          3HB       ARG  18  13.873   4.859  -0.926
  836   1HG   ARG  18          2HG       ARG  18  11.094   5.667  -0.359
  837   2HG   ARG  18          3HG       ARG  18  12.005   4.978   0.987
  838   1HD   ARG  18          2HD       ARG  18  12.896   7.287  -0.736
  839   2HD   ARG  18          3HD       ARG  18  12.209   7.424   0.882
  840    HE   ARG  18           HE       ARG  18  14.311   5.792   1.278
  841   1HH1  ARG  18          2HH1      ARG  18  13.984   8.859  -0.337
  842   2HH1  ARG  18          1HH1      ARG  18  15.603   9.366   0.018
  843   1HH2  ARG  18          2HH2      ARG  18  16.445   6.448   1.750
  844   2HH2  ARG  18          1HH2      ARG  18  17.002   7.992   1.203
  845    H    GLY  19           H        GLY  19  12.455   5.751  -4.652
  846   1HA   GLY  19          1HA       GLY  19  15.007   6.173  -5.274
  847   2HA   GLY  19          2HA       GLY  19  14.927   4.425  -5.439
  848    H    LEU  20           H        LEU  20  11.969   5.024  -6.273
  849    HA   LEU  20           HA       LEU  20  12.628   5.614  -9.084
  850   1HB   LEU  20          2HB       LEU  20  11.010   3.518  -7.821
  851   2HB   LEU  20          3HB       LEU  20  10.244   4.303  -9.200
  852    HG   LEU  20           HG       LEU  20  13.017   3.437  -9.652
  853   1HD1  LEU  20          1HD1      LEU  20  12.664   1.139  -9.682
  854   2HD1  LEU  20          2HD1      LEU  20  10.912   1.307  -9.584
  855   3HD1  LEU  20          3HD1      LEU  20  11.910   1.648  -8.171
  856   1HD2  LEU  20          1HD2      LEU  20  11.565   4.373 -11.397
  857   2HD2  LEU  20          2HD2      LEU  20  10.445   3.029 -11.175
  858   3HD2  LEU  20          3HD2      LEU  20  12.077   2.727 -11.774
  859    H    CYS  21           H        CYS  21  11.781   7.496  -9.900
  860    HA   CYS  21           HA       CYS  21  10.059   9.050  -8.350
  861   1HB   CYS  21          2HB       CYS  21  11.579  10.058  -9.955
  862   2HB   CYS  21          3HB       CYS  21  10.793   9.237 -11.289
  863    H    TYR  22           H        TYR  22   7.862   9.357  -8.509
  864    HA   TYR  22           HA       TYR  22   6.363   7.338 -10.035
  865   1HB   TYR  22          2HB       TYR  22   6.162   7.340  -7.524
  866   2HB   TYR  22          3HB       TYR  22   5.391   8.917  -7.649
  867    HD1  TYR  22           HD1      TYR  22   4.945   5.962  -9.863
  868    HD2  TYR  22           HD2      TYR  22   3.206   8.496  -6.920
  869    HE1  TYR  22           HE1      TYR  22   2.771   4.863 -10.210
  870    HE2  TYR  22           HE2      TYR  22   1.028   7.404  -7.258
  871    HH   TYR  22           HH       TYR  22   0.520   5.074  -9.827
  872    H    THR  23           H        THR  23   7.261   9.653 -11.343
  873    HA   THR  23           HA       THR  23   4.685  10.865 -12.033
  874    HB   THR  23           HB       THR  23   7.203  12.435 -11.457
  875    HG1  THR  23           HG1      THR  23   4.595  12.657 -10.331
  876   1HG2  THR  23          1HG2      THR  23   4.631  13.226 -12.803
  877   2HG2  THR  23          2HG2      THR  23   6.285  13.463 -13.368
  878   3HG2  THR  23          3HG2      THR  23   5.674  14.404 -12.008
  879    H    CYS  24           H        CYS  24   8.205  10.628 -12.919
  880    HA   CYS  24           HA       CYS  24   7.311  10.733 -15.705
  881   1HB   CYS  24          2HB       CYS  24   9.587  11.447 -16.273
  882   2HB   CYS  24          3HB       CYS  24   8.838  12.549 -15.135
  883    H    GLY  25           H        GLY  25   9.205   9.085 -13.244
  884   1HA   GLY  25          1HA       GLY  25   9.286   6.671 -13.206
  885   2HA   GLY  25          2HA       GLY  25   9.303   6.692 -14.963
  886    H    SER  26           H        SER  26  11.259   8.859 -13.043
  887    HA   SER  26           HA       SER  26  13.651   7.578 -14.149
  888   1HB   SER  26          2HB       SER  26  13.087  10.119 -14.351
  889   2HB   SER  26          3HB       SER  26  13.676  10.203 -12.691
  890    HG   SER  26           HG       SER  26  15.062   9.569 -15.047
  891    HA   PRO  27           HA       PRO  27  14.342   5.828 -10.104
  892   1HB   PRO  27          2HB       PRO  27  16.650   4.556 -10.757
  893   2HB   PRO  27          3HB       PRO  27  15.055   3.943 -11.208
  894   1HG   PRO  27          2HG       PRO  27  17.022   5.491 -12.850
  895   2HG   PRO  27          3HG       PRO  27  16.044   4.085 -13.309
  896   1HD   PRO  27          2HD       PRO  27  15.369   6.618 -13.992
  897   2HD   PRO  27          3HD       PRO  27  14.157   5.360 -13.670
  898    H    GLY  28           H        GLY  28  14.797   7.694  -8.912
  899   1HA   GLY  28          1HA       GLY  28  17.274   8.035  -7.826
  900   2HA   GLY  28          2HA       GLY  28  17.287   9.100  -9.224
  901    H    HIS  29           H        HIS  29  15.301  10.569  -9.364
  902    HA   HIS  29           HA       HIS  29  15.036  11.884  -6.781
  903   1HB   HIS  29          2HB       HIS  29  14.214  13.784  -8.006
  904   2HB   HIS  29          3HB       HIS  29  15.633  13.168  -8.847
  905    HD1  HIS  29           HD1      HIS  29  15.356  12.700 -11.272
  906    HD2  HIS  29           HD2      HIS  29  11.708  12.952  -9.299
  907    HE1  HIS  29           HE1      HIS  29  13.607  12.574 -13.074
  908    H    TYR  30           H        TYR  30  12.813  12.934  -6.378
  909    HA   TYR  30           HA       TYR  30  10.749  10.874  -6.799
  910   1HB   TYR  30          2HB       TYR  30  11.677  12.228  -4.411
  911   2HB   TYR  30          3HB       TYR  30   9.950  12.471  -4.643
  912    HD1  TYR  30           HD1      TYR  30  12.398   9.653  -4.941
  913    HD2  TYR  30           HD2      TYR  30   8.585  10.958  -3.578
  914    HE1  TYR  30           HE1      TYR  30  11.966   7.413  -4.022
  915    HE2  TYR  30           HE2      TYR  30   8.142   8.722  -2.655
  916    HH   TYR  30           HH       TYR  30   8.840   6.571  -2.626
  917    H    GLN  31           H        GLN  31   8.465  11.875  -6.446
  918    HA   GLN  31           HA       GLN  31   7.883  13.543  -8.570
  919   1HB   GLN  31          2HB       GLN  31   6.137  12.236  -7.606
  920   2HB   GLN  31          3HB       GLN  31   6.350  12.992  -6.032
  921   1HG   GLN  31          2HG       GLN  31   5.726  14.889  -8.155
  922   2HG   GLN  31          3HG       GLN  31   4.474  13.675  -7.898
  923   1HE2  GLN  31          1HE2      GLN  31   2.995  15.061  -7.015
  924   2HE2  GLN  31          2HE2      GLN  31   3.198  15.804  -5.469
  925    H    ALA  32           H        ALA  32   8.472  14.379  -5.188
  926    HA   ALA  32           HA       ALA  32   7.800  17.100  -5.342
  927   1HB   ALA  32          1HB       ALA  32  10.000  16.263  -3.534
  928   2HB   ALA  32          2HB       ALA  32   8.587  17.267  -3.211
  929   3HB   ALA  32          3HB       ALA  32   8.419  15.514  -3.310
  930    H    GLN  33           H        GLN  33  10.454  15.378  -6.625
  931    HA   GLN  33           HA       GLN  33  11.819  17.917  -7.228
  932   1HB   GLN  33          2HB       GLN  33  12.850  15.739  -5.790
  933   2HB   GLN  33          3HB       GLN  33  13.591  15.641  -7.381
  934   1HG   GLN  33          2HG       GLN  33  14.060  18.171  -7.023
  935   2HG   GLN  33          3HG       GLN  33  13.806  17.785  -5.321
  936   1HE2  GLN  33          1HE2      GLN  33  15.954  17.685  -7.949
  937   2HE2  GLN  33          2HE2      GLN  33  17.246  16.844  -7.169
  938    H    CYS  34           H        CYS  34   9.756  16.026  -8.686
  939    HA   CYS  34           HA       CYS  34  11.219  14.988 -10.864
  940   1HB   CYS  34          2HB       CYS  34   8.980  14.155 -10.109
  941   2HB   CYS  34          3HB       CYS  34   8.255  15.627 -10.722
  942    HA   PRO  35           HA       PRO  35  11.863  18.926 -12.865
  943   1HB   PRO  35          2HB       PRO  35  12.901  17.914 -15.160
  944   2HB   PRO  35          3HB       PRO  35  13.816  18.005 -13.650
  945   1HG   PRO  35          2HG       PRO  35  12.383  15.671 -14.858
  946   2HG   PRO  35          3HG       PRO  35  13.978  15.727 -14.085
  947   1HD   PRO  35          2HD       PRO  35  11.767  14.829 -12.804
  948   2HD   PRO  35          3HD       PRO  35  13.087  15.662 -11.959
  949    H    LYS  36           H        LYS  36   9.758  16.422 -13.864
  950    HA   LYS  36           HA       LYS  36   8.723  17.972 -16.119
  951   1HB   LYS  36          2HB       LYS  36   9.166  15.369 -16.043
  952   2HB   LYS  36          3HB       LYS  36   7.575  15.339 -15.294
  953   1HG   LYS  36          2HG       LYS  36   6.555  15.631 -17.243
  954   2HG   LYS  36          3HG       LYS  36   7.604  16.983 -17.674
  955   1HD   LYS  36          2HD       LYS  36   9.364  15.276 -18.266
  956   2HD   LYS  36          3HD       LYS  36   8.116  14.041 -18.078
  957   1HE   LYS  36          2HE       LYS  36   6.834  15.750 -19.708
  958   2HE   LYS  36          3HE       LYS  36   8.497  16.059 -20.203
  959   1HZ   LYS  36          1HZ       LYS  36   8.742  13.624 -20.509
  960   2HZ   LYS  36          2HZ       LYS  36   7.622  14.331 -21.560
  961   3HZ   LYS  36          3HZ       LYS  36   7.084  13.450 -20.220
  962    H    LYS  37           H        LYS  37   8.297  17.952 -12.900
  963    HA   LYS  37           HA       LYS  37   5.384  18.183 -12.936
  964   1HB   LYS  37          2HB       LYS  37   7.307  17.365 -11.000
  965   2HB   LYS  37          3HB       LYS  37   6.475  18.779 -10.369
  966   1HG   LYS  37          2HG       LYS  37   4.897  16.532 -11.539
  967   2HG   LYS  37          3HG       LYS  37   5.543  16.401  -9.902
  968   1HD   LYS  37          2HD       LYS  37   4.464  18.777  -9.623
  969   2HD   LYS  37          3HD       LYS  37   3.473  18.256 -10.989
  970   1HE   LYS  37          2HE       LYS  37   3.515  16.092  -9.215
  971   2HE   LYS  37          3HE       LYS  37   3.298  17.522  -8.208
  972   1HZ   LYS  37          1HZ       LYS  37   1.204  16.496  -9.039
  973   2HZ   LYS  37          2HZ       LYS  37   1.652  16.950 -10.607
  974   3HZ   LYS  37          3HZ       LYS  37   1.377  18.134  -9.430
  975    H    ARG  38           H        ARG  38   7.280  20.159 -14.161
  976    HA   ARG  38           HA       ARG  38   6.795  22.522 -12.508
  977   1HB   ARG  38          2HB       ARG  38   8.277  23.682 -14.095
  978   2HB   ARG  38          3HB       ARG  38   9.046  22.265 -13.396
  979   1HG   ARG  38          2HG       ARG  38   9.074  21.128 -15.370
  980   2HG   ARG  38          3HG       ARG  38   7.640  21.948 -15.989
  981   1HD   ARG  38          2HD       ARG  38  10.232  23.401 -15.574
  982   2HD   ARG  38          3HD       ARG  38   9.902  22.507 -17.058
  983    HE   ARG  38           HE       ARG  38   7.729  24.156 -16.667
  984   1HH1  ARG  38          2HH1      ARG  38  11.161  24.542 -17.112
  985   2HH1  ARG  38          1HH1      ARG  38  11.019  26.088 -17.881
  986   1HH2  ARG  38          2HH2      ARG  38   7.530  26.191 -17.677
  987   2HH2  ARG  38          1HH2      ARG  38   8.953  27.026 -18.201
  988    H    LYS  39           H        LYS  39   6.245  24.557 -13.865
  989    HA   LYS  39           HA       LYS  39   4.752  24.372 -16.225
  990   1HB   LYS  39          2HB       LYS  39   3.332  23.252 -14.181
  991   2HB   LYS  39          3HB       LYS  39   2.771  24.917 -14.116
  992   1HG   LYS  39          2HG       LYS  39   2.545  24.510 -16.741
  993   2HG   LYS  39          3HG       LYS  39   2.350  22.847 -16.184
  994   1HD   LYS  39          2HD       LYS  39   0.796  25.101 -14.954
  995   2HD   LYS  39          3HD       LYS  39   0.244  24.300 -16.427
  996   1HE   LYS  39          2HE       LYS  39  -0.647  22.684 -15.191
  997   2HE   LYS  39          3HE       LYS  39   0.960  22.274 -14.592
  998   1HZ   LYS  39          1HZ       LYS  39  -0.915  22.931 -12.944
  999   2HZ   LYS  39          2HZ       LYS  39  -0.501  24.514 -13.372
 1000   3HZ   LYS  39          3HZ       LYS  39   0.661  23.492 -12.689
 1001    H    SER  40           H        SER  40   3.371  26.388 -16.561
 1002    HA   SER  40           HA       SER  40   4.878  28.656 -15.522
 1003   1HB   SER  40          2HB       SER  40   3.195  28.137 -17.908
 1004   2HB   SER  40          3HB       SER  40   3.156  29.781 -17.271
 1005    HG   SER  40           HG       SER  40   5.369  28.310 -18.230
 1006    H    GLY  41           H        GLY  41   1.414  28.190 -16.245
 1007   1HA   GLY  41          1HA       GLY  41  -0.256  28.304 -14.490
 1008   2HA   GLY  41          2HA       GLY  41   0.807  29.405 -13.627
 1009    H    ASN  42           H        ASN  42  -1.985  29.773 -14.367
 1010    HA   ASN  42           HA       ASN  42  -1.683  32.353 -15.686
 1011   1HB   ASN  42          2HB       ASN  42  -2.316  30.438 -17.352
 1012   2HB   ASN  42          3HB       ASN  42  -3.913  30.578 -16.622
 1013   1HD2  ASN  42          1HD2      ASN  42  -1.845  31.743 -18.972
 1014   2HD2  ASN  42          2HD2      ASN  42  -2.721  33.166 -19.410
 1015    H    SER  43           H        SER  43  -2.130  31.834 -13.001
 1016    HA   SER  43           HA       SER  43  -4.957  32.038 -12.446
 1017   1HB   SER  43          2HB       SER  43  -2.674  32.450 -10.509
 1018   2HB   SER  43          3HB       SER  43  -4.343  32.026 -10.130
 1019    HG   SER  43           HG       SER  43  -2.869  30.228 -10.090
 1020    H    ARG  44           H        ARG  44  -5.180  33.845 -10.454
 1021    HA   ARG  44           HA       ARG  44  -4.398  36.404 -11.686
 1022   1HB   ARG  44          2HB       ARG  44  -6.958  35.455 -11.609
 1023   2HB   ARG  44          3HB       ARG  44  -6.895  36.403 -10.129
 1024   1HG   ARG  44          2HG       ARG  44  -6.930  38.339 -11.236
 1025   2HG   ARG  44          3HG       ARG  44  -5.759  37.781 -12.433
 1026   1HD   ARG  44          2HD       ARG  44  -7.506  36.606 -13.633
 1027   2HD   ARG  44          3HD       ARG  44  -8.686  37.056 -12.403
 1028    HE   ARG  44           HE       ARG  44  -7.707  39.438 -13.275
 1029   1HH1  ARG  44          2HH1      ARG  44  -9.129  36.673 -14.841
 1030   2HH1  ARG  44          1HH1      ARG  44  -9.820  37.597 -16.133
 1031   1HH2  ARG  44          2HH2      ARG  44  -8.613  40.666 -14.970
 1032   2HH2  ARG  44          1HH2      ARG  44  -9.526  39.868 -16.207
 1033    H    GLU  45           H        GLU  45  -4.533  38.258 -10.125
 1034    HA   GLU  45           HA       GLU  45  -3.830  39.278  -8.218
 1035   1HB   GLU  45          2HB       GLU  45  -4.796  36.789  -6.804
 1036   2HB   GLU  45          3HB       GLU  45  -4.559  38.381  -6.098
 1037   1HG   GLU  45          2HG       GLU  45  -6.321  39.195  -7.744
 1038   2HG   GLU  45          3HG       GLU  45  -6.681  37.491  -8.019
 1039    H    ARG  46           H        ARG  46  -2.075  37.403  -9.708
 1040    HA   ARG  46           HA       ARG  46  -0.266  36.525  -7.571
 1041   1HB   ARG  46          2HB       ARG  46  -1.064  35.053  -9.599
 1042   2HB   ARG  46          3HB       ARG  46   0.199  35.917 -10.463
 1043   1HG   ARG  46          2HG       ARG  46   1.891  35.006  -9.158
 1044   2HG   ARG  46          3HG       ARG  46   0.779  34.553  -7.865
 1045   1HD   ARG  46          2HD       ARG  46  -0.083  32.746  -9.091
 1046   2HD   ARG  46          3HD       ARG  46   0.592  33.344 -10.606
 1047    HE   ARG  46           HE       ARG  46   1.910  31.717  -8.658
 1048   1HH1  ARG  46          2HH1      ARG  46   2.398  34.132 -11.117
 1049   2HH1  ARG  46          1HH1      ARG  46   4.037  33.666 -11.434
 1050   1HH2  ARG  46          2HH2      ARG  46   4.066  31.094  -9.066
 1051   2HH2  ARG  46          1HH2      ARG  46   4.984  31.937 -10.267
 1052    H    CYS  47           H        CYS  47   2.220  36.712  -8.245
 1053    HA   CYS  47           HA       CYS  47   2.552  39.388  -9.393
 1054   1HB   CYS  47          2HB       CYS  47   2.868  39.438  -6.943
 1055   2HB   CYS  47          3HB       CYS  47   4.103  38.202  -7.067
 1056    H    GLN  48           H        GLN  48   3.657  39.219 -11.221
 1057    HA   GLN  48           HA       GLN  48   5.283  36.854 -11.764
 1058   1HB   GLN  48          2HB       GLN  48   3.518  38.329 -13.319
 1059   2HB   GLN  48          3HB       GLN  48   5.102  38.805 -13.917
 1060   1HG   GLN  48          2HG       GLN  48   4.979  36.996 -15.200
 1061   2HG   GLN  48          3HG       GLN  48   5.336  36.085 -13.733
 1062   1HE2  GLN  48          1HE2      GLN  48   3.272  36.355 -16.284
 1063   2HE2  GLN  48          2HE2      GLN  48   1.907  35.517 -15.638
 1064    H    LEU  49           H        LEU  49   6.180  38.982  -9.946
 1065    HA   LEU  49           HA       LEU  49   8.635  39.745 -11.384
 1066   1HB   LEU  49          2HB       LEU  49   6.707  41.440 -10.187
 1067   2HB   LEU  49          3HB       LEU  49   8.161  41.509  -9.194
 1068    HG   LEU  49           HG       LEU  49   8.567  41.813 -12.103
 1069   1HD1  LEU  49          1HD1      LEU  49   6.669  43.160 -12.087
 1070   2HD1  LEU  49          2HD1      LEU  49   7.987  44.297 -11.805
 1071   3HD1  LEU  49          3HD1      LEU  49   6.986  43.754 -10.458
 1072   1HD2  LEU  49          1HD2      LEU  49  10.530  42.285 -11.129
 1073   2HD2  LEU  49          2HD2      LEU  49   9.787  42.619  -9.564
 1074   3HD2  LEU  49          3HD2      LEU  49   9.811  43.864 -10.814
 1075    H    CYS  50           H        CYS  50   7.125  38.767  -8.272
 1076    HA   CYS  50           HA       CYS  50   9.813  37.962  -7.440
 1077   1HB   CYS  50          2HB       CYS  50   9.514  38.727  -5.240
 1078   2HB   CYS  50          3HB       CYS  50   8.954  40.052  -6.241
 1079    H    ASN  51           H        ASN  51   7.217  36.860  -8.700
 1080    HA   ASN  51           HA       ASN  51   6.009  34.935  -8.682
 1081   1HB   ASN  51          2HB       ASN  51   8.458  34.248  -7.140
 1082   2HB   ASN  51          3HB       ASN  51   7.109  33.120  -7.048
 1083   1HD2  ASN  51          1HD2      ASN  51   9.773  34.126  -8.822
 1084   2HD2  ASN  51          2HD2      ASN  51   9.481  33.215 -10.261
 1085    H    GLY  52           H        GLY  52   5.640  37.085  -6.568
 1086   1HA   GLY  52          1HA       GLY  52   4.771  35.854  -4.174
 1087   2HA   GLY  52          2HA       GLY  52   4.317  37.459  -4.727
 1088    H    MET  53           H        MET  53   2.594  35.662  -3.373
 1089    HA   MET  53           HA       MET  53   0.617  35.154  -5.497
 1090   1HB   MET  53          2HB       MET  53   1.696  33.116  -4.287
 1091   2HB   MET  53          3HB       MET  53   0.657  33.574  -2.944
 1092   1HG   MET  53          2HG       MET  53  -1.306  33.284  -4.297
 1093   2HG   MET  53          3HG       MET  53  -0.321  32.983  -5.726
 1094   1HE   MET  53          1HE       MET  53   0.997  29.448  -5.314
 1095   2HE   MET  53          2HE       MET  53   0.452  30.672  -6.463
 1096   3HE   MET  53          3HE       MET  53   1.764  31.036  -5.341
 1097    H    GLY  54           H        GLY  54  -0.590  36.987  -5.275
 1098   1HA   GLY  54          1HA       GLY  54  -2.715  37.285  -3.749
 1099   2HA   GLY  54          2HA       GLY  54  -1.478  37.786  -2.605
 1100    H    HIS  55           H        HIS  55   0.185  39.365  -3.842
 1101    HA   HIS  55           HA       HIS  55  -1.455  41.645  -4.570
 1102   1HB   HIS  55          2HB       HIS  55   0.665  42.913  -4.437
 1103   2HB   HIS  55          3HB       HIS  55   0.347  41.990  -2.970
 1104    HD1  HIS  55           HD1      HIS  55   1.735  39.672  -2.785
 1105    HD2  HIS  55           HD2      HIS  55   3.096  42.440  -5.568
 1106    HE1  HIS  55           HE1      HIS  55   4.093  38.982  -3.322
 1107    H    ASN  56           H        ASN  56   0.008  43.115  -6.256
 1108    HA   ASN  56           HA       ASN  56   0.237  41.436  -8.668
 1109   1HB   ASN  56          2HB       ASN  56  -1.566  43.498  -8.215
 1110   2HB   ASN  56          3HB       ASN  56  -0.303  44.255  -9.181
 1111   1HD2  ASN  56          1HD2      ASN  56  -2.884  41.986  -9.122
 1112   2HD2  ASN  56          2HD2      ASN  56  -2.879  41.607 -10.807
 1113    H    ALA  57           H        ALA  57   1.819  42.016 -10.215
 1114    HA   ALA  57           HA       ALA  57   4.305  42.749  -9.192
 1115   1HB   ALA  57          1HB       ALA  57   3.198  42.086 -11.786
 1116   2HB   ALA  57          2HB       ALA  57   4.472  43.301 -11.900
 1117   3HB   ALA  57          3HB       ALA  57   4.797  41.752 -11.121
 1118    H    LYS  58           H        LYS  58   1.831  44.685 -10.791
 1119    HA   LYS  58           HA       LYS  58   3.342  47.023 -11.171
 1120   1HB   LYS  58          2HB       LYS  58   0.851  46.265 -11.871
 1121   2HB   LYS  58          3HB       LYS  58   0.465  47.320 -10.518
 1122   1HG   LYS  58          2HG       LYS  58   0.669  49.073 -11.847
 1123   2HG   LYS  58          3HG       LYS  58   2.368  48.670 -12.107
 1124   1HD   LYS  58          2HD       LYS  58   0.135  47.389 -13.666
 1125   2HD   LYS  58          3HD       LYS  58   0.928  48.878 -14.184
 1126   1HE   LYS  58          2HE       LYS  58   2.740  47.783 -14.906
 1127   2HE   LYS  58          3HE       LYS  58   2.809  46.772 -13.463
 1128   1HZ   LYS  58          1HZ       LYS  58   2.410  45.553 -15.582
 1129   2HZ   LYS  58          2HZ       LYS  58   0.904  46.314 -15.690
 1130   3HZ   LYS  58          3HZ       LYS  58   1.237  45.279 -14.393
 1131    H    GLN  59           H        GLN  59   1.979  45.621  -8.339
 1132    HA   GLN  59           HA       GLN  59   2.567  48.083  -6.830
 1133   1HB   GLN  59          2HB       GLN  59   0.153  46.975  -6.930
 1134   2HB   GLN  59          3HB       GLN  59   0.832  45.955  -5.668
 1135   1HG   GLN  59          2HG       GLN  59   1.551  48.379  -4.751
 1136   2HG   GLN  59          3HG       GLN  59   0.065  48.794  -5.606
 1137   1HE2  GLN  59          1HE2      GLN  59  -1.779  47.219  -5.139
 1138   2HE2  GLN  59          2HE2      GLN  59  -2.005  46.794  -3.480
 1139    H    CYS  60           H        CYS  60   4.235  45.520  -7.650
 1140    HA   CYS  60           HA       CYS  60   4.805  44.481  -5.022
 1141   1HB   CYS  60          2HB       CYS  60   4.732  42.945  -6.943
 1142   2HB   CYS  60          3HB       CYS  60   6.030  43.827  -7.723
 1143    H    ARG  61           H        ARG  61   6.666  44.932  -3.909
 1144    HA   ARG  61           HA       ARG  61   8.377  46.214  -3.121
 1145   1HB   ARG  61          2HB       ARG  61   9.077  45.569  -5.930
 1146   2HB   ARG  61          3HB       ARG  61  10.026  46.830  -5.153
 1147   1HG   ARG  61          2HG       ARG  61  11.166  45.358  -3.937
 1148   2HG   ARG  61          3HG       ARG  61   9.700  44.497  -3.460
 1149   1HD   ARG  61          2HD       ARG  61   9.945  42.941  -5.064
 1150   2HD   ARG  61          3HD       ARG  61  10.479  44.119  -6.261
 1151    HE   ARG  61           HE       ARG  61  12.580  43.877  -4.524
 1152   1HH1  ARG  61          2HH1      ARG  61  10.743  41.699  -6.523
 1153   2HH1  ARG  61          1HH1      ARG  61  12.066  40.608  -6.776
 1154   1HH2  ARG  61          2HH2      ARG  61  14.330  42.451  -4.850
 1155   2HH2  ARG  61          1HH2      ARG  61  14.105  41.037  -5.823
 1156    H    LYS  62           H        LYS  62   7.044  47.999  -2.581
 1157    HA   LYS  62           HA       LYS  62   7.766  50.415  -4.002
 1158   1HB   LYS  62          2HB       LYS  62   5.395  49.213  -4.724
 1159   2HB   LYS  62          3HB       LYS  62   4.878  50.371  -3.505
 1160   1HG   LYS  62          2HG       LYS  62   5.217  52.117  -4.852
 1161   2HG   LYS  62          3HG       LYS  62   6.750  51.480  -5.451
 1162   1HD   LYS  62          2HD       LYS  62   5.330  49.830  -6.796
 1163   2HD   LYS  62          3HD       LYS  62   3.966  50.883  -6.412
 1164   1HE   LYS  62          2HE       LYS  62   4.786  52.626  -7.677
 1165   2HE   LYS  62          3HE       LYS  62   6.454  52.073  -7.550
 1166   1HZ   LYS  62          1HZ       LYS  62   5.419  50.059  -8.902
 1167   2HZ   LYS  62          2HZ       LYS  62   6.040  51.436  -9.663
 1168   3HZ   LYS  62          3HZ       LYS  62   4.373  51.279  -9.427
 1169    H    ARG  63           H        ARG  63   5.342  49.326  -1.615
 1170    HA   ARG  63           HA       ARG  63   6.443  51.321   0.253
 1171   1HB   ARG  63          2HB       ARG  63   4.047  51.626  -0.681
 1172   2HB   ARG  63          3HB       ARG  63   3.621  50.302   0.394
 1173   1HG   ARG  63          2HG       ARG  63   3.468  51.701   2.098
 1174   2HG   ARG  63          3HG       ARG  63   5.141  52.210   1.860
 1175   1HD   ARG  63          2HD       ARG  63   3.792  54.160   1.717
 1176   2HD   ARG  63          3HD       ARG  63   4.310  53.768   0.078
 1177    HE   ARG  63           HE       ARG  63   2.122  53.416  -0.487
 1178   1HH1  ARG  63          2HH1      ARG  63   2.414  53.410   2.981
 1179   2HH1  ARG  63          1HH1      ARG  63   0.704  53.361   3.256
 1180   1HH2  ARG  63          2HH2      ARG  63  -0.131  53.353  -0.139
 1181   2HH2  ARG  63          1HH2      ARG  63  -0.742  53.329   1.480
 1182    H    ASP  64           H        ASP  64   7.584  48.821   0.133
 1183    HA   ASP  64           HA       ASP  64   7.393  47.960   2.811
 1184   1HB   ASP  64          2HB       ASP  64   5.441  46.823   1.113
 1185   2HB   ASP  64          3HB       ASP  64   6.643  45.568   1.403
  Start of MODEL   16
    1   1H5*    C 160          1H5*        C 160  25.045  32.242 -14.790
    2   2H5*    C 160          2H5*        C 160  24.197  30.867 -14.082
    3    H4*    C 160           H4*        C 160  26.220  30.842 -12.971
    4    H3*    C 160           H3*        C 160  24.228  32.341 -11.277
    5    H2*    C 160           H2*        C 160  25.855  32.495  -9.557
    6   2HO*    C 160          2HO*        C 160  27.829  31.217  -9.897
    7    H1*    C 160           H1*        C 160  27.895  33.261 -11.368
    8   1H4     C 160          1H4         C 160  25.922  38.718  -8.692
    9   2H4     C 160          2H4         C 160  24.591  38.773  -9.827
   10    H5     C 160           H5         C 160  24.096  37.045 -11.359
   11    H6     C 160           H6         C 160  24.764  34.818 -12.190
   12   1H5*    U 161          1H5*        U 161  25.263  28.801  -8.574
   13   2H5*    U 161          2H5*        U 161  23.753  28.536  -7.701
   14    H4*    U 161           H4*        U 161  25.694  29.022  -6.239
   15    H3*    U 161           H3*        U 161  23.271  30.805  -6.168
   16    H2*    U 161           H2*        U 161  24.213  31.980  -4.328
   17   2HO*    U 161          2HO*        U 161  25.096  30.123  -3.346
   18    H1*    U 161           H1*        U 161  26.710  32.262  -5.582
   19    H3     U 161           H3         U 161  24.632  36.373  -5.298
   20    H5     U 161           H5         U 161  23.340  34.678  -8.903
   21    H6     U 161           H6         U 161  24.387  32.582  -8.179
   22   1H5*    G 162          1H5*        G 162  23.793  29.147  -2.043
   23   2H5*    G 162          2H5*        G 162  22.175  28.748  -1.466
   24    H4*    G 162           H4*        G 162  23.286  30.127   0.156
   25    H3*    G 162           H3*        G 162  20.976  31.389  -1.288
   26    H2*    G 162           H2*        G 162  21.177  33.332   0.076
   27   2HO*    G 162          2HO*        G 162  23.403  32.063   1.352
   28    H1*    G 162           H1*        G 162  23.918  33.580  -0.382
   29    H8     G 162           H8         G 162  22.418  32.400  -3.549
   30    H1     G 162           H1         G 162  21.544  38.737  -2.571
   31   1H2     G 162          1H2         G 162  22.055  39.212  -0.631
   32   2H2     G 162          2H2         G 162  22.635  38.064   0.555
   33   1H5*    C 163          1H5*        C 163  20.404  31.924   2.669
   34   2H5*    C 163          2H5*        C 163  18.841  31.429   3.317
   35    H4*    C 163           H4*        C 163  19.115  33.629   4.048
   36    H3*    C 163           H3*        C 163  17.303  33.514   1.651
   37    H2*    C 163           H2*        C 163  16.912  35.851   1.843
   38   2HO*    C 163          2HO*        C 163  17.395  36.813   3.807
   39    H1*    C 163           H1*        C 163  19.632  36.466   2.084
   40   1H4     C 163          1H4         C 163  18.448  37.137  -4.150
   41   2H4     C 163          2H4         C 163  18.562  35.404  -4.354
   42    H5     C 163           H5         C 163  18.837  33.884  -2.566
   43    H6     C 163           H6         C 163  19.072  33.653  -0.119
   44   1H5*    C 164          1H5*        C 164  14.990  35.585   4.566
   45   2H5*    C 164          2H5*        C 164  13.338  34.968   4.559
   46    H4*    C 164           H4*        C 164  13.287  37.332   4.181
   47    H3*    C 164           H3*        C 164  12.575  35.650   1.789
   48    H2*    C 164           H2*        C 164  12.002  37.626   0.595
   49   2HO*    C 164          2HO*        C 164  12.702  39.422   2.574
   50    H1*    C 164           H1*        C 164  14.375  38.942   1.350
   51   1H4     C 164          1H4         C 164  15.649  36.592  -4.447
   52   2H4     C 164          2H4         C 164  15.950  35.022  -3.736
   53    H5     C 164           H5         C 164  15.611  34.525  -1.452
   54    H6     C 164           H6         C 164  14.892  35.421   0.734
   55   1H5*    C 165          1H5*        C 165   9.828  38.372   2.947
   56   2H5*    C 165          2H5*        C 165   8.083  38.152   2.814
   57    H4*    C 165           H4*        C 165   8.700  40.156   1.661
   58    H3*    C 165           H3*        C 165   7.799  37.879  -0.067
   59    H2*    C 165           H2*        C 165   8.032  39.210  -2.017
   60   2HO*    C 165          2HO*        C 165   8.993  41.504  -0.944
   61    H1*    C 165           H1*        C 165  10.584  40.154  -1.242
   62   1H4     C 165          1H4         C 165  11.679  35.412  -5.394
   63   2H4     C 165          2H4         C 165  11.606  34.274  -4.068
   64    H5     C 165           H5         C 165  11.009  34.863  -1.860
   65    H6     C 165           H6         C 165  10.328  36.709  -0.368
   66   1H5*    U 166          1H5*        U 166   5.261  41.087  -1.445
   67   2H5*    U 166          2H5*        U 166   3.604  40.507  -1.273
   68    H4*    U 166           H4*        U 166   3.777  41.246  -3.488
   69    H3*    U 166           H3*        U 166   3.934  38.250  -3.299
   70    H2*    U 166           H2*        U 166   4.003  38.102  -5.669
   71   2HO*    U 166          2HO*        U 166   3.622  40.121  -6.839
   72    H1*    U 166           H1*        U 166   5.995  40.047  -5.921
   73    H3     U 166           H3         U 166   7.998  36.071  -6.930
   74    H5     U 166           H5         U 166   7.973  36.216  -2.745
   75    H6     U 166           H6         U 166   6.555  38.208  -2.921
   76   1H5*    C 167          1H5*        C 167   0.074  38.633  -6.209
   77   2H5*    C 167          2H5*        C 167  -0.717  37.252  -5.448
   78    H4*    C 167           H4*        C 167  -0.388  37.067  -7.921
   79    H3*    C 167           H3*        C 167   0.667  34.971  -6.038
   80    H2*    C 167           H2*        C 167   1.302  33.639  -7.905
   81   2HO*    C 167          2HO*        C 167   0.076  33.965  -9.671
   82    H1*    C 167           H1*        C 167   2.566  35.783  -9.203
   83   1H4     C 167          1H4         C 167   7.168  32.663  -6.021
   84   2H4     C 167          2H4         C 167   6.898  33.736  -4.666
   85    H5     C 167           H5         C 167   5.146  35.318  -4.569
   86    H6     C 167           H6         C 167   3.205  36.269  -5.762
   87   1H5*    A 168          1H5*        A 168  -4.692  33.276  -6.982
   88   2H5*    A 168          2H5*        A 168  -3.998  32.671  -5.478
   89    H4*    A 168           H4*        A 168  -3.410  30.581  -7.016
   90    H3*    A 168           H3*        A 168  -5.632  31.951  -8.512
   91    H2*    A 168           H2*        A 168  -6.695  29.909  -8.882
   92   2HO*    A 168          2HO*        A 168  -5.371  28.001  -8.800
   93    H1*    A 168           H1*        A 168  -5.723  28.899  -6.296
   94    H8     A 168           H8         A 168  -8.363  28.685  -8.160
   95   1H6     A 168          1H6         A 168 -12.387  30.852  -3.910
   96   2H6     A 168          2H6         A 168 -12.251  29.953  -5.405
   97    H2     A 168           H2         A 168  -8.288  32.045  -2.678
   98   1H5*    U 169          1H5*        U 169  -4.304  31.241 -13.336
   99   2H5*    U 169          2H5*        U 169  -2.782  31.273 -12.445
  100    H4*    U 169           H4*        U 169  -2.282  33.420 -13.086
  101    H3*    U 169           H3*        U 169  -5.246  33.917 -13.298
  102    H2*    U 169           H2*        U 169  -4.813  35.734 -14.753
  103   2HO*    U 169          2HO*        U 169  -2.894  36.732 -14.441
  104    H1*    U 169           H1*        U 169  -2.861  34.241 -16.209
  105    H3     U 169           H3         U 169  -5.553  33.465 -19.698
  106    H5     U 169           H5         U 169  -8.267  33.823 -16.529
  107    H6     U 169           H6         U 169  -6.338  34.052 -15.032
  108   1H5*    C 170          1H5*        C 170  -6.187  33.459 -10.723
  109   2H5*    C 170          2H5*        C 170  -7.318  34.676 -11.314
  110    H4*    C 170           H4*        C 170  -8.303  33.665  -9.412
  111    H3*    C 170           H3*        C 170  -7.253  36.434  -8.863
  112    H2*    C 170           H2*        C 170  -8.189  36.342  -6.692
  113   2HO*    C 170          2HO*        C 170  -9.956  35.063  -6.479
  114    H1*    C 170           H1*        C 170  -7.285  33.637  -6.337
  115   1H4     C 170          1H4         C 170  -3.393  37.162  -2.702
  116   2H4     C 170          2H4         C 170  -2.499  37.626  -4.132
  117    H5     C 170           H5         C 170  -3.136  37.043  -6.330
  118    H6     C 170           H6         C 170  -4.806  35.858  -7.711
  119   1H5*    C 171          1H5*        C 171 -10.663  36.867  -6.974
  120   2H5*    C 171          2H5*        C 171 -11.611  38.078  -7.838
  121    H4*    C 171           H4*        C 171 -11.600  38.881  -5.671
  122    H3*    C 171           H3*        C 171  -9.401  40.242  -7.216
  123    H2*    C 171           H2*        C 171  -8.970  41.621  -5.329
  124   2HO*    C 171          2HO*        C 171 -11.194  41.839  -4.802
  125    H1*    C 171           H1*        C 171  -8.992  39.435  -3.548
  126   1H4     C 171          1H4         C 171  -2.786  40.270  -4.720
  127   2H4     C 171          2H4         C 171  -2.992  39.632  -6.337
  128    H5     C 171           H5         C 171  -5.082  39.023  -7.253
  129    H6     C 171           H6         C 171  -7.512  38.875  -6.841
  130   1H5*    G 172          1H5*        G 172 -12.303  43.608  -6.028
  131   2H5*    G 172          2H5*        G 172 -12.056  44.860  -7.245
  132    H4*    G 172           H4*        G 172 -11.641  45.622  -4.926
  133    H3*    G 172           H3*        G 172  -9.454  45.775  -6.983
  134    H2*    G 172           H2*        G 172  -8.066  46.906  -5.412
  135   2HO*    G 172          2HO*        G 172  -9.435  46.994  -3.190
  136    H1*    G 172           H1*        G 172  -8.514  45.019  -3.403
  137    H8     G 172           H8         G 172  -8.328  43.306  -6.712
  138    H1     G 172           H1         G 172  -2.527  44.567  -4.134
  139   1H2     G 172          1H2         G 172  -2.753  45.811  -2.505
  140   2H2     G 172          2H2         G 172  -4.286  46.421  -1.924
  141   1H5*    U 173          1H5*        U 173  -9.877  49.812  -5.574
  142   2H5*    U 173          2H5*        U 173  -9.851  50.922  -6.944
  143    H4*    U 173           H4*        U 173  -8.147  51.571  -5.398
  144    H3*    U 173           H3*        U 173  -7.132  50.361  -7.958
  145    H2*    U 173           H2*        U 173  -4.904  50.859  -7.296
  146   2HO*    U 173          2HO*        U 173  -5.757  51.942  -4.834
  147    H1*    U 173           H1*        U 173  -5.265  49.799  -4.717
  148    H3     U 173           H3         U 173  -2.394  46.987  -6.903
  149    H5     U 173           H5         U 173  -6.216  45.818  -8.157
  150    H6     U 173           H6         U 173  -7.089  47.809  -7.023
  151   1H5*    C 174          1H5*        C 174  -4.989  54.378  -8.025
  152   2H5*    C 174          2H5*        C 174  -5.373  54.877  -9.672
  153    H4*    C 174           H4*        C 174  -2.996  54.980  -9.338
  154    H3*    C 174           H3*        C 174  -3.956  52.821 -11.199
  155    H2*    C 174           H2*        C 174  -1.700  52.278 -11.718
  156   2HO*    C 174          2HO*        C 174  -0.555  54.126 -11.696
  157    H1*    C 174           H1*        C 174  -0.943  52.269  -8.994
  158   1H4     C 174          1H4         C 174  -1.890  46.143 -10.602
  159   2H4     C 174          2H4         C 174  -3.565  46.321 -10.130
  160    H5     C 174           H5         C 174  -4.546  48.378  -9.508
  161    H6     C 174           H6         C 174  -4.157  50.794  -9.180
  162   1H5*    U 175          1H5*        U 175  -4.804  54.239 -15.138
  163   2H5*    U 175          2H5*        U 175  -3.052  54.383 -14.994
  164    H4*    U 175           H4*        U 175  -3.580  55.294 -17.086
  165    H3*    U 175           H3*        U 175  -3.102  57.461 -15.048
  166    H2*    U 175           H2*        U 175  -3.293  59.085 -16.765
  167   2HO*    U 175          2HO*        U 175  -3.787  57.619 -18.937
  168    H1*    U 175           H1*        U 175  -5.590  57.795 -17.864
  169    H3     U 175           H3         U 175  -6.807  62.016 -16.495
  170    H5     U 175           H5         U 175  -7.023  59.614 -13.070
  171    H6     U 175           H6         U 175  -5.931  57.842 -14.364
  172   1H5*    C 176          1H5*        C 176  -0.209  55.008 -13.991
  173   2H5*    C 176          2H5*        C 176   0.687  56.372 -13.326
  174    H4*    C 176           H4*        C 176   2.763  55.467 -13.938
  175    H3*    C 176           H3*        C 176   1.252  53.796 -15.913
  176    H2*    C 176           H2*        C 176   2.866  52.062 -15.744
  177   2HO*    C 176          2HO*        C 176   4.622  53.540 -15.598
  178    H1*    C 176           H1*        C 176   2.867  52.129 -12.925
  179   1H4     C 176          1H4         C 176  -1.056  47.353 -14.611
  180   2H4     C 176          2H4         C 176  -2.383  48.491 -14.576
  181    H5     C 176           H5         C 176  -2.114  50.816 -14.260
  182    H6     C 176           H6         C 176  -0.489  52.639 -13.895
  183   1H5*    G 177          1H5*        G 177   5.424  53.906 -17.904
  184   2H5*    G 177          2H5*        G 177   4.927  54.441 -19.509
  185    H4*    G 177           H4*        G 177   6.301  52.473 -19.694
  186    H3*    G 177           H3*        G 177   3.408  52.150 -20.434
  187    H2*    G 177           H2*        G 177   3.833  49.910 -21.125
  188   2HO*    G 177          2HO*        G 177   6.277  49.358 -20.732
  189    H1*    G 177           H1*        G 177   5.158  49.249 -18.761
  190    H8     G 177           H8         G 177   2.365  51.543 -17.909
  191    H1     G 177           H1         G 177   0.446  45.427 -18.790
  192   1H2     G 177          1H2         G 177   1.988  44.334 -19.616
  193   2H2     G 177          2H2         G 177   3.566  44.978 -20.009
  194   1H5*    C 178          1H5*        C 178   5.681  50.683 -23.555
  195   2H5*    C 178          2H5*        C 178   5.173  51.243 -25.149
  196    H4*    C 178           H4*        C 178   5.250  48.877 -25.227
  197    H3*    C 178           H3*        C 178   2.479  50.017 -25.183
  198    H2*    C 178           H2*        C 178   1.537  47.846 -25.328
  199   2HO*    C 178          2HO*        C 178   3.831  46.367 -25.297
  200    H1*    C 178           H1*        C 178   3.269  46.817 -23.329
  201   1H4     C 178          1H4         C 178  -2.236  47.883 -20.279
  202   2H4     C 178          2H4         C 178  -1.850  49.587 -20.193
  203    H5     C 178           H5         C 178   0.040  50.562 -21.222
  204    H6     C 178           H6         C 178   2.045  50.135 -22.599
  205   1H5*    U 179          1H5*        U 179   2.615  47.465 -28.977
  206   2H5*    U 179          2H5*        U 179   1.518  48.294 -30.082
  207    H4*    U 179           H4*        U 179   0.924  45.922 -29.619
  208    H3*    U 179           H3*        U 179  -1.032  48.135 -29.051
  209    H2*    U 179           H2*        U 179  -2.684  46.524 -28.491
  210   2HO*    U 179          2HO*        U 179  -0.826  44.435 -29.017
  211    H1*    U 179           H1*        U 179  -0.933  45.056 -26.850
  212    H3     U 179           H3         U 179  -4.143  47.053 -24.221
  213    H5     U 179           H5         U 179  -1.098  49.897 -24.649
  214    H6     U 179           H6         U 179  -0.100  48.428 -26.340
  215   1H5*    U 180          1H5*        U 180  -2.872  45.490 -31.302
  216   2H5*    U 180          2H5*        U 180  -3.838  46.016 -32.681
  217    H4*    U 180           H4*        U 180  -5.262  44.763 -31.263
  218    H3*    U 180           H3*        U 180  -5.764  47.719 -31.204
  219    H2*    U 180           H2*        U 180  -7.564  47.424 -29.691
  220   2HO*    U 180          2HO*        U 180  -8.582  45.561 -30.143
  221    H1*    U 180           H1*        U 180  -6.071  45.631 -28.067
  222    H3     U 180           H3         U 180  -6.673  49.115 -25.249
  223    H5     U 180           H5         U 180  -3.966  50.595 -28.081
  224    H6     U 180           H6         U 180  -4.297  48.515 -29.338
  225   1H5*    A 181          1H5*        A 181  -9.108  46.677 -34.570
  226   2H5*    A 181          2H5*        A 181  -9.214  48.305 -35.241
  227    H4*    A 181           H4*        A 181 -11.235  47.478 -33.976
  228    H3*    A 181           H3*        A 181  -9.889  50.093 -33.334
  229    H2*    A 181           H2*        A 181 -11.617  50.583 -31.781
  230   2HO*    A 181          2HO*        A 181 -13.537  49.658 -32.243
  231    H1*    A 181           H1*        A 181 -11.502  48.046 -30.587
  232    H8     A 181           H8         A 181  -8.105  49.368 -31.486
  233   1H6     A 181          1H6         A 181  -8.047  52.061 -25.857
  234   2H6     A 181          2H6         A 181  -7.076  51.705 -27.267
  235    H2     A 181           H2         A 181 -12.109  50.409 -26.565
  236   1H5*    U 182          1H5*        U 182 -13.921  51.418 -36.170
  237   2H5*    U 182          2H5*        U 182 -13.435  49.931 -36.985
  238    H4*    U 182           H4*        U 182 -13.580  52.717 -38.141
  239    H3*    U 182           H3*        U 182 -15.111  50.163 -38.645
  240    H2*    U 182           H2*        U 182 -15.543  50.918 -40.842
  241   2HO*    U 182          2HO*        U 182 -15.952  53.054 -40.654
  242    H1*    U 182           H1*        U 182 -12.855  51.898 -41.120
  243    H3     U 182           H3         U 182 -13.428  48.835 -44.466
  244    H5     U 182           H5         U 182 -12.776  46.551 -41.016
  245    H6     U 182           H6         U 182 -12.944  48.630 -39.727
  246   1H5*    U 183          1H5*        U 183 -17.268  52.076 -35.831
  247   2H5*    U 183          2H5*        U 183 -18.978  51.645 -35.868
  248    H4*    U 183           H4*        U 183 -17.805  54.421 -35.619
  249    H3*    U 183           H3*        U 183 -19.137  52.566 -33.659
  250    H2*    U 183           H2*        U 183 -20.030  54.443 -32.510
  251   2HO*    U 183          2HO*        U 183 -18.837  56.230 -34.353
  252    H1*    U 183           H1*        U 183 -20.881  55.671 -34.915
  253    H3     U 183           H3         U 183 -24.811  54.698 -32.889
  254    H5     U 183           H5         U 183 -23.387  50.966 -34.145
  255    H6     U 183           H6         U 183 -21.307  52.089 -34.796
  256   1H5*    C 184          1H5*        C 184 -16.098  53.873 -29.620
  257   2H5*    C 184          2H5*        C 184 -16.022  55.201 -30.777
  258    H4*    C 184           H4*        C 184 -13.862  53.829 -29.304
  259    H3*    C 184           H3*        C 184 -14.377  56.628 -30.311
  260    H2*    C 184           H2*        C 184 -12.101  57.090 -30.161
  261   2HO*    C 184          2HO*        C 184 -11.031  55.098 -28.819
  262    H1*    C 184           H1*        C 184 -11.474  54.260 -30.732
  263   1H4     C 184          1H4         C 184 -10.381  58.316 -35.944
  264   2H4     C 184          2H4         C 184  -8.949  57.326 -35.780
  265    H5     C 184           H5         C 184  -8.663  55.694 -34.097
  266    H6     C 184           H6         C 184  -9.690  54.601 -32.136
  267   1H5*    G 185          1H5*        G 185 -14.019  59.226 -25.950
  268   2H5*    G 185          2H5*        G 185 -13.509  60.402 -27.162
  269    H4*    G 185           H4*        G 185 -11.677  58.398 -25.825
  270    H3*    G 185           H3*        G 185 -12.380  61.215 -25.075
  271    H2*    G 185           H2*        G 185 -10.125  61.631 -24.429
  272   2HO*    G 185          2HO*        G 185  -8.951  59.859 -23.896
  273    H1*    G 185           H1*        G 185  -9.077  60.639 -26.817
  274    H8     G 185           H8         G 185 -12.313  62.688 -26.562
  275    H1     G 185           H1         G 185  -7.108  65.930 -28.633
  276   1H2     G 185          1H2         G 185  -5.465  64.684 -28.604
  277   2H2     G 185          2H2         G 185  -5.492  63.011 -28.095
  278   1H5*    G 186          1H5*        G 186 -11.908  59.206 -19.260
  279   2H5*    G 186          2H5*        G 186 -11.025  60.503 -20.066
  280    H4*    G 186           H4*        G 186 -10.554  57.548 -20.523
  281    H3*    G 186           H3*        G 186  -9.334  59.435 -18.557
  282    H2*    G 186           H2*        G 186  -7.154  58.563 -18.957
  283   2HO*    G 186          2HO*        G 186  -7.199  56.755 -20.667
  284    H1*    G 186           H1*        G 186  -7.369  58.827 -21.727
  285    H8     G 186           H8         G 186  -8.959  61.509 -19.541
  286    H1     G 186           H1         G 186  -2.912  62.782 -21.465
  287   1H2     G 186          1H2         G 186  -2.144  61.143 -22.451
  288   2H2     G 186          2H2         G 186  -3.009  59.646 -22.718
  289   1H5*    G 187          1H5*        G 187 -10.152  54.454 -15.372
  290   2H5*    G 187          2H5*        G 187  -9.253  54.726 -16.864
  291    H4*    G 187           H4*        G 187 -12.257  54.816 -16.513
  292    H3*    G 187           H3*        G 187 -10.388  52.772 -17.665
  293    H2*    G 187           H2*        G 187 -11.999  52.204 -19.326
  294   2HO*    G 187          2HO*        G 187 -14.058  53.631 -19.062
  295    H1*    G 187           H1*        G 187 -12.410  54.857 -20.082
  296    H8     G 187           H8         G 187  -8.819  54.630 -19.333
  297    H1     G 187           H1         G 187 -10.316  51.978 -25.044
  298   1H2     G 187          1H2         G 187 -12.362  51.773 -25.193
  299   2H2     G 187          2H2         G 187 -13.503  52.248 -23.954
  300   1H5*    G 188          1H5*        G 188 -14.106  50.969 -18.092
  301   2H5*    G 188          2H5*        G 188 -14.085  49.637 -16.937
  302    H4*    G 188           H4*        G 188 -14.916  48.653 -18.857
  303    H3*    G 188           H3*        G 188 -11.964  48.120 -18.656
  304    H2*    G 188           H2*        G 188 -12.085  46.761 -20.611
  305   2HO*    G 188          2HO*        G 188 -14.060  45.796 -20.349
  306    H1*    G 188           H1*        G 188 -13.474  48.697 -22.071
  307    H8     G 188           H8         G 188 -11.064  50.585 -20.041
  308    H1     G 188           H1         G 188  -8.267  47.668 -25.095
  309   1H2     G 188          1H2         G 188  -9.581  46.311 -25.922
  310   2H2     G 188          2H2         G 188 -11.200  46.008 -25.333
  311   1H5*    A 189          1H5*        A 189 -13.348  43.703 -19.230
  312   2H5*    A 189          2H5*        A 189 -12.224  43.044 -18.044
  313    H4*    A 189           H4*        A 189 -12.012  42.163 -20.398
  314    H3*    A 189           H3*        A 189  -9.667  43.307 -18.896
  315    H2*    A 189           H2*        A 189  -8.236  42.641 -20.669
  316   2HO*    A 189          2HO*        A 189 -10.381  41.585 -22.164
  317    H1*    A 189           H1*        A 189  -9.936  43.682 -22.653
  318    H8     A 189           H8         A 189  -9.736  45.917 -19.653
  319   1H6     A 189          1H6         A 189  -4.772  48.553 -22.366
  320   2H6     A 189          2H6         A 189  -5.898  48.688 -21.034
  321    H2     A 189           H2         A 189  -5.885  44.946 -24.710
  322   1H5*    G 190          1H5*        G 190  -8.710  39.463 -20.373
  323   2H5*    G 190          2H5*        G 190  -8.088  38.434 -19.082
  324    H4*    G 190           H4*        G 190  -6.593  38.164 -20.864
  325    H3*    G 190           H3*        G 190  -5.499  39.997 -18.751
  326    H2*    G 190           H2*        G 190  -3.448  40.166 -19.952
  327   2HO*    G 190          2HO*        G 190  -3.552  38.810 -22.063
  328    H1*    G 190           H1*        G 190  -4.711  40.776 -22.364
  329    H8     G 190           H8         G 190  -6.580  42.381 -19.567
  330    H1     G 190           H1         G 190  -1.372  45.740 -21.436
  331   1H2     G 190          1H2         G 190  -0.237  44.592 -22.720
  332   2H2     G 190          2H2         G 190  -0.637  42.964 -23.217
  333   1H5*    C 191          1H5*        C 191  -2.524  36.904 -19.408
  334   2H5*    C 191          2H5*        C 191  -1.681  36.548 -17.900
  335    H4*    C 191           H4*        C 191  -0.141  37.276 -19.646
  336    H3*    C 191           H3*        C 191  -0.429  39.007 -17.203
  337    H2*    C 191           H2*        C 191   1.308  40.419 -18.000
  338   2HO*    C 191          2HO*        C 191   2.332  39.620 -20.070
  339    H1*    C 191           H1*        C 191   0.196  40.580 -20.584
  340   1H4     C 191          1H4         C 191  -1.779  45.855 -17.556
  341   2H4     C 191          2H4         C 191  -3.133  44.950 -16.919
  342    H5     C 191           H5         C 191  -3.414  42.623 -17.208
  343    H6     C 191           H6         C 191  -2.453  40.571 -18.190
  344   1H5*    G 192          1H5*        G 192   3.953  38.399 -17.540
  345   2H5*    G 192          2H5*        G 192   4.338  37.684 -15.975
  346    H4*    G 192           H4*        G 192   5.886  39.428 -16.309
  347    H3*    G 192           H3*        G 192   3.734  40.131 -14.337
  348    H2*    G 192           H2*        G 192   4.798  42.220 -13.910
  349   2HO*    G 192          2HO*        G 192   6.793  41.891 -15.819
  350    H1*    G 192           H1*        G 192   5.014  42.858 -16.617
  351    H8     G 192           H8         G 192   1.798  41.067 -16.042
  352    H1     G 192           H1         G 192   1.529  47.361 -14.561
  353   1H2     G 192          1H2         G 192   3.432  48.154 -14.575
  354   2H2     G 192          2H2         G 192   4.886  47.248 -14.935
  355   1H5*    G 193          1H5*        G 193   7.713  41.075 -12.477
  356   2H5*    G 193          2H5*        G 193   7.504  40.779 -10.752
  357    H4*    G 193           H4*        G 193   8.262  43.082 -11.337
  358    H3*    G 193           H3*        G 193   5.768  42.620  -9.727
  359    H2*    G 193           H2*        G 193   5.531  44.972  -9.424
  360   2HO*    G 193          2HO*        G 193   7.490  46.027 -10.827
  361    H1*    G 193           H1*        G 193   5.832  45.526 -12.143
  362    H8     G 193           H8         G 193   3.921  42.373 -11.931
  363    H1     G 193           H1         G 193   0.275  47.586 -10.745
  364   1H2     G 193          1H2         G 193   1.489  49.233 -10.491
  365   2H2     G 193          2H2         G 193   3.236  49.205 -10.586
  366   1H5*    A 194          1H5*        A 194   7.959  45.392  -7.330
  367   2H5*    A 194          2H5*        A 194   8.369  44.520  -5.853
  368    H4*    A 194           H4*        A 194   7.569  46.584  -5.117
  369    H3*    A 194           H3*        A 194   5.525  44.420  -4.835
  370    H2*    A 194           H2*        A 194   3.934  45.946  -3.950
  371   2HO*    A 194          2HO*        A 194   5.413  47.157  -2.736
  372    H1*    A 194           H1*        A 194   4.364  47.837  -5.982
  373    H8     A 194           H8         A 194   4.397  44.297  -7.240
  374   1H6     A 194          1H6         A 194  -1.768  44.889  -8.009
  375   2H6     A 194          2H6         A 194  -0.394  43.853  -8.323
  376    H2     A 194           H2         A 194  -0.290  48.467  -5.827
  377   1H5*    C 195          1H5*        C 195   5.802  46.018  -0.656
  378   2H5*    C 195          2H5*        C 195   5.483  44.642   0.400
  379    H4*    C 195           H4*        C 195   3.852  46.502   0.624
  380    H3*    C 195           H3*        C 195   2.909  43.746  -0.141
  381    H2*    C 195           H2*        C 195   0.662  44.489   0.025
  382   2HO*    C 195          2HO*        C 195   1.098  47.103   0.664
  383    H1*    C 195           H1*        C 195   1.187  46.860  -1.425
  384   1H4     C 195          1H4         C 195  -1.360  42.863  -5.706
  385   2H4     C 195          2H4         C 195   0.202  42.101  -5.904
  386    H5     C 195           H5         C 195   2.100  42.634  -4.604
  387    H6     C 195           H6         C 195   2.975  44.043  -2.775
  388   1H5*    G 196          1H5*        G 196   2.353  43.091   4.636
  389   2H5*    G 196          2H5*        G 196   2.671  41.357   4.599
  390    H4*    G 196           H4*        G 196   0.358  42.000   5.294
  391    H3*    G 196           H3*        G 196   0.848  40.127   2.996
  392    H2*    G 196           H2*        G 196  -1.499  39.763   2.799
  393   2HO*    G 196          2HO*        G 196  -2.772  41.033   4.506
  394    H1*    G 196           H1*        G 196  -2.092  42.492   2.800
  395    H8     G 196           H8         G 196   1.079  41.977   0.929
  396    H1     G 196           H1         G 196  -4.195  40.690  -2.594
  397   1H2     G 196          1H2         G 196  -5.850  40.650  -1.365
  398   2H2     G 196          2H2         G 196  -5.815  40.925   0.362
  399   1H5*    A 197          1H5*        A 197   2.507  36.302   6.785
  400   2H5*    A 197          2H5*        A 197   1.684  35.655   5.366
  401    H4*    A 197           H4*        A 197   1.085  35.325   8.210
  402    H3*    A 197           H3*        A 197   0.522  33.790   5.674
  403    H2*    A 197           H2*        A 197  -1.203  32.680   6.722
  404   2HO*    A 197          2HO*        A 197  -0.273  33.350   9.309
  405    H1*    A 197           H1*        A 197  -1.424  34.916   8.696
  406    H8     A 197           H8         A 197  -2.643  34.529   5.082
  407   1H6     A 197          1H6         A 197  -8.375  34.454   7.550
  408   2H6     A 197          2H6         A 197  -7.478  34.426   6.048
  409    H2     A 197           H2         A 197  -5.434  34.656  10.874
  410   1H5*    U 198          1H5*        U 198   4.553  32.537   6.738
  411   2H5*    U 198          2H5*        U 198   5.099  30.861   6.741
  412    H4*    U 198           H4*        U 198   4.552  32.295   9.327
  413    H3*    U 198           H3*        U 198   7.011  32.595   7.601
  414    H2*    U 198           H2*        U 198   8.337  32.509   9.483
  415   2HO*    U 198          2HO*        U 198   7.018  33.144  11.549
  416    H1*    U 198           H1*        U 198   6.143  31.075  10.930
  417    H3     U 198           H3         U 198   8.554  26.920  10.193
  418    H5     U 198           H5         U 198  11.101  30.022  11.390
  419    H6     U 198           H6         U 198   9.255  31.575  10.945
  420   1H5*    G 199          1H5*        G 199   7.137  36.292   5.176
  421   2H5*    G 199          2H5*        G 199   8.752  35.929   5.786
  422    H4*    G 199           H4*        G 199   8.569  38.282   5.302
  423    H3*    G 199           H3*        G 199   8.817  37.546   8.208
  424    H2*    G 199           H2*        G 199   8.966  39.858   8.766
  425   2HO*    G 199          2HO*        G 199  10.049  40.804   7.125
  426    H1*    G 199           H1*        G 199   6.719  40.537   7.244
  427    H8     G 199           H8         G 199   6.992  37.328   9.328
  428    H1     G 199           H1         G 199   3.560  42.112  12.014
  429   1H2     G 199          1H2         G 199   3.631  43.777  10.799
  430   2H2     G 199          2H2         G 199   4.492  43.864   9.279
  431   1H5*    A 200          1H5*        A 200   9.793  37.880  10.526
  432   2H5*    A 200          2H5*        A 200  11.482  38.238  10.887
  433    H4*    A 200           H4*        A 200  10.941  36.569  12.404
  434    H3*    A 200           H3*        A 200  12.469  35.514  10.083
  435    H2*    A 200           H2*        A 200  12.256  33.258  10.804
  436   2HO*    A 200          2HO*        A 200  10.694  33.473  12.957
  437    H1*    A 200           H1*        A 200   9.546  33.291  11.048
  438    H8     A 200           H8         A 200   9.500  35.687   8.445
  439   1H6     A 200          1H6         A 200  11.267  31.343   4.326
  440   2H6     A 200          2H6         A 200  10.597  32.951   4.490
  441    H2     A 200           H2         A 200  11.977  29.754   8.413
  442   1H5*    C 201          1H5*        C 201  16.133  34.459  13.276
  443   2H5*    C 201          2H5*        C 201  16.183  32.939  12.382
  444    H4*    C 201           H4*        C 201  13.799  34.250  13.689
  445    H3*    C 201           H3*        C 201  15.385  31.757  14.233
  446    H2*    C 201           H2*        C 201  13.426  30.693  15.071
  447   2HO*    C 201          2HO*        C 201  11.499  32.443  14.725
  448    H1*    C 201           H1*        C 201  11.893  31.472  12.838
  449   1H4     C 201          1H4         C 201  13.891  25.464  11.777
  450   2H4     C 201          2H4         C 201  15.197  26.137  10.826
  451    H5     C 201           H5         C 201  15.661  28.448  10.676
  452    H6     C 201           H6         C 201  14.980  30.704  11.410
  453   1H5*    C 202          1H5*        C 202  13.013  32.889  17.323
  454   2H5*    C 202          2H5*        C 202  13.605  32.804  18.982
  455    H4*    C 202           H4*        C 202  11.541  31.631  18.888
  456    H3*    C 202           H3*        C 202  13.955  29.865  19.164
  457    H2*    C 202           H2*        C 202  12.560  27.953  19.317
  458   2HO*    C 202          2HO*        C 202  10.823  28.617  20.468
  459    H1*    C 202           H1*        C 202  10.968  28.768  17.120
  460   1H4     C 202          1H4         C 202  15.051  24.430  14.787
  461   2H4     C 202          2H4         C 202  16.218  25.708  14.535
  462    H5     C 202           H5         C 202  15.907  27.935  15.258
  463    H6     C 202           H6         C 202  14.382  29.500  16.410
  464   1H5*    C 203          1H5*        C 203  11.751  28.957  23.122
  465   2H5*    C 203          2H5*        C 203  13.083  28.477  24.174
  466    H4*    C 203           H4*        C 203  11.349  26.720  23.789
  467    H3*    C 203           H3*        C 203  14.248  26.207  23.162
  468    H2*    C 203           H2*        C 203  13.724  23.933  22.704
  469   2HO*    C 203          2HO*        C 203  11.713  23.162  23.424
  470    H1*    C 203           H1*        C 203  11.534  24.603  21.076
  471   1H4     C 203          1H4         C 203  16.429  23.709  17.057
  472   2H4     C 203          2H4         C 203  16.875  25.386  17.273
  473    H5     C 203           H5         C 203  15.834  26.837  18.819
  474    H6     C 203           H6         C 203  14.089  27.037  20.555
  475   1H5*    U 204          1H5*        U 204  12.771  23.365  25.557
  476   2H5*    U 204          2H5*        U 204  13.663  22.899  27.005
  477    H4*    U 204           H4*        U 204  13.162  20.910  25.826
  478    H3*    U 204           H3*        U 204  16.044  21.733  25.615
  479    H2*    U 204           H2*        U 204  16.527  19.735  24.415
  480   2HO*    U 204          2HO*        U 204  14.966  18.090  24.461
  481    H1*    U 204           H1*        U 204  14.419  20.086  22.623
  482    H3     U 204           H3         U 204  18.377  20.917  20.431
  483    H5     U 204           H5         U 204  17.260  24.565  22.159
  484    H6     U 204           H6         U 204  15.515  23.343  23.373
  485   1H5*    A 205          1H5*        A 205  16.507  18.694  29.213
  486   2H5*    A 205          2H5*        A 205  18.091  19.158  29.833
  487    H4*    A 205           H4*        A 205  17.939  17.010  28.474
  488    H3*    A 205           H3*        A 205  19.967  19.174  27.945
  489    H2*    A 205           H2*        A 205  20.997  17.781  26.320
  490   2HO*    A 205          2HO*        A 205  20.524  15.579  26.395
  491    H1*    A 205           H1*        A 205  18.561  17.111  25.095
  492    H8     A 205           H8         A 205  18.350  20.684  25.974
  493   1H6     A 205          1H6         A 205  21.550  21.930  20.762
  494   2H6     A 205          2H6         A 205  20.612  22.644  22.055
  495    H2     A 205           H2         A 205  21.704  17.547  21.474
  496   1H5*    G 206          1H5*        G 206  22.964  18.133  26.408
  497   2H5*    G 206          2H5*        G 206  24.116  17.967  27.732
  498    H4*    G 206           H4*        G 206  23.199  20.535  26.424
  499    H3*    G 206           H3*        G 206  25.663  18.876  26.166
  500    H2*    G 206           H2*        G 206  27.063  20.804  26.107
  501   2HO*    G 206          2HO*        G 206  25.415  22.822  26.518
  502    H1*    G 206           H1*        G 206  25.946  21.901  28.415
  503    H8     G 206           H8         G 206  26.131  18.177  28.708
  504    H1     G 206           H1         G 206  31.665  21.177  30.210
  505   1H2     G 206          1H2         G 206  31.534  23.166  29.686
  506   2H2     G 206          2H2         G 206  30.133  23.912  28.949
  507   1H5*    U 207          1H5*        U 207  24.480  20.474  21.301
  508   2H5*    U 207          2H5*        U 207  26.104  20.697  20.650
  509    H4*    U 207           H4*        U 207  24.401  22.538  20.223
  510    H3*    U 207           H3*        U 207  27.162  23.039  21.307
  511    H2*    U 207           H2*        U 207  26.773  25.379  21.192
  512   2HO*    U 207          2HO*        U 207  24.521  25.875  20.229
  513    H1*    U 207           H1*        U 207  24.271  25.217  22.434
  514    H3     U 207           H3         U 207  26.574  27.032  25.838
  515    H5     U 207           H5         U 207  28.298  23.233  25.463
  516    H6     U 207           H6         U 207  26.891  22.898  23.483
  517   1H5*    A 208          1H5*        A 208  29.250  25.126  16.827
  518   2H5*    A 208          2H5*        A 208  28.047  25.016  15.543
  519    H4*    A 208           H4*        A 208  30.045  23.932  14.811
  520    H3*    A 208           H3*        A 208  27.697  22.166  15.344
  521    H2*    A 208           H2*        A 208  28.931  20.215  14.779
  522   2HO*    A 208          2HO*        A 208  30.047  21.443  13.103
  523    H1*    A 208           H1*        A 208  31.098  20.891  16.416
  524    H8     A 208           H8         A 208  27.446  21.499  17.407
  525   1H6     A 208          1H6         A 208  28.065  16.376  20.919
  526   2H6     A 208          2H6         A 208  26.972  17.670  20.478
  527    H2     A 208           H2         A 208  31.845  16.981  18.664
  528   1H5*    G 209          1H5*        G 209  27.805  21.308  11.713
  529   2H5*    G 209          2H5*        G 209  26.270  21.006  10.898
  530    H4*    G 209           H4*        G 209  27.170  19.041  12.107
  531    H3*    G 209           H3*        G 209  24.461  20.143  12.794
  532    H2*    G 209           H2*        G 209  24.113  18.343  14.316
  533   2HO*    G 209          2HO*        G 209  26.728  17.389  13.683
  534    H1*    G 209           H1*        G 209  26.581  18.718  15.577
  535    H8     G 209           H8         G 209  25.150  22.038  14.685
  536    H1     G 209           H1         G 209  22.696  19.574  20.144
  537   1H2     G 209          1H2         G 209  23.283  17.607  20.336
  538   2H2     G 209          2H2         G 209  24.290  16.752  19.190
  539   1H5*    A 210          1H5*        A 210  24.113  15.828  12.913
  540   2H5*    A 210          2H5*        A 210  22.753  15.497  11.840
  541    H4*    A 210           H4*        A 210  22.370  14.404  13.934
  542    H3*    A 210           H3*        A 210  20.589  16.773  13.403
  543    H2*    A 210           H2*        A 210  19.360  16.265  15.372
  544   2HO*    A 210          2HO*        A 210  20.149  14.197  16.465
  545    H1*    A 210           H1*        A 210  21.670  15.936  16.935
  546    H8     A 210           H8         A 210  21.999  18.785  14.521
  547   1H6     A 210          1H6         A 210  19.405  22.369  18.922
  548   2H6     A 210          2H6         A 210  20.204  22.390  17.366
  549    H2     A 210           H2         A 210  19.115  18.133  20.231
  550   1H5*    G 211          1H5*        G 211  17.668  13.137  14.207
  551   2H5*    G 211          2H5*        G 211  16.405  13.597  13.064
  552    H4*    G 211           H4*        G 211  15.634  13.223  15.413
  553    H3*    G 211           H3*        G 211  15.101  15.802  13.966
  554    H2*    G 211           H2*        G 211  13.795  16.563  15.807
  555   2HO*    G 211          2HO*        G 211  12.963  14.422  16.179
  556    H1*    G 211           H1*        G 211  15.762  15.936  17.684
  557    H8     G 211           H8         G 211  17.606  17.155  14.748
  558    H1     G 211           H1         G 211  14.867  21.962  18.104
  559   1H2     G 211          1H2         G 211  13.528  21.177  19.464
  560   2H2     G 211          2H2         G 211  13.197  19.471  19.663
  561   1H5*    G 212          1H5*        G 212  10.515  14.362  14.965
  562   2H5*    G 212          2H5*        G 212   9.976  14.877  13.367
  563    H4*    G 212           H4*        G 212   8.681  15.835  15.272
  564    H3*    G 212           H3*        G 212  10.014  17.603  13.240
  565    H2*    G 212           H2*        G 212   9.028  19.516  14.264
  566   2HO*    G 212          2HO*        G 212   7.201  19.134  15.408
  567    H1*    G 212           H1*        G 212   9.860  18.782  16.826
  568    H8     G 212           H8         G 212  12.554  17.835  14.464
  569    H1     G 212           H1         G 212  12.580  24.139  15.930
  570   1H2     G 212          1H2         G 212  10.840  24.621  16.926
  571   2H2     G 212          2H2         G 212   9.564  23.487  17.307
  572   1H5*    G 213          1H5*        G 213   5.541  18.467  12.901
  573   2H5*    G 213          2H5*        G 213   5.285  19.073  11.264
  574    H4*    G 213           H4*        G 213   4.619  20.649  13.075
  575    H3*    G 213           H3*        G 213   6.615  21.445  10.975
  576    H2*    G 213           H2*        G 213   6.667  23.655  11.863
  577   2HO*    G 213          2HO*        G 213   5.059  24.190  13.427
  578    H1*    G 213           H1*        G 213   7.076  22.782  14.480
  579    H8     G 213           H8         G 213   9.003  20.446  12.398
  580    H1     G 213           H1         G 213  11.941  26.178  13.027
  581   1H2     G 213          1H2         G 213  10.623  27.541  13.838
  582   2H2     G 213          2H2         G 213   8.969  27.186  14.281
  583   1H5*    G 214          1H5*        G 214   5.987  25.328  10.289
  584   2H5*    G 214          2H5*        G 214   5.070  25.096   8.801
  585    H4*    G 214           H4*        G 214   7.022  26.306   8.233
  586    H3*    G 214           H3*        G 214   7.095  23.431   7.366
  587    H2*    G 214           H2*        G 214   9.180  23.812   6.275
  588   2HO*    G 214          2HO*        G 214   9.298  26.483   7.160
  589    H1*    G 214           H1*        G 214  10.325  25.031   8.504
  590    H8     G 214           H8         G 214   8.224  22.375   9.912
  591    H1     G 214           H1         G 214  13.666  20.054   7.287
  592   1H2     G 214          1H2         G 214  14.568  21.526   6.159
  593   2H2     G 214          2H2         G 214  13.944  23.146   5.955
  594   1H5*    G 215          1H5*        G 215   8.393  25.411   3.603
  595   2H5*    G 215          2H5*        G 215   6.913  25.137   2.684
  596    H4*    G 215           H4*        G 215   8.618  24.544   1.216
  597    H3*    G 215           H3*        G 215   7.379  22.123   2.477
  598    H2*    G 215           H2*        G 215   8.800  20.698   1.200
  599   2HO*    G 215          2HO*        G 215   8.826  21.907  -0.692
  600    H1*    G 215           H1*        G 215  11.122  22.025   1.920
  601    H8     G 215           H8         G 215   8.934  22.242   4.884
  602    H1     G 215           H1         G 215  11.703  16.427   4.249
  603   1H2     G 215          1H2         G 215  12.566  16.276   2.382
  604   2H2     G 215          2H2         G 215  12.543  17.536   1.171
  605   1H5*    C 216          1H5*        C 216   5.523  21.846  -1.598
  606   2H5*    C 216          2H5*        C 216   4.058  20.878  -1.436
  607    H4*    C 216           H4*        C 216   6.107  19.697  -2.331
  608    H3*    C 216           H3*        C 216   4.556  18.630   0.029
  609    H2*    C 216           H2*        C 216   5.863  16.655  -0.071
  610   2HO*    C 216          2HO*        C 216   6.871  16.196  -2.012
  611    H1*    C 216           H1*        C 216   8.272  18.126  -0.426
  612   1H4     C 216          1H4         C 216   8.092  16.313   5.721
  613   2H4     C 216          2H4         C 216   7.302  17.829   6.091
  614    H5     C 216           H5         C 216   6.578  19.370   4.455
  615    H6     C 216           H6         C 216   6.434  19.841   2.035
  616   1H5*    U 217          1H5*        U 217   4.588  15.791  -2.965
  617   2H5*    U 217          2H5*        U 217   3.075  14.930  -3.243
  618    H4*    U 217           H4*        U 217   4.769  13.310  -2.856
  619    H3*    U 217           H3*        U 217   2.849  13.632  -0.562
  620    H2*    U 217           H2*        U 217   3.889  11.792   0.538
  621   2HO*    U 217          2HO*        U 217   5.647  10.742  -0.773
  622    H1*    U 217           H1*        U 217   6.467  12.820   0.155
  623    H3     U 217           H3         U 217   5.756  13.319   4.612
  624    H5     U 217           H5         U 217   3.557  16.429   2.872
  625    H6     U 217           H6         U 217   4.061  15.432   0.689
  626   1H5*    G 218          1H5*        G 218   0.616   9.343  -2.468
  627   2H5*    G 218          2H5*        G 218   0.216   8.718  -0.869
  628    H4*    G 218           H4*        G 218   1.714   7.124  -1.249
  629    H3*    G 218           H3*        G 218   3.565   9.451  -0.805
  630    H2*    G 218           H2*        G 218   5.419   8.117  -1.377
  631   2HO*    G 218          2HO*        G 218   4.835   6.270  -0.260
  632    H1*    G 218           H1*        G 218   3.955   6.859  -3.525
  633    H8     G 218           H8         G 218   3.902  10.592  -3.581
  634    H1     G 218           H1         G 218   9.120   8.040  -6.436
  635   1H2     G 218          1H2         G 218   9.204   6.019  -6.036
  636   2H2     G 218          2H2         G 218   8.036   5.146  -5.071
  637   1H5*    C 219          1H5*        C 219   4.531   6.495   2.001
  638   2H5*    C 219          2H5*        C 219   3.960   5.080   2.885
  639    H4*    C 219           H4*        C 219   4.891   6.235   4.603
  640    H3*    C 219           H3*        C 219   2.032   7.103   4.432
  641    H2*    C 219           H2*        C 219   2.329   8.717   6.116
  642   2HO*    C 219          2HO*        C 219   3.567   7.671   7.594
  643    H1*    C 219           H1*        C 219   4.801   9.649   5.150
  644   1H4     C 219          1H4         C 219   0.091  13.498   2.998
  645   2H4     C 219          2H4         C 219   0.414  12.815   1.420
  646    H5     C 219           H5         C 219   1.862  10.988   1.048
  647    H6     C 219           H6         C 219   3.374   9.349   2.111
  648   1H5*    G 220          1H5*        G 220   4.949   3.130   6.404
  649   2H5*    G 220          2H5*        G 220   4.959   4.883   6.213
  650    H4*    G 220           H4*        G 220   6.697   2.869   5.050
  651    H3*    G 220           H3*        G 220   6.802   5.874   5.382
  652    H2*    G 220           H2*        G 220   8.633   5.924   3.943
  653   2HO*    G 220          2HO*        G 220   9.189   3.268   3.722
  654    H1*    G 220           H1*        G 220   7.573   3.566   2.514
  655    H8     G 220           H8         G 220   7.415   4.279   0.104
  656    H1     G 220           H1         G 220   6.911  10.541   1.656
  657   1H2     G 220          1H2         G 220   6.815  10.737   3.707
  658   2H2     G 220          2H2         G 220   6.866   9.403   4.838
  659   1H5*    G 221          1H5*        G 221  10.175   4.968   6.561
  660   2H5*    G 221          2H5*        G 221  11.149   6.116   7.480
  661    H4*    G 221           H4*        G 221  10.790   6.134   4.767
  662    H3*    G 221           H3*        G 221  11.648   8.314   6.672
  663    H2*    G 221           H2*        G 221  11.920   9.755   4.809
  664   2HO*    G 221          2HO*        G 221  11.208   7.547   3.133
  665    H1*    G 221           H1*        G 221   9.464   8.942   3.647
  666    H8     G 221           H8         G 221   9.166   9.500   7.329
  667    H1     G 221           H1         G 221   8.632  14.925   3.841
  668   1H2     G 221          1H2         G 221   9.154  14.540   1.884
  669   2H2     G 221          2H2         G 221   9.661  12.979   1.278
  670   1H5*    C 222          1H5*        C 222  15.001   7.976   3.644
  671   2H5*    C 222          2H5*        C 222  16.320   8.961   4.277
  672    H4*    C 222           H4*        C 222  15.081   9.730   2.148
  673    H3*    C 222           H3*        C 222  15.764  11.526   4.474
  674    H2*    C 222           H2*        C 222  15.012  13.379   3.207
  675   2HO*    C 222          2HO*        C 222  14.295  12.480   0.885
  676    H1*    C 222           H1*        C 222  12.702  12.003   2.295
  677   1H4     C 222          1H4         C 222  10.813  15.834   7.077
  678   2H4     C 222          2H4         C 222  11.070  14.499   8.178
  679    H5     C 222           H5         C 222  12.052  12.445   7.551
  680    H6     C 222           H6         C 222  13.039  11.153   5.691
  681   1H5*    U 223          1H5*        U 223  16.352  14.184   1.633
  682   2H5*    U 223          2H5*        U 223  18.055  14.628   1.749
  683    H4*    U 223           H4*        U 223  16.763  16.617   1.933
  684    H3*    U 223           H3*        U 223  18.032  15.723   4.508
  685    H2*    U 223           H2*        U 223  17.161  17.586   5.628
  686   2HO*    U 223          2HO*        U 223  17.427  19.308   4.333
  687    H1*    U 223           H1*        U 223  14.709  17.471   4.054
  688    H3     U 223           H3         U 223  13.317  17.656   8.403
  689    H5     U 223           H5         U 223  14.677  13.731   7.879
  690    H6     U 223           H6         U 223  15.539  14.426   5.691
  691   1H5*    U 224          1H5*        U 224  21.028  16.945  -0.169
  692   2H5*    U 224          2H5*        U 224  20.091  18.076   0.808
  693    H4*    U 224           H4*        U 224  19.294  16.504  -1.592
  694    H3*    U 224           H3*        U 224  19.018  19.331  -0.642
  695    H2*    U 224           H2*        U 224  17.028  19.614  -1.910
  696   2HO*    U 224          2HO*        U 224  17.637  18.416  -3.708
  697    H1*    U 224           H1*        U 224  15.948  17.164  -0.970
  698    H3     U 224           H3         U 224  13.074  19.505   1.505
  699    H5     U 224           H5         U 224  16.714  21.374   2.395
  700    H6     U 224           H6         U 224  17.783  19.813   0.836
  701   1H5*    A 225          1H5*        A 225  20.272  20.450  -5.072
  702   2H5*    A 225          2H5*        A 225  20.056  22.195  -4.943
  703    H4*    A 225           H4*        A 225  18.208  20.562  -5.968
  704    H3*    A 225           H3*        A 225  17.829  23.141  -4.454
  705    H2*    A 225           H2*        A 225  15.492  22.970  -4.818
  706   2HO*    A 225          2HO*        A 225  15.515  20.580  -6.191
  707    H1*    A 225           H1*        A 225  15.393  20.260  -4.085
  708    H8     A 225           H8         A 225  17.729  22.133  -1.858
  709   1H6     A 225          1H6         A 225  12.758  23.573   1.631
  710   2H6     A 225          2H6         A 225  14.506  23.624   1.564
  711    H2     A 225           H2         A 225  11.320  21.694  -2.130
  712   1H5*    G 226          1H5*        G 226  16.148  23.101  -8.376
  713   2H5*    G 226          2H5*        G 226  15.749  24.631  -9.157
  714    H4*    G 226           H4*        G 226  13.788  23.181  -8.799
  715    H3*    G 226           H3*        G 226  13.878  25.896  -7.515
  716    H2*    G 226           H2*        G 226  11.643  25.597  -6.744
  717   2HO*    G 226          2HO*        G 226  11.294  23.017  -7.624
  718    H1*    G 226           H1*        G 226  12.179  23.073  -5.668
  719    H8     G 226           H8         G 226  15.195  25.055  -4.987
  720    H1     G 226           H1         G 226  10.313  26.571  -1.019
  721   1H2     G 226          1H2         G 226   8.565  25.738  -1.728
  722   2H2     G 226          2H2         G 226   8.441  24.773  -3.181
  723   1H5*    G 227          1H5*        G 227  12.359  25.692 -12.454
  724   2H5*    G 227          2H5*        G 227  13.542  26.899 -12.958
  725    H4*    G 227           H4*        G 227  11.485  27.280 -14.128
  726    H3*    G 227           H3*        G 227  12.207  29.344 -12.068
  727    H2*    G 227           H2*        G 227  10.324  30.652 -12.717
  728   2HO*    G 227          2HO*        G 227   9.121  29.136 -14.536
  729    H1*    G 227           H1*        G 227   8.555  28.501 -12.548
  730    H8     G 227           H8         G 227  11.103  28.229  -9.838
  731    H1     G 227           H1         G 227   6.251  32.267  -8.413
  732   1H2     G 227          1H2         G 227   5.114  32.601 -10.100
  733   2H2     G 227          2H2         G 227   5.430  31.893 -11.669
  734   1H5*    A 228          1H5*        A 228  11.902  31.564 -15.921
  735   2H5*    A 228          2H5*        A 228  13.128  32.831 -15.895
  736    H4*    A 228           H4*        A 228  10.889  33.736 -16.261
  737    H3*    A 228           H3*        A 228  12.387  34.534 -13.791
  738    H2*    A 228           H2*        A 228  10.623  35.987 -13.147
  739   2HO*    A 228          2HO*        A 228   8.768  35.796 -14.931
  740    H1*    A 228           H1*        A 228   8.635  34.058 -13.568
  741    H8     A 228           H8         A 228  11.473  32.242 -12.098
  742   1H6     A 228          1H6         A 228   9.607  34.267  -6.497
  743   2H6     A 228          2H6         A 228  10.680  33.154  -7.317
  744    H2     A 228           H2         A 228   7.353  36.503  -9.605
  745   1H5*    G 229          1H5*        G 229  11.663  38.730 -15.715
  746   2H5*    G 229          2H5*        G 229  13.297  39.363 -15.509
  747    H4*    G 229           H4*        G 229  11.655  40.872 -14.553
  748    H3*    G 229           H3*        G 229  13.594  39.550 -12.685
  749    H2*    G 229           H2*        G 229  12.701  40.787 -10.854
  750   2HO*    G 229          2HO*        G 229  10.804  42.250 -11.654
  751    H1*    G 229           H1*        G 229  10.064  40.102 -11.455
  752    H8     G 229           H8         G 229  12.025  37.091 -12.226
  753    H1     G 229           H1         G 229  11.165  37.904  -5.864
  754   1H2     G 229          1H2         G 229  10.436  39.800  -5.504
  755   2H2     G 229          2H2         G 229  10.108  40.991  -6.742
  756   1H5*    G 230          1H5*        G 230  13.503  43.742 -12.310
  757   2H5*    G 230          2H5*        G 230  15.032  44.556 -11.981
  758    H4*    G 230           H4*        G 230  13.351  45.176 -10.346
  759    H3*    G 230           H3*        G 230  15.738  43.634  -9.383
  760    H2*    G 230           H2*        G 230  14.967  43.809  -7.135
  761   2HO*    G 230          2HO*        G 230  13.584  45.465  -6.721
  762    H1*    G 230           H1*        G 230  12.402  42.907  -7.763
  763    H8     G 230           H8         G 230  14.651  40.937  -9.901
  764    H1     G 230           H1         G 230  14.686  38.901  -3.759
  765   1H2     G 230          1H2         G 230  13.744  40.295  -2.565
  766   2H2     G 230          2H2         G 230  13.049  41.792  -3.144
  767   1H5*    G 231          1H5*        G 231  15.567  47.268  -6.686
  768   2H5*    G 231          2H5*        G 231  17.237  47.831  -6.733
  769    H4*    G 231           H4*        G 231  16.500  47.620  -4.447
  770    H3*    G 231           H3*        G 231  18.616  45.690  -5.355
  771    H2*    G 231           H2*        G 231  18.793  44.839  -3.137
  772   2HO*    G 231          2HO*        G 231  17.264  46.010  -1.577
  773    H1*    G 231           H1*        G 231  16.037  44.481  -2.872
  774    H8     G 231           H8         G 231  16.902  43.650  -6.373
  775    H1     G 231           H1         G 231  18.327  38.884  -2.233
  776   1H2     G 231          1H2         G 231  18.177  39.584  -0.299
  777   2H2     G 231          2H2         G 231  17.732  41.219   0.136
  778   1H5*    C 232          1H5*        C 232  19.916  47.356  -1.880
  779   2H5*    C 232          2H5*        C 232  21.538  48.042  -1.953
  780    H4*    C 232           H4*        C 232  21.547  46.614  -0.095
  781    H3*    C 232           H3*        C 232  22.921  45.395  -2.467
  782    H2*    C 232           H2*        C 232  23.481  43.476  -1.187
  783   2HO*    C 232          2HO*        C 232  22.157  44.642   1.055
  784    H1*    C 232           H1*        C 232  20.871  43.208  -0.160
  785   1H4     C 232          1H4         C 232  21.048  39.146  -5.079
  786   2H4     C 232          2H4         C 232  20.806  40.481  -6.182
  787    H5     C 232           H5         C 232  20.746  42.746  -5.515
  788    H6     C 232           H6         C 232  20.907  44.302  -3.604
  789   1H5*    A 233          1H5*        A 233  25.693  45.165   0.880
  790   2H5*    A 233          2H5*        A 233  27.332  45.478   0.308
  791    H4*    A 233           H4*        A 233  27.241  43.351   1.443
  792    H3*    A 233           H3*        A 233  27.763  43.282  -1.514
  793    H2*    A 233           H2*        A 233  28.046  40.924  -1.424
  794   2HO*    A 233          2HO*        A 233  29.129  40.873   0.558
  795    H1*    A 233           H1*        A 233  25.703  40.548   0.096
  796    H8     A 233           H8         A 233  25.150  43.129  -2.534
  797   1H6     A 233          1H6         A 233  23.784  38.445  -6.425
  798   2H6     A 233          2H6         A 233  23.766  40.185  -6.239
  799    H2     A 233           H2         A 233  25.440  36.709  -2.685
  800   1H5*    G 234          1H5*        G 234  31.211  41.109   0.357
  801   2H5*    G 234          2H5*        G 234  32.635  41.805  -0.416
  802    H4*    G 234           H4*        G 234  32.783  39.429  -0.563
  803    H3*    G 234           H3*        G 234  32.219  40.829  -3.159
  804    H2*    G 234           H2*        G 234  32.355  38.751  -4.318
  805   2HO*    G 234          2HO*        G 234  33.434  37.116  -3.295
  806    H1*    G 234           H1*        G 234  30.604  37.465  -2.567
  807    H8     G 234           H8         G 234  29.413  40.952  -2.995
  808    H1     G 234           H1         G 234  27.755  37.090  -7.915
  809   1H2     G 234          1H2         G 234  28.776  35.305  -7.764
  810   2H2     G 234          2H2         G 234  29.912  34.913  -6.493
  811   1H    GLY  15          1H        GLY  15   8.887  -3.722   0.654
  812   1HA   GLY  15          1HA       GLY  15  10.354  -3.313  -1.122
  813   2HA   GLY  15          2HA       GLY  15   8.937  -2.419  -1.651
  814    H    ARG  16           H        ARG  16   8.836  -0.168  -0.382
  815    HA   ARG  16           HA       ARG  16   9.704   1.925  -0.196
  816   1HB   ARG  16          2HB       ARG  16  11.323   0.434   1.316
  817   2HB   ARG  16          3HB       ARG  16  12.490   0.926   0.096
  818   1HG   ARG  16          2HG       ARG  16  12.756   2.849   1.150
  819   2HG   ARG  16          3HG       ARG  16  11.059   3.236   0.858
  820   1HD   ARG  16          2HD       ARG  16  11.244   3.375   3.169
  821   2HD   ARG  16          3HD       ARG  16  10.597   1.755   2.914
  822    HE   ARG  16           HE       ARG  16  13.361   1.527   2.979
  823   1HH1  ARG  16          2HH1      ARG  16  10.790   2.490   5.118
  824   2HH1  ARG  16          1HH1      ARG  16  11.624   1.996   6.555
  825   1HH2  ARG  16          2HH2      ARG  16  14.469   0.873   4.862
  826   2HH2  ARG  16          1HH2      ARG  16  13.718   1.077   6.407
  827    H    ALA  17           H        ALA  17   9.515   2.859  -2.149
  828    HA   ALA  17           HA       ALA  17  11.409   2.181  -4.268
  829   1HB   ALA  17          1HB       ALA  17   9.304   2.224  -5.194
  830   2HB   ALA  17          2HB       ALA  17   8.771   3.570  -4.187
  831   3HB   ALA  17          3HB       ALA  17   9.864   3.860  -5.540
  832    H    ARG  18           H        ARG  18  12.037   3.821  -1.811
  833    HA   ARG  18           HA       ARG  18  12.313   6.514  -2.323
  834   1HB   ARG  18          2HB       ARG  18  13.526   4.577  -0.533
  835   2HB   ARG  18          3HB       ARG  18  14.676   5.817  -1.014
  836   1HG   ARG  18          2HG       ARG  18  11.961   6.620  -0.083
  837   2HG   ARG  18          3HG       ARG  18  13.186   6.145   1.095
  838   1HD   ARG  18          2HD       ARG  18  14.100   8.162   0.956
  839   2HD   ARG  18          3HD       ARG  18  14.404   7.907  -0.762
  840    HE   ARG  18           HE       ARG  18  11.716   8.742  -0.142
  841   1HH1  ARG  18          2HH1      ARG  18  14.958   9.772  -0.885
  842   2HH1  ARG  18          1HH1      ARG  18  14.468  11.325  -1.478
  843   1HH2  ARG  18          2HH2      ARG  18  11.058  10.783  -0.919
  844   2HH2  ARG  18          1HH2      ARG  18  12.249  11.900  -1.495
  845    H    GLY  19           H        GLY  19  13.623   7.772  -3.535
  846   1HA   GLY  19          1HA       GLY  19  15.622   8.278  -4.712
  847   2HA   GLY  19          2HA       GLY  19  15.947   6.556  -4.844
  848    H    LEU  20           H        LEU  20  13.042   6.191  -5.665
  849    HA   LEU  20           HA       LEU  20  13.445   6.932  -8.483
  850   1HB   LEU  20          2HB       LEU  20  12.447   4.541  -7.134
  851   2HB   LEU  20          3HB       LEU  20  11.420   5.082  -8.461
  852    HG   LEU  20           HG       LEU  20  14.209   5.024  -9.237
  853   1HD1  LEU  20          1HD1      LEU  20  14.222   3.230  -7.493
  854   2HD1  LEU  20          2HD1      LEU  20  14.616   2.680  -9.121
  855   3HD1  LEU  20          3HD1      LEU  20  13.014   2.374  -8.451
  856   1HD2  LEU  20          1HD2      LEU  20  11.583   3.989 -10.196
  857   2HD2  LEU  20          2HD2      LEU  20  13.067   3.337 -10.891
  858   3HD2  LEU  20          3HD2      LEU  20  12.732   5.067 -10.992
  859    H    CYS  21           H        CYS  21  12.135   8.490  -9.371
  860    HA   CYS  21           HA       CYS  21  10.052   9.563  -7.790
  861   1HB   CYS  21          2HB       CYS  21  11.472  10.891  -9.365
  862   2HB   CYS  21          3HB       CYS  21  10.677  10.100 -10.711
  863    H    TYR  22           H        TYR  22   7.825   9.501  -8.272
  864    HA   TYR  22           HA       TYR  22   6.968   7.198  -9.900
  865   1HB   TYR  22          2HB       TYR  22   6.337   6.616  -7.745
  866   2HB   TYR  22          3HB       TYR  22   5.997   8.280  -7.282
  867    HD1  TYR  22           HD1      TYR  22   4.754   5.759  -9.755
  868    HD2  TYR  22           HD2      TYR  22   3.784   8.831  -6.976
  869    HE1  TYR  22           HE1      TYR  22   2.361   5.382 -10.184
  870    HE2  TYR  22           HE2      TYR  22   1.388   8.462  -7.396
  871    HH   TYR  22           HH       TYR  22   0.211   6.803  -9.989
  872    H    THR  23           H        THR  23   6.636  10.578  -9.322
  873    HA   THR  23           HA       THR  23   4.130  11.008 -10.564
  874    HB   THR  23           HB       THR  23   6.435  12.958 -10.386
  875    HG1  THR  23           HG1      THR  23   4.278  12.611  -8.557
  876   1HG2  THR  23          1HG2      THR  23   4.830  14.673 -10.658
  877   2HG2  THR  23          2HG2      THR  23   3.484  13.553 -10.442
  878   3HG2  THR  23          3HG2      THR  23   4.465  13.481 -11.906
  879    H    CYS  24           H        CYS  24   7.526  11.074 -11.827
  880    HA   CYS  24           HA       CYS  24   6.334  11.269 -14.497
  881   1HB   CYS  24          2HB       CYS  24   8.443  12.194 -15.270
  882   2HB   CYS  24          3HB       CYS  24   7.826  13.146 -13.934
  883    H    GLY  25           H        GLY  25   8.565   9.628 -12.333
  884   1HA   GLY  25          1HA       GLY  25   8.888   7.264 -12.389
  885   2HA   GLY  25          2HA       GLY  25   8.546   7.290 -14.113
  886    H    SER  26           H        SER  26  10.740   9.477 -12.444
  887    HA   SER  26           HA       SER  26  12.932   8.377 -14.067
  888   1HB   SER  26          2HB       SER  26  12.402  11.113 -12.932
  889   2HB   SER  26          3HB       SER  26  14.028  10.635 -13.416
  890    HG   SER  26           HG       SER  26  13.364  10.441 -15.492
  891    HA   PRO  27           HA       PRO  27  14.450   6.753 -10.186
  892   1HB   PRO  27          2HB       PRO  27  16.593   5.485 -11.268
  893   2HB   PRO  27          3HB       PRO  27  14.950   4.837 -11.351
  894   1HG   PRO  27          2HG       PRO  27  16.498   6.344 -13.423
  895   2HG   PRO  27          3HG       PRO  27  15.471   4.912 -13.616
  896   1HD   PRO  27          2HD       PRO  27  14.619   7.408 -14.228
  897   2HD   PRO  27          3HD       PRO  27  13.526   6.150 -13.615
  898    H    GLY  28           H        GLY  28  15.107   8.675  -9.188
  899   1HA   GLY  28          1HA       GLY  28  17.774   9.077  -8.699
  900   2HA   GLY  28          2HA       GLY  28  17.420  10.126 -10.064
  901    H    HIS  29           H        HIS  29  14.626  10.506  -9.046
  902    HA   HIS  29           HA       HIS  29  15.121  12.080  -6.629
  903   1HB   HIS  29          2HB       HIS  29  14.058  14.059  -7.557
  904   2HB   HIS  29          3HB       HIS  29  15.432  13.602  -8.561
  905    HD1  HIS  29           HD1      HIS  29  14.979  13.157 -10.989
  906    HD2  HIS  29           HD2      HIS  29  11.498  13.424  -8.738
  907    HE1  HIS  29           HE1      HIS  29  13.097  13.162 -12.658
  908    H    TYR  30           H        TYR  30  12.785  13.262  -6.202
  909    HA   TYR  30           HA       TYR  30  10.742  11.158  -6.447
  910   1HB   TYR  30          2HB       TYR  30  12.009  12.091  -4.050
  911   2HB   TYR  30          3HB       TYR  30  10.305  12.532  -4.008
  912    HD1  TYR  30           HD1      TYR  30  12.369   9.565  -4.990
  913    HD2  TYR  30           HD2      TYR  30   8.908  11.018  -2.988
  914    HE1  TYR  30           HE1      TYR  30  11.800   7.268  -4.322
  915    HE2  TYR  30           HE2      TYR  30   8.328   8.724  -2.314
  916    HH   TYR  30           HH       TYR  30   9.127   6.599  -2.137
  917    H    GLN  31           H        GLN  31   8.553  12.160  -5.553
  918    HA   GLN  31           HA       GLN  31   7.654  14.002  -7.396
  919   1HB   GLN  31          2HB       GLN  31   6.092  12.660  -6.164
  920   2HB   GLN  31          3HB       GLN  31   6.604  13.370  -4.638
  921   1HG   GLN  31          2HG       GLN  31   5.173  15.049  -4.841
  922   2HG   GLN  31          3HG       GLN  31   5.705  15.394  -6.486
  923   1HE2  GLN  31          1HE2      GLN  31   4.017  12.700  -4.903
  924   2HE2  GLN  31          2HE2      GLN  31   2.695  12.651  -6.016
  925    H    ALA  32           H        ALA  32   8.831  14.590  -4.107
  926    HA   ALA  32           HA       ALA  32   8.290  17.325  -3.963
  927   1HB   ALA  32          1HB       ALA  32  10.442  17.210  -2.417
  928   2HB   ALA  32          2HB       ALA  32   8.895  16.521  -1.922
  929   3HB   ALA  32          3HB       ALA  32  10.155  15.477  -2.582
  930    H    GLN  33           H        GLN  33  10.730  15.598  -5.700
  931    HA   GLN  33           HA       GLN  33  11.935  18.162  -6.509
  932   1HB   GLN  33          2HB       GLN  33  13.271  15.482  -6.123
  933   2HB   GLN  33          3HB       GLN  33  14.038  16.844  -6.931
  934   1HG   GLN  33          2HG       GLN  33  14.853  17.263  -4.888
  935   2HG   GLN  33          3HG       GLN  33  13.281  18.021  -4.634
  936   1HE2  GLN  33          1HE2      GLN  33  14.456  17.325  -2.423
  937   2HE2  GLN  33          2HE2      GLN  33  13.804  15.874  -1.749
  938    H    CYS  34           H        CYS  34   9.626  16.608  -7.715
  939    HA   CYS  34           HA       CYS  34  10.757  15.473 -10.088
  940   1HB   CYS  34          2HB       CYS  34   8.670  14.607  -8.999
  941   2HB   CYS  34          3HB       CYS  34   7.849  16.082  -9.467
  942    HA   PRO  35           HA       PRO  35  11.047  19.458 -12.080
  943   1HB   PRO  35          2HB       PRO  35  11.712  18.502 -14.533
  944   2HB   PRO  35          3HB       PRO  35  12.855  18.572 -13.186
  945   1HG   PRO  35          2HG       PRO  35  11.262  16.249 -14.201
  946   2HG   PRO  35          3HG       PRO  35  12.960  16.303 -13.690
  947   1HD   PRO  35          2HD       PRO  35  10.988  15.359 -12.093
  948   2HD   PRO  35          3HD       PRO  35  12.421  16.188 -11.452
  949    H    LYS  36           H        LYS  36   8.818  16.962 -12.767
  950    HA   LYS  36           HA       LYS  36   7.422  18.557 -14.790
  951   1HB   LYS  36          2HB       LYS  36   7.863  15.835 -14.572
  952   2HB   LYS  36          3HB       LYS  36   6.195  16.013 -14.042
  953   1HG   LYS  36          2HG       LYS  36   5.765  17.304 -16.149
  954   2HG   LYS  36          3HG       LYS  36   7.381  16.830 -16.681
  955   1HD   LYS  36          2HD       LYS  36   6.740  14.465 -16.439
  956   2HD   LYS  36          3HD       LYS  36   5.115  14.966 -15.966
  957   1HE   LYS  36          2HE       LYS  36   4.581  15.696 -18.088
  958   2HE   LYS  36          3HE       LYS  36   6.266  15.954 -18.538
  959   1HZ   LYS  36          1HZ       LYS  36   6.450  13.426 -18.353
  960   2HZ   LYS  36          2HZ       LYS  36   5.657  14.063 -19.705
  961   3HZ   LYS  36          3HZ       LYS  36   4.759  13.419 -18.424
  962    H    LYS  37           H        LYS  37   7.514  18.396 -11.540
  963    HA   LYS  37           HA       LYS  37   4.674  18.421 -10.996
  964   1HB   LYS  37          2HB       LYS  37   7.016  18.000  -9.484
  965   2HB   LYS  37          3HB       LYS  37   6.271  19.455  -8.832
  966   1HG   LYS  37          2HG       LYS  37   4.596  17.033  -9.307
  967   2HG   LYS  37          3HG       LYS  37   5.641  17.113  -7.886
  968   1HD   LYS  37          2HD       LYS  37   4.556  19.406  -7.471
  969   2HD   LYS  37          3HD       LYS  37   3.330  18.881  -8.628
  970   1HE   LYS  37          2HE       LYS  37   2.688  17.061  -7.260
  971   2HE   LYS  37          3HE       LYS  37   4.106  17.241  -6.229
  972   1HZ   LYS  37          1HZ       LYS  37   3.100  18.789  -5.003
  973   2HZ   LYS  37          2HZ       LYS  37   1.657  18.252  -5.702
  974   3HZ   LYS  37          3HZ       LYS  37   2.459  19.595  -6.345
  975    H    ARG  38           H        ARG  38   3.556  20.142 -11.666
  976    HA   ARG  38           HA       ARG  38   4.169  22.734 -10.598
  977   1HB   ARG  38          2HB       ARG  38   4.196  23.852 -12.851
  978   2HB   ARG  38          3HB       ARG  38   5.629  22.904 -12.478
  979   1HG   ARG  38          2HG       ARG  38   5.253  21.435 -14.138
  980   2HG   ARG  38          3HG       ARG  38   3.503  21.465 -13.910
  981   1HD   ARG  38          2HD       ARG  38   3.206  23.195 -15.353
  982   2HD   ARG  38          3HD       ARG  38   4.764  23.926 -14.966
  983    HE   ARG  38           HE       ARG  38   5.288  21.557 -16.313
  984   1HH1  ARG  38          2HH1      ARG  38   3.729  24.606 -16.942
  985   2HH1  ARG  38          1HH1      ARG  38   4.089  24.590 -18.637
  986   1HH2  ARG  38          2HH2      ARG  38   5.768  21.524 -18.543
  987   2HH2  ARG  38          1HH2      ARG  38   5.249  22.835 -19.546
  988    H    LYS  39           H        LYS  39   2.011  21.091 -10.187
  989    HA   LYS  39           HA       LYS  39  -0.151  22.805 -10.904
  990   1HB   LYS  39          2HB       LYS  39   0.432  20.853 -12.793
  991   2HB   LYS  39          3HB       LYS  39  -0.887  20.155 -11.862
  992   1HG   LYS  39          2HG       LYS  39  -2.398  21.611 -12.664
  993   2HG   LYS  39          3HG       LYS  39  -1.261  22.960 -12.655
  994   1HD   LYS  39          2HD       LYS  39  -1.760  22.545 -14.928
  995   2HD   LYS  39          3HD       LYS  39  -0.155  21.866 -14.653
  996   1HE   LYS  39          2HE       LYS  39  -2.200  19.914 -14.098
  997   2HE   LYS  39          3HE       LYS  39  -2.392  20.572 -15.722
  998   1HZ   LYS  39          1HZ       LYS  39  -0.027  20.062 -16.114
  999   2HZ   LYS  39          2HZ       LYS  39  -0.951  18.680 -15.802
 1000   3HZ   LYS  39          3HZ       LYS  39   0.052  19.316 -14.597
 1001    H    SER  40           H        SER  40  -1.420  22.824  -9.178
 1002    HA   SER  40           HA       SER  40  -2.512  20.533  -7.968
 1003   1HB   SER  40          2HB       SER  40   0.075  20.832  -7.159
 1004   2HB   SER  40          3HB       SER  40  -0.775  21.755  -5.920
 1005    HG   SER  40           HG       SER  40  -0.509  19.453  -5.491
 1006    H    GLY  41           H        GLY  41  -3.693  21.089  -5.908
 1007   1HA   GLY  41          1HA       GLY  41  -4.101  23.478  -4.740
 1008   2HA   GLY  41          2HA       GLY  41  -4.947  23.679  -6.267
 1009    H    ASN  42           H        ASN  42  -5.568  23.176  -3.198
 1010    HA   ASN  42           HA       ASN  42  -8.150  22.131  -3.614
 1011   1HB   ASN  42          2HB       ASN  42  -6.216  20.130  -3.496
 1012   2HB   ASN  42          3HB       ASN  42  -6.907  20.157  -1.877
 1013   1HD2  ASN  42          1HD2      ASN  42  -7.255  19.038  -5.006
 1014   2HD2  ASN  42          2HD2      ASN  42  -8.886  18.477  -4.903
 1015    H    SER  43           H        SER  43  -9.452  22.553  -1.892
 1016    HA   SER  43           HA       SER  43  -8.330  24.117   0.241
 1017   1HB   SER  43          2HB       SER  43 -11.149  23.249  -0.411
 1018   2HB   SER  43          3HB       SER  43 -10.751  24.214   1.010
 1019    HG   SER  43           HG       SER  43 -10.398  24.898  -1.717
 1020    H    ARG  44           H        ARG  44  -8.163  23.610   2.387
 1021    HA   ARG  44           HA       ARG  44  -9.314  21.411   3.672
 1022   1HB   ARG  44          2HB       ARG  44  -7.204  20.645   1.985
 1023   2HB   ARG  44          3HB       ARG  44  -6.540  20.615   3.613
 1024   1HG   ARG  44          2HG       ARG  44  -8.128  19.034   4.341
 1025   2HG   ARG  44          3HG       ARG  44  -9.123  19.262   2.901
 1026   1HD   ARG  44          2HD       ARG  44  -6.662  18.536   1.882
 1027   2HD   ARG  44          3HD       ARG  44  -6.819  17.538   3.326
 1028    HE   ARG  44           HE       ARG  44  -9.189  17.498   1.741
 1029   1HH1  ARG  44          2HH1      ARG  44  -5.976  16.181   2.010
 1030   2HH1  ARG  44          1HH1      ARG  44  -6.363  14.724   1.156
 1031   1HH2  ARG  44          2HH2      ARG  44  -9.708  15.584   0.615
 1032   2HH2  ARG  44          1HH2      ARG  44  -8.484  14.385   0.362
 1033    H    GLU  45           H        GLU  45  -7.521  20.743   5.588
 1034    HA   GLU  45           HA       GLU  45  -7.541  22.934   7.307
 1035   1HB   GLU  45          2HB       GLU  45  -7.298  20.445   7.867
 1036   2HB   GLU  45          3HB       GLU  45  -5.582  20.659   7.550
 1037   1HG   GLU  45          2HG       GLU  45  -5.549  21.032   9.772
 1038   2HG   GLU  45          3HG       GLU  45  -5.928  22.673   9.253
 1039    H    ARG  46           H        ARG  46  -5.268  22.023   4.875
 1040    HA   ARG  46           HA       ARG  46  -3.231  23.845   5.904
 1041   1HB   ARG  46          2HB       ARG  46  -2.825  21.481   4.858
 1042   2HB   ARG  46          3HB       ARG  46  -2.980  22.335   3.329
 1043   1HG   ARG  46          2HG       ARG  46  -1.079  23.635   3.727
 1044   2HG   ARG  46          3HG       ARG  46  -1.077  23.259   5.452
 1045   1HD   ARG  46          2HD       ARG  46   0.619  21.902   4.686
 1046   2HD   ARG  46          3HD       ARG  46  -0.761  20.806   4.627
 1047    HE   ARG  46           HE       ARG  46  -0.566  20.745   2.347
 1048   1HH1  ARG  46          2HH1      ARG  46   1.244  23.455   3.573
 1049   2HH1  ARG  46          1HH1      ARG  46   1.968  23.830   2.045
 1050   1HH2  ARG  46          2HH2      ARG  46   0.382  21.229   0.330
 1051   2HH2  ARG  46          1HH2      ARG  46   1.477  22.563   0.200
 1052    H    CYS  47           H        CYS  47  -2.089  25.296   4.144
 1053    HA   CYS  47           HA       CYS  47  -4.224  26.446   2.498
 1054   1HB   CYS  47          2HB       CYS  47  -3.695  27.902   4.414
 1055   2HB   CYS  47          3HB       CYS  47  -2.006  27.933   3.944
 1056    H    GLN  48           H        GLN  48  -3.756  26.178   0.425
 1057    HA   GLN  48           HA       GLN  48  -1.017  25.615  -0.420
 1058   1HB   GLN  48          2HB       GLN  48  -3.485  24.559  -1.153
 1059   2HB   GLN  48          3HB       GLN  48  -3.025  25.562  -2.521
 1060   1HG   GLN  48          2HG       GLN  48  -1.150  23.552  -1.323
 1061   2HG   GLN  48          3HG       GLN  48  -2.325  23.121  -2.565
 1062   1HE2  GLN  48          1HE2      GLN  48   0.736  23.452  -2.350
 1063   2HE2  GLN  48          2HE2      GLN  48   1.136  24.316  -3.791
 1064    H    LEU  49           H        LEU  49  -1.852  28.316   0.331
 1065    HA   LEU  49           HA       LEU  49  -1.292  29.657  -2.230
 1066   1HB   LEU  49          2HB       LEU  49  -3.575  29.952  -0.591
 1067   2HB   LEU  49          3HB       LEU  49  -2.622  31.425  -0.422
 1068    HG   LEU  49           HG       LEU  49  -3.089  30.479  -3.184
 1069   1HD1  LEU  49          1HD1      LEU  49  -5.293  30.275  -2.974
 1070   2HD1  LEU  49          2HD1      LEU  49  -5.336  32.009  -2.659
 1071   3HD1  LEU  49          3HD1      LEU  49  -5.265  30.871  -1.314
 1072   1HD2  LEU  49          1HD2      LEU  49  -3.487  32.944  -3.463
 1073   2HD2  LEU  49          2HD2      LEU  49  -1.880  32.503  -2.882
 1074   3HD2  LEU  49          3HD2      LEU  49  -3.085  33.130  -1.756
 1075    H    CYS  50           H        CYS  50  -0.869  29.620   1.337
 1076    HA   CYS  50           HA       CYS  50   1.468  31.319   0.888
 1077   1HB   CYS  50          2HB       CYS  50   1.046  32.651   2.779
 1078   2HB   CYS  50          3HB       CYS  50  -0.495  32.566   1.948
 1079    H    ASN  51           H        ASN  51   0.631  28.375   1.269
 1080    HA   ASN  51           HA       ASN  51   1.465  26.485   2.221
 1081   1HB   ASN  51          2HB       ASN  51   3.769  28.054   3.332
 1082   2HB   ASN  51          3HB       ASN  51   3.754  26.422   2.673
 1083   1HD2  ASN  51          1HD2      ASN  51   5.018  29.258   2.108
 1084   2HD2  ASN  51          2HD2      ASN  51   5.004  29.311   0.381
 1085    H    GLY  52           H        GLY  52  -0.123  28.538   3.816
 1086   1HA   GLY  52          1HA       GLY  52   0.713  28.445   6.510
 1087   2HA   GLY  52          2HA       GLY  52  -0.922  28.773   5.955
 1088    H    MET  53           H        MET  53  -0.370  27.335   8.285
 1089    HA   MET  53           HA       MET  53  -1.389  24.680   7.526
 1090   1HB   MET  53          2HB       MET  53   1.044  24.756   8.358
 1091   2HB   MET  53          3HB       MET  53   0.359  25.116   9.936
 1092   1HG   MET  53          2HG       MET  53  -1.094  22.944   9.218
 1093   2HG   MET  53          3HG       MET  53   0.451  22.598   8.446
 1094   1HE   MET  53          1HE       MET  53   0.026  20.580   9.739
 1095   2HE   MET  53          2HE       MET  53   1.171  20.306  11.053
 1096   3HE   MET  53          3HE       MET  53  -0.528  20.621  11.414
 1097    H    GLY  54           H        GLY  54  -3.522  25.126   7.953
 1098   1HA   GLY  54          1HA       GLY  54  -4.750  24.627  10.240
 1099   2HA   GLY  54          2HA       GLY  54  -4.235  26.280  10.541
 1100    H    HIS  55           H        HIS  55  -4.709  27.667   8.371
 1101    HA   HIS  55           HA       HIS  55  -7.602  27.588   8.149
 1102   1HB   HIS  55          2HB       HIS  55  -7.337  29.762   6.998
 1103   2HB   HIS  55          3HB       HIS  55  -6.546  29.740   8.572
 1104    HD1  HIS  55           HD1      HIS  55  -3.870  29.402   8.484
 1105    HD2  HIS  55           HD2      HIS  55  -5.720  30.468   4.920
 1106    HE1  HIS  55           HE1      HIS  55  -2.027  30.248   6.996
 1107    H    ASN  56           H        ASN  56  -8.197  28.562   5.733
 1108    HA   ASN  56           HA       ASN  56  -7.152  26.536   3.864
 1109   1HB   ASN  56          2HB       ASN  56  -9.480  26.086   4.486
 1110   2HB   ASN  56          3HB       ASN  56  -9.938  27.713   3.992
 1111   1HD2  ASN  56          1HD2      ASN  56 -11.367  27.060   2.436
 1112   2HD2  ASN  56          2HD2      ASN  56 -10.879  26.294   0.967
 1113    H    ALA  57           H        ALA  57  -6.915  27.130   1.674
 1114    HA   ALA  57           HA       ALA  57  -5.848  29.661   1.203
 1115   1HB   ALA  57          1HB       ALA  57  -6.221  28.990  -1.271
 1116   2HB   ALA  57          2HB       ALA  57  -5.127  28.030  -0.274
 1117   3HB   ALA  57          3HB       ALA  57  -6.762  27.453  -0.596
 1118    H    LYS  58           H        LYS  58  -9.103  28.420   0.681
 1119    HA   LYS  58           HA       LYS  58 -10.112  30.567  -0.824
 1120   1HB   LYS  58          2HB       LYS  58 -11.606  28.782   1.106
 1121   2HB   LYS  58          3HB       LYS  58 -12.325  29.758  -0.167
 1122   1HG   LYS  58          2HG       LYS  58 -10.269  27.712  -0.863
 1123   2HG   LYS  58          3HG       LYS  58 -11.929  27.214  -0.530
 1124   1HD   LYS  58          2HD       LYS  58 -12.772  28.337  -2.366
 1125   2HD   LYS  58          3HD       LYS  58 -11.412  29.461  -2.434
 1126   1HE   LYS  58          2HE       LYS  58 -10.095  28.010  -3.598
 1127   2HE   LYS  58          3HE       LYS  58 -10.832  26.585  -2.869
 1128   1HZ   LYS  58          1HZ       LYS  58 -12.506  26.553  -4.394
 1129   2HZ   LYS  58          2HZ       LYS  58 -11.282  27.220  -5.353
 1130   3HZ   LYS  58          3HZ       LYS  58 -12.462  28.221  -4.670
 1131    H    GLN  59           H        GLN  59  -9.352  30.279   2.519
 1132    HA   GLN  59           HA       GLN  59 -10.701  32.843   3.055
 1133   1HB   GLN  59          2HB       GLN  59 -11.279  30.617   4.361
 1134   2HB   GLN  59          3HB       GLN  59  -9.840  31.043   5.275
 1135   1HG   GLN  59          2HG       GLN  59 -11.089  32.372   6.519
 1136   2HG   GLN  59          3HG       GLN  59 -11.342  33.392   5.103
 1137   1HE2  GLN  59          1HE2      GLN  59 -12.858  31.706   7.476
 1138   2HE2  GLN  59          2HE2      GLN  59 -14.402  31.483   6.734
 1139    H    CYS  60           H        CYS  60  -7.833  32.035   2.002
 1140    HA   CYS  60           HA       CYS  60  -6.242  33.120   4.155
 1141   1HB   CYS  60          2HB       CYS  60  -5.397  31.197   2.857
 1142   2HB   CYS  60          3HB       CYS  60  -5.426  32.158   1.392
 1143    H    ARG  61           H        ARG  61  -5.333  35.136   4.084
 1144    HA   ARG  61           HA       ARG  61  -5.110  37.346   3.598
 1145   1HB   ARG  61          2HB       ARG  61  -5.415  36.523   0.709
 1146   2HB   ARG  61          3HB       ARG  61  -4.598  37.949   1.333
 1147   1HG   ARG  61          2HG       ARG  61  -3.355  35.755   2.556
 1148   2HG   ARG  61          3HG       ARG  61  -3.561  35.324   0.858
 1149   1HD   ARG  61          2HD       ARG  61  -2.616  37.659   0.360
 1150   2HD   ARG  61          3HD       ARG  61  -2.088  37.654   2.042
 1151    HE   ARG  61           HE       ARG  61  -0.413  36.217   1.461
 1152   1HH1  ARG  61          2HH1      ARG  61  -2.849  36.161  -1.025
 1153   2HH1  ARG  61          1HH1      ARG  61  -1.924  35.156  -2.091
 1154   1HH2  ARG  61          2HH2      ARG  61   0.815  34.894   0.067
 1155   2HH2  ARG  61          1HH2      ARG  61   0.160  34.436  -1.469
 1156    H    LYS  62           H        LYS  62  -7.503  36.990   4.508
 1157    HA   LYS  62           HA       LYS  62  -9.289  38.423   2.653
 1158   1HB   LYS  62          2HB       LYS  62  -9.894  35.992   3.193
 1159   2HB   LYS  62          3HB       LYS  62 -10.257  36.563   4.817
 1160   1HG   LYS  62          2HG       LYS  62 -12.312  36.952   4.074
 1161   2HG   LYS  62          3HG       LYS  62 -11.629  38.325   3.201
 1162   1HD   LYS  62          2HD       LYS  62 -12.825  37.103   1.585
 1163   2HD   LYS  62          3HD       LYS  62 -11.131  36.678   1.322
 1164   1HE   LYS  62          2HE       LYS  62 -11.537  34.528   1.730
 1165   2HE   LYS  62          3HE       LYS  62 -12.352  34.910   3.246
 1166   1HZ   LYS  62          1HZ       LYS  62 -14.347  34.674   2.309
 1167   2HZ   LYS  62          2HZ       LYS  62 -13.544  33.884   1.047
 1168   3HZ   LYS  62          3HZ       LYS  62 -13.916  35.529   0.914
 1169    H    ARG  63           H        ARG  63  -9.063  37.641   6.130
 1170    HA   ARG  63           HA       ARG  63  -9.198  40.494   6.745
 1171   1HB   ARG  63          2HB       ARG  63 -11.011  40.264   8.291
 1172   2HB   ARG  63          3HB       ARG  63 -11.531  39.579   6.758
 1173   1HG   ARG  63          2HG       ARG  63 -11.185  37.344   7.583
 1174   2HG   ARG  63          3HG       ARG  63 -10.508  37.972   9.088
 1175   1HD   ARG  63          2HD       ARG  63 -12.782  37.322   9.488
 1176   2HD   ARG  63          3HD       ARG  63 -12.685  39.083   9.536
 1177    HE   ARG  63           HE       ARG  63 -14.082  39.167   7.729
 1178   1HH1  ARG  63          2HH1      ARG  63 -12.761  35.956   7.988
 1179   2HH1  ARG  63          1HH1      ARG  63 -13.766  35.301   6.738
 1180   1HH2  ARG  63          2HH2      ARG  63 -15.412  38.316   6.083
 1181   2HH2  ARG  63          1HH2      ARG  63 -15.273  36.645   5.654
 1182    H    ASP  64           H        ASP  64  -8.098  41.073   8.562
 1183    HA   ASP  64           HA       ASP  64  -6.570  40.917  10.241
 1184   1HB   ASP  64          2HB       ASP  64  -8.612  39.799  11.287
 1185   2HB   ASP  64          3HB       ASP  64  -7.831  38.263  10.922
  Start of MODEL   17
    1   1H5*    C 160          1H5*        C 160  10.829  14.861 -19.828
    2   2H5*    C 160          2H5*        C 160  11.284  16.123 -18.683
    3    H4*    C 160           H4*        C 160  11.289  14.085 -17.489
    4    H3*    C 160           H3*        C 160  14.034  15.128 -18.101
    5    H2*    C 160           H2*        C 160  15.015  13.321 -16.903
    6   2HO*    C 160          2HO*        C 160  13.748  12.561 -15.309
    7    H1*    C 160           H1*        C 160  13.434  11.398 -18.209
    8   1H4     C 160          1H4         C 160  19.000  11.599 -21.376
    9   2H4     C 160          2H4         C 160  18.296  12.791 -22.445
   10    H5     C 160           H5         C 160  16.168  13.761 -22.116
   11    H6     C 160           H6         C 160  14.170  13.825 -20.665
   12   1H5*    U 161          1H5*        U 161  13.538  14.340 -13.995
   13   2H5*    U 161          2H5*        U 161  14.457  15.331 -12.863
   14    H4*    U 161           H4*        U 161  14.937  12.912 -12.683
   15    H3*    U 161           H3*        U 161  17.156  14.831 -13.353
   16    H2*    U 161           H2*        U 161  18.724  13.052 -13.213
   17   2HO*    U 161          2HO*        U 161  17.785  10.956 -12.463
   18    H1*    U 161           H1*        U 161  17.188  11.333 -14.807
   19    H3     U 161           H3         U 161  20.973  12.701 -17.085
   20    H5     U 161           H5         U 161  17.995  15.504 -17.985
   21    H6     U 161           H6         U 161  16.626  14.464 -16.235
   22   1H5*    G 162          1H5*        G 162  18.744  12.903  -9.363
   23   2H5*    G 162          2H5*        G 162  19.424  14.373  -8.666
   24    H4*    G 162           H4*        G 162  21.065  12.558  -8.802
   25    H3*    G 162           H3*        G 162  21.562  15.082 -10.355
   26    H2*    G 162           H2*        G 162  23.703  14.260 -11.003
   27   2HO*    G 162          2HO*        G 162  23.217  11.814  -9.655
   28    H1*    G 162           H1*        G 162  22.691  11.804 -11.856
   29    H8     G 162           H8         G 162  20.176  14.368 -12.747
   30    H1     G 162           H1         G 162  25.171  14.211 -16.860
   31   1H2     G 162          1H2         G 162  26.677  13.047 -16.070
   32   2H2     G 162          2H2         G 162  26.599  12.233 -14.524
   33   1H5*    C 163          1H5*        C 163  24.880  14.250  -8.131
   34   2H5*    C 163          2H5*        C 163  25.540  15.591  -7.196
   35    H4*    C 163           H4*        C 163  27.331  14.735  -8.457
   36    H3*    C 163           H3*        C 163  26.247  17.296  -9.598
   37    H2*    C 163           H2*        C 163  27.960  17.290 -11.246
   38   2HO*    C 163          2HO*        C 163  29.603  15.564 -10.984
   39    H1*    C 163           H1*        C 163  27.519  14.593 -11.914
   40   1H4     C 163          1H4         C 163  24.195  17.869 -16.270
   41   2H4     C 163          2H4         C 163  22.899  18.076 -15.113
   42    H5     C 163           H5         C 163  23.026  17.383 -12.858
   43    H6     C 163           H6         C 163  24.441  16.312 -11.142
   44   1H5*    C 164          1H5*        C 164  30.326  17.712  -9.131
   45   2H5*    C 164          2H5*        C 164  30.831  19.189  -8.310
   46    H4*    C 164           H4*        C 164  32.070  19.100 -10.307
   47    H3*    C 164           H3*        C 164  29.820  21.079 -10.419
   48    H2*    C 164           H2*        C 164  30.459  21.730 -12.612
   49   2HO*    C 164          2HO*        C 164  32.523  21.093 -13.331
   50    H1*    C 164           H1*        C 164  30.698  19.048 -13.480
   51   1H4     C 164          1H4         C 164  24.951  20.891 -15.561
   52   2H4     C 164          2H4         C 164  24.298  20.638 -13.958
   53    H5     C 164           H5         C 164  25.608  20.056 -12.080
   54    H6     C 164           H6         C 164  27.890  19.570 -11.271
   55   1H5*    C 165          1H5*        C 165  33.348  23.332 -11.385
   56   2H5*    C 165          2H5*        C 165  33.248  24.981 -10.771
   57    H4*    C 165           H4*        C 165  33.475  24.929 -13.200
   58    H3*    C 165           H3*        C 165  30.920  26.048 -12.060
   59    H2*    C 165           H2*        C 165  30.264  26.708 -14.242
   60   2HO*    C 165          2HO*        C 165  32.433  25.744 -15.619
   61    H1*    C 165           H1*        C 165  31.034  24.209 -15.358
   62   1H4     C 165          1H4         C 165  24.679  23.900 -14.753
   63   2H4     C 165          2H4         C 165  24.882  23.436 -13.078
   64    H5     C 165           H5         C 165  26.968  23.381 -11.973
   65    H6     C 165           H6         C 165  29.396  23.761 -12.202
   66   1H5*    U 166          1H5*        U 166  32.817  29.846 -13.994
   67   2H5*    U 166          2H5*        U 166  32.154  31.107 -12.955
   68    H4*    U 166           H4*        U 166  31.607  31.283 -15.408
   69    H3*    U 166           H3*        U 166  29.477  31.307 -13.282
   70    H2*    U 166           H2*        U 166  27.845  31.769 -14.946
   71   2HO*    U 166          2HO*        U 166  28.619  32.408 -17.021
   72    H1*    U 166           H1*        U 166  28.789  29.763 -16.671
   73    H3     U 166           H3         U 166  24.670  28.514 -15.041
   74    H5     U 166           H5         U 166  27.456  27.179 -12.213
   75    H6     U 166           H6         U 166  29.155  28.465 -13.427
   76   1H5*    C 167          1H5*        C 167  28.829  34.758 -15.488
   77   2H5*    C 167          2H5*        C 167  28.835  36.195 -14.466
   78    H4*    C 167           H4*        C 167  26.866  36.388 -15.681
   79    H3*    C 167           H3*        C 167  26.289  35.249 -12.959
   80    H2*    C 167           H2*        C 167  23.958  35.302 -13.443
   81   2HO*    C 167          2HO*        C 167  23.295  36.521 -15.248
   82    H1*    C 167           H1*        C 167  24.274  34.049 -15.925
   83   1H4     C 167          1H4         C 167  23.007  29.197 -11.989
   84   2H4     C 167          2H4         C 167  24.637  29.276 -11.358
   85    H5     C 167           H5         C 167  26.209  30.925 -11.977
   86    H6     C 167           H6         C 167  26.609  32.925 -13.370
   87   1H5*    A 168          1H5*        A 168  27.306  39.555 -12.556
   88   2H5*    A 168          2H5*        A 168  26.485  40.642 -11.437
   89    H4*    A 168           H4*        A 168  25.957  40.725 -14.403
   90    H3*    A 168           H3*        A 168  28.241  42.003 -12.903
   91    H2*    A 168           H2*        A 168  27.977  43.938 -14.127
   92   2HO*    A 168          2HO*        A 168  26.469  43.045 -16.213
   93    H1*    A 168           H1*        A 168  25.133  43.204 -14.665
   94    H8     A 168           H8         A 168  26.906  45.921 -14.559
   95   1H6     A 168          1H6         A 168  23.673  48.655  -9.973
   96   2H6     A 168          2H6         A 168  24.799  48.944 -11.281
   97    H2     A 168           H2         A 168  22.783  44.302  -9.898
   98   1H5*    U 169          1H5*        U 169  30.435  43.609 -13.785
   99   2H5*    U 169          2H5*        U 169  30.943  44.307 -15.323
  100    H4*    U 169           H4*        U 169  32.513  42.189 -13.843
  101    H3*    U 169           H3*        U 169  32.681  45.197 -13.643
  102    H2*    U 169           H2*        U 169  34.994  45.030 -13.382
  103   2HO*    U 169          2HO*        U 169  35.489  43.421 -12.014
  104    H1*    U 169           H1*        U 169  35.052  42.657 -15.116
  105    H3     U 169           H3         U 169  38.362  44.924 -17.145
  106    H5     U 169           H5         U 169  35.094  47.518 -17.494
  107    H6     U 169           H6         U 169  33.822  45.944 -16.109
  108   1H5*    C 170          1H5*        C 170  29.930  46.183 -12.089
  109   2H5*    C 170          2H5*        C 170  30.454  47.077 -10.662
  110    H4*    C 170           H4*        C 170  28.077  46.808 -10.580
  111    H3*    C 170           H3*        C 170  29.608  45.181  -8.562
  112    H2*    C 170           H2*        C 170  27.562  44.484  -7.586
  113   2HO*    C 170          2HO*        C 170  26.302  46.277  -7.688
  114    H1*    C 170           H1*        C 170  26.408  43.974 -10.149
  115   1H4     C 170          1H4         C 170  27.904  38.205  -7.858
  116   2H4     C 170          2H4         C 170  29.573  38.472  -8.306
  117    H5     C 170           H5         C 170  30.394  40.510  -9.174
  118    H6     C 170           H6         C 170  29.807  42.817  -9.831
  119   1H5*    C 171          1H5*        C 171  29.006  49.505  -6.331
  120   2H5*    C 171          2H5*        C 171  30.376  49.533  -5.221
  121    H4*    C 171           H4*        C 171  28.206  49.328  -4.075
  122    H3*    C 171           H3*        C 171  30.203  47.085  -3.769
  123    H2*    C 171           H2*        C 171  28.805  46.129  -2.117
  124   2HO*    C 171          2HO*        C 171  26.799  47.996  -2.133
  125    H1*    C 171           H1*        C 171  26.455  46.630  -3.662
  126   1H4     C 171          1H4         C 171  27.592  40.383  -4.358
  127   2H4     C 171          2H4         C 171  28.803  40.754  -5.565
  128    H5     C 171           H5         C 171  29.489  42.946  -6.111
  129    H6     C 171           H6         C 171  29.177  45.348  -5.629
  130   1H5*    G 172          1H5*        G 172  30.004  48.996   0.629
  131   2H5*    G 172          2H5*        G 172  31.667  48.642   1.097
  132    H4*    G 172           H4*        G 172  29.987  47.789   2.695
  133    H3*    G 172           H3*        G 172  31.878  45.885   1.343
  134    H2*    G 172           H2*        G 172  31.025  44.100   2.672
  135   2HO*    G 172          2HO*        G 172  29.046  45.494   3.964
  136    H1*    G 172           H1*        G 172  28.364  44.705   2.083
  137    H8     G 172           H8         G 172  30.324  45.352  -0.990
  138    H1     G 172           H1         G 172  29.110  39.063  -0.060
  139   1H2     G 172          1H2         G 172  28.370  38.778   1.844
  140   2H2     G 172          2H2         G 172  28.117  40.054   3.014
  141   1H5*    U 173          1H5*        U 173  32.290  45.148   5.435
  142   2H5*    U 173          2H5*        U 173  33.981  45.176   5.939
  143    H4*    U 173           H4*        U 173  33.082  43.138   6.714
  144    H3*    U 173           H3*        U 173  34.856  42.806   4.314
  145    H2*    U 173           H2*        U 173  34.599  40.448   4.433
  146   2HO*    U 173          2HO*        U 173  33.274  39.723   6.365
  147    H1*    U 173           H1*        U 173  31.806  40.600   4.708
  148    H3     U 173           H3         U 173  32.645  38.797   0.584
  149    H5     U 173           H5         U 173  32.994  42.936   0.051
  150    H6     U 173           H6         U 173  32.842  43.163   2.488
  151   1H5*    C 174          1H5*        C 174  36.973  40.084   7.358
  152   2H5*    C 174          2H5*        C 174  38.655  40.493   7.016
  153    H4*    C 174           H4*        C 174  38.235  38.092   6.828
  154    H3*    C 174           H3*        C 174  39.075  39.580   4.350
  155    H2*    C 174           H2*        C 174  39.238  37.510   3.189
  156   2HO*    C 174          2HO*        C 174  38.771  35.576   4.646
  157    H1*    C 174           H1*        C 174  36.726  36.632   4.135
  158   1H4     C 174          1H4         C 174  35.729  38.958  -1.750
  159   2H4     C 174          2H4         C 174  35.396  40.517  -1.029
  160    H5     C 174           H5         C 174  35.679  40.991   1.268
  161    H6     C 174           H6         C 174  36.360  40.078   3.458
  162   1H5*    U 175          1H5*        U 175  44.713  39.771   5.554
  163   2H5*    U 175          2H5*        U 175  43.552  40.977   5.001
  164    H4*    U 175           H4*        U 175  42.955  38.766   3.442
  165    H3*    U 175           H3*        U 175  45.891  38.743   4.053
  166    H2*    U 175           H2*        U 175  46.391  38.267   1.779
  167   2HO*    U 175          2HO*        U 175  44.121  38.210   0.517
  168    H1*    U 175           H1*        U 175  44.682  40.298   0.827
  169    H3     U 175           H3         U 175  48.802  41.868  -0.226
  170    H5     U 175           H5         U 175  48.541  42.421   3.918
  171    H6     U 175           H6         U 175  46.429  41.178   3.851
  172   1H5*    C 176          1H5*        C 176  42.621  35.724   4.902
  173   2H5*    C 176          2H5*        C 176  42.805  34.361   6.007
  174    H4*    C 176           H4*        C 176  42.939  32.812   4.305
  175    H3*    C 176           H3*        C 176  43.980  35.026   2.549
  176    H2*    C 176           H2*        C 176  43.283  33.802   0.635
  177   2HO*    C 176          2HO*        C 176  42.149  31.632   1.589
  178    H1*    C 176           H1*        C 176  40.742  33.258   1.734
  179   1H4     C 176          1H4         C 176  39.927  38.308  -2.109
  180   2H4     C 176          2H4         C 176  40.335  39.353  -0.767
  181    H5     C 176           H5         C 176  41.090  38.569   1.329
  182    H6     C 176           H6         C 176  41.645  36.569   2.665
  183   1H5*    G 177          1H5*        G 177  45.603  31.241   0.818
  184   2H5*    G 177          2H5*        G 177  47.339  31.554   0.790
  185    H4*    G 177           H4*        G 177  46.794  30.701  -1.334
  186    H3*    G 177           H3*        G 177  47.258  33.662  -1.339
  187    H2*    G 177           H2*        G 177  46.919  33.741  -3.696
  188   2HO*    G 177          2HO*        G 177  46.356  31.417  -4.542
  189    H1*    G 177           H1*        G 177  44.517  32.326  -3.571
  190    H8     G 177           H8         G 177  44.693  34.525  -0.587
  191    H1     G 177           H1         G 177  42.858  37.662  -5.941
  192   1H2     G 177          1H2         G 177  43.158  36.453  -7.585
  193   2H2     G 177          2H2         G 177  43.811  34.832  -7.522
  194   1H5*    C 178          1H5*        C 178  49.318  32.194  -4.445
  195   2H5*    C 178          2H5*        C 178  50.993  32.726  -4.595
  196    H4*    C 178           H4*        C 178  49.892  33.231  -6.637
  197    H3*    C 178           H3*        C 178  50.461  35.640  -4.932
  198    H2*    C 178           H2*        C 178  49.619  37.055  -6.632
  199   2HO*    C 178          2HO*        C 178  50.159  36.221  -8.562
  200    H1*    C 178           H1*        C 178  47.367  35.363  -7.085
  201   1H4     C 178          1H4         C 178  45.060  40.242  -3.676
  202   2H4     C 178          2H4         C 178  45.725  39.530  -2.223
  203    H5     C 178           H5         C 178  47.083  37.597  -2.207
  204    H6     C 178           H6         C 178  48.148  35.856  -3.596
  205   1H5*    U 179          1H5*        U 179  52.385  36.395  -8.700
  206   2H5*    U 179          2H5*        U 179  53.864  37.331  -8.487
  207    H4*    U 179           H4*        U 179  52.237  38.485  -9.902
  208    H3*    U 179           H3*        U 179  52.981  39.768  -7.279
  209    H2*    U 179           H2*        U 179  51.724  41.680  -7.878
  210   2HO*    U 179          2HO*        U 179  50.979  41.757 -10.132
  211    H1*    U 179           H1*        U 179  49.568  40.087  -8.869
  212    H3     U 179           H3         U 179  48.046  42.686  -5.380
  213    H5     U 179           H5         U 179  49.703  39.266  -3.618
  214    H6     U 179           H6         U 179  50.595  38.681  -5.827
  215   1H5*    U 180          1H5*        U 180  53.613  42.258 -10.354
  216   2H5*    U 180          2H5*        U 180  55.028  43.308 -10.397
  217    H4*    U 180           H4*        U 180  53.121  44.699 -10.572
  218    H3*    U 180           H3*        U 180  54.483  44.822  -7.902
  219    H2*    U 180           H2*        U 180  52.941  46.455  -7.147
  220   2HO*    U 180          2HO*        U 180  51.603  47.454  -8.750
  221    H1*    U 180           H1*        U 180  50.719  45.016  -8.194
  222    H3     U 180           H3         U 180  49.949  44.961  -3.724
  223    H5     U 180           H5         U 180  53.114  42.267  -4.238
  224    H6     U 180           H6         U 180  53.214  42.984  -6.581
  225   1H5*    A 181          1H5*        A 181  56.878  48.617  -9.853
  226   2H5*    A 181          2H5*        A 181  58.226  48.536  -8.718
  227    H4*    A 181           H4*        A 181  56.729  50.562  -8.549
  228    H3*    A 181           H3*        A 181  57.390  48.827  -6.182
  229    H2*    A 181           H2*        A 181  56.238  50.340  -4.761
  230   2HO*    A 181          2HO*        A 181  56.892  52.245  -5.757
  231    H1*    A 181           H1*        A 181  53.986  50.474  -6.417
  232    H8     A 181           H8         A 181  55.443  47.017  -6.298
  233   1H6     A 181          1H6         A 181  51.812  46.033  -1.317
  234   2H6     A 181          2H6         A 181  52.884  45.262  -2.465
  235    H2     A 181           H2         A 181  51.601  50.347  -2.361
  236   1H5*    U 182          1H5*        U 182  59.799  48.807  -3.317
  237   2H5*    U 182          2H5*        U 182  58.069  48.621  -3.603
  238    H4*    U 182           H4*        U 182  59.503  49.958  -1.395
  239    H3*    U 182           H3*        U 182  56.918  48.429  -1.705
  240    H2*    U 182           H2*        U 182  56.114  49.407   0.232
  241   2HO*    U 182          2HO*        U 182  57.732  48.914   1.636
  242    H1*    U 182           H1*        U 182  57.874  51.759  -0.214
  243    H3     U 182           H3         U 182  54.110  53.826   1.244
  244    H5     U 182           H5         U 182  52.984  52.142  -2.421
  245    H6     U 182           H6         U 182  55.164  51.018  -2.462
  246   1H5*    U 183          1H5*        U 183  57.976  43.880   0.813
  247   2H5*    U 183          2H5*        U 183  59.033  44.617   2.018
  248    H4*    U 183           H4*        U 183  59.684  42.725  -0.197
  249    H3*    U 183           H3*        U 183  60.427  42.971   2.723
  250    H2*    U 183           H2*        U 183  62.273  41.574   2.315
  251   2HO*    U 183          2HO*        U 183  61.947  40.873  -0.249
  252    H1*    U 183           H1*        U 183  62.704  42.805  -0.279
  253    H3     U 183           H3         U 183  66.676  42.994   2.034
  254    H5     U 183           H5         U 183  64.384  46.190   3.470
  255    H6     U 183           H6         U 183  62.484  45.255   2.233
  256   1H5*    C 184          1H5*        C 184  60.038  42.834   4.871
  257   2H5*    C 184          2H5*        C 184  61.671  42.256   5.202
  258    H4*    C 184           H4*        C 184  59.226  40.908   6.347
  259    H3*    C 184           H3*        C 184  60.700  43.312   7.430
  260    H2*    C 184           H2*        C 184  60.393  42.505   9.586
  261   2HO*    C 184          2HO*        C 184  58.618  40.599   9.462
  262    H1*    C 184           H1*        C 184  60.386  39.730   8.556
  263   1H4     C 184          1H4         C 184  65.070  39.837  12.904
  264   2H4     C 184          2H4         C 184  66.081  40.694  11.762
  265    H5     C 184           H5         C 184  65.329  41.467   9.661
  266    H6     C 184           H6         C 184  63.403  41.613   8.124
  267   1H5*    G 185          1H5*        G 185  55.375  46.305   7.600
  268   2H5*    G 185          2H5*        G 185  56.415  46.089   9.008
  269    H4*    G 185           H4*        G 185  54.570  43.950   7.928
  270    H3*    G 185           H3*        G 185  54.022  46.147   9.889
  271    H2*    G 185           H2*        G 185  52.745  44.665  11.249
  272   2HO*    G 185          2HO*        G 185  53.333  42.477   9.560
  273    H1*    G 185           H1*        G 185  54.738  42.713  11.293
  274    H8     G 185           H8         G 185  56.943  45.454  11.571
  275    H1     G 185           H1         G 185  53.165  45.190  16.818
  276   1H2     G 185          1H2         G 185  51.551  43.963  16.444
  277   2H2     G 185          2H2         G 185  51.263  43.131  14.932
  278   1H5*    G 186          1H5*        G 186  48.517  46.917   8.701
  279   2H5*    G 186          2H5*        G 186  49.461  47.274  10.148
  280    H4*    G 186           H4*        G 186  48.650  44.478  10.039
  281    H3*    G 186           H3*        G 186  46.512  46.551   9.666
  282    H2*    G 186           H2*        G 186  45.093  45.380  11.180
  283   2HO*    G 186          2HO*        G 186  46.483  43.364  12.064
  284    H1*    G 186           H1*        G 186  47.061  45.187  13.147
  285    H8     G 186           H8         G 186  45.173  46.534  14.344
  286    H1     G 186           H1         G 186  46.654  51.795  10.879
  287   1H2     G 186          1H2         G 186  47.948  51.278   9.360
  288   2H2     G 186          2H2         G 186  48.544  49.659   9.068
  289   1H5*    G 187          1H5*        G 187  43.753  46.903   6.351
  290   2H5*    G 187          2H5*        G 187  44.896  46.040   5.322
  291    H4*    G 187           H4*        G 187  44.926  48.906   6.208
  292    H3*    G 187           H3*        G 187  44.952  47.469   3.572
  293    H2*    G 187           H2*        G 187  46.120  49.295   2.583
  294   2HO*    G 187          2HO*        G 187  46.547  50.912   4.662
  295    H1*    G 187           H1*        G 187  48.054  49.371   4.591
  296    H8     G 187           H8         G 187  47.321  45.800   4.116
  297    H1     G 187           H1         G 187  51.042  48.200  -0.605
  298   1H2     G 187          1H2         G 187  51.056  50.258  -0.492
  299   2H2     G 187          2H2         G 187  50.188  51.195   0.703
  300   1H5*    G 188          1H5*        G 188  44.413  51.459   2.397
  301   2H5*    G 188          2H5*        G 188  42.756  51.479   1.795
  302    H4*    G 188           H4*        G 188  43.929  52.589   0.139
  303    H3*    G 188           H3*        G 188  43.575  49.708  -0.646
  304    H2*    G 188           H2*        G 188  44.612  50.163  -2.742
  305   2HO*    G 188          2HO*        G 188  44.800  52.321  -3.356
  306    H1*    G 188           H1*        G 188  46.792  51.461  -1.569
  307    H8     G 188           H8         G 188  46.008  48.668   0.688
  308    H1     G 188           H1         G 188  49.091  46.720  -4.659
  309   1H2     G 188          1H2         G 188  49.114  48.253  -6.037
  310   2H2     G 188          2H2         G 188  48.405  49.831  -5.783
  311   1H5*    A 189          1H5*        A 189  41.903  51.739  -4.457
  312   2H5*    A 189          2H5*        A 189  40.627  50.566  -4.779
  313    H4*    A 189           H4*        A 189  42.376  50.873  -6.582
  314    H3*    A 189           H3*        A 189  41.631  48.176  -5.472
  315    H2*    A 189           H2*        A 189  43.032  47.140  -7.086
  316   2HO*    A 189          2HO*        A 189  43.944  48.612  -8.732
  317    H1*    A 189           H1*        A 189  45.188  48.860  -6.582
  318    H8     A 189           H8         A 189  43.448  48.003  -3.394
  319   1H6     A 189          1H6         A 189  47.044  42.908  -3.157
  320   2H6     A 189          2H6         A 189  45.902  43.880  -2.256
  321    H2     A 189           H2         A 189  47.584  44.807  -7.138
  322   1H5*    G 190          1H5*        G 190  41.140  48.107  -9.874
  323   2H5*    G 190          2H5*        G 190  39.580  47.349 -10.190
  324    H4*    G 190           H4*        G 190  41.220  46.303 -11.573
  325    H3*    G 190           H3*        G 190  40.189  44.609  -9.320
  326    H2*    G 190           H2*        G 190  41.477  42.764 -10.104
  327   2HO*    G 190          2HO*        G 190  42.827  43.876 -12.143
  328    H1*    G 190           H1*        G 190  43.827  44.259 -10.279
  329    H8     G 190           H8         G 190  41.982  45.450  -7.294
  330    H1     G 190           H1         G 190  45.178  39.922  -6.243
  331   1H2     G 190          1H2         G 190  45.838  39.156  -8.041
  332   2H2     G 190          2H2         G 190  45.566  39.901  -9.601
  333   1H5*    C 191          1H5*        C 191  39.908  42.416 -12.903
  334   2H5*    C 191          2H5*        C 191  38.381  41.547 -13.057
  335    H4*    C 191           H4*        C 191  40.162  39.990 -13.350
  336    H3*    C 191           H3*        C 191  38.683  39.707 -10.746
  337    H2*    C 191           H2*        C 191  39.944  37.751 -10.258
  338   2HO*    C 191          2HO*        C 191  41.072  36.786 -11.972
  339    H1*    C 191           H1*        C 191  42.389  38.971 -10.902
  340   1H4     C 191          1H4         C 191  41.868  39.607  -4.566
  341   2H4     C 191          2H4         C 191  40.892  41.039  -4.807
  342    H5     C 191           H5         C 191  40.167  41.796  -6.924
  343    H6     C 191           H6         C 191  40.200  41.359  -9.354
  344   1H5*    G 192          1H5*        G 192  38.952  35.839 -12.312
  345   2H5*    G 192          2H5*        G 192  37.307  35.268 -12.589
  346    H4*    G 192           H4*        G 192  38.314  33.493 -11.495
  347    H3*    G 192           H3*        G 192  36.743  35.146  -9.542
  348    H2*    G 192           H2*        G 192  37.286  33.618  -7.797
  349   2HO*    G 192          2HO*        G 192  37.896  31.591  -8.421
  350    H1*    G 192           H1*        G 192  40.016  33.656  -8.380
  351    H8     G 192           H8         G 192  38.569  37.056  -8.912
  352    H1     G 192           H1         G 192  39.998  35.801  -2.726
  353   1H2     G 192          1H2         G 192  40.451  33.801  -2.516
  354   2H2     G 192          2H2         G 192  40.445  32.636  -3.822
  355   1H5*    G 193          1H5*        G 193  35.777  31.210  -9.128
  356   2H5*    G 193          2H5*        G 193  34.066  30.798  -9.038
  357    H4*    G 193           H4*        G 193  35.106  29.804  -7.164
  358    H3*    G 193           H3*        G 193  33.474  32.228  -6.487
  359    H2*    G 193           H2*        G 193  33.936  31.916  -4.170
  360   2HO*    G 193          2HO*        G 193  35.643  29.738  -4.632
  361    H1*    G 193           H1*        G 193  36.687  31.681  -4.573
  362    H8     G 193           H8         G 193  35.297  34.207  -6.940
  363    H1     G 193           H1         G 193  36.412  36.570  -1.020
  364   1H2     G 193          1H2         G 193  36.834  35.019   0.273
  365   2H2     G 193          2H2         G 193  36.880  33.330  -0.180
  366   1H5*    A 194          1H5*        A 194  32.489  29.263  -3.826
  367   2H5*    A 194          2H5*        A 194  30.784  28.821  -3.913
  368    H4*    A 194           H4*        A 194  31.200  29.031  -1.635
  369    H3*    A 194           H3*        A 194  29.843  31.464  -2.725
  370    H2*    A 194           H2*        A 194  29.844  32.492  -0.580
  371   2HO*    A 194          2HO*        A 194  31.083  30.852   1.017
  372    H1*    A 194           H1*        A 194  32.566  31.959  -0.151
  373    H8     A 194           H8         A 194  31.855  32.928  -3.704
  374   1H6     A 194          1H6         A 194  32.644  38.846  -1.887
  375   2H6     A 194          2H6         A 194  32.433  37.806  -3.279
  376    H2     A 194           H2         A 194  32.600  36.274   1.735
  377   1H5*    C 195          1H5*        C 195  27.710  30.318   0.750
  378   2H5*    C 195          2H5*        C 195  25.967  30.312   0.479
  379    H4*    C 195           H4*        C 195  26.396  31.663   2.384
  380    H3*    C 195           H3*        C 195  25.598  33.190  -0.070
  381    H2*    C 195           H2*        C 195  25.670  35.233   1.136
  382   2HO*    C 195          2HO*        C 195  25.810  35.089   3.436
  383    H1*    C 195           H1*        C 195  28.176  34.607   2.302
  384   1H4     C 195          1H4         C 195  29.594  38.517  -2.542
  385   2H4     C 195          2H4         C 195  29.436  37.177  -3.657
  386    H5     C 195           H5         C 195  28.708  35.020  -3.029
  387    H6     C 195           H6         C 195  27.943  33.604  -1.157
  388   1H5*    G 196          1H5*        G 196  22.434  34.364   3.054
  389   2H5*    G 196          2H5*        G 196  20.953  34.381   2.096
  390    H4*    G 196           H4*        G 196  21.250  36.483   3.272
  391    H3*    G 196           H3*        G 196  21.381  36.543   0.272
  392    H2*    G 196           H2*        G 196  21.550  38.920   0.327
  393   2HO*    G 196          2HO*        G 196  21.449  39.828   2.604
  394    H1*    G 196           H1*        G 196  23.612  38.902   2.205
  395    H8     G 196           H8         G 196  24.121  36.008  -0.059
  396    H1     G 196           H1         G 196  26.142  41.602  -2.608
  397   1H2     G 196          1H2         G 196  25.474  43.169  -1.445
  398   2H2     G 196          2H2         G 196  24.510  42.994   0.004
  399   1H5*    A 197          1H5*        A 197  18.422  38.463  -0.313
  400   2H5*    A 197          2H5*        A 197  17.503  38.275   1.180
  401    H4*    A 197           H4*        A 197  15.445  38.009  -0.043
  402    H3*    A 197           H3*        A 197  17.196  37.815  -2.475
  403    H2*    A 197           H2*        A 197  15.729  39.076  -3.725
  404   2HO*    A 197          2HO*        A 197  13.773  38.321  -1.751
  405    H1*    A 197           H1*        A 197  14.649  40.288  -1.212
  406    H8     A 197           H8         A 197  17.757  40.913  -3.380
  407   1H6     A 197          1H6         A 197  15.197  46.485  -4.543
  408   2H6     A 197          2H6         A 197  16.596  45.477  -4.842
  409    H2     A 197           H2         A 197  12.406  44.184  -1.963
  410   1H5*    U 198          1H5*        U 198  15.520  34.143  -1.002
  411   2H5*    U 198          2H5*        U 198  16.362  33.169  -2.206
  412    H4*    U 198           H4*        U 198  14.073  32.043  -2.604
  413    H3*    U 198           H3*        U 198  13.511  33.476  -0.002
  414    H2*    U 198           H2*        U 198  12.196  31.659   0.657
  415   2HO*    U 198          2HO*        U 198  12.341  30.459  -1.900
  416    H1*    U 198           H1*        U 198  13.958  29.811  -0.780
  417    H3     U 198           H3         U 198  15.248  27.657   2.916
  418    H5     U 198           H5         U 198  14.232  31.440   4.398
  419    H6     U 198           H6         U 198  13.783  32.117   2.085
  420   1H5*    G 199          1H5*        G 199   9.861  36.759  -2.875
  421   2H5*    G 199          2H5*        G 199   9.594  36.637  -1.137
  422    H4*    G 199           H4*        G 199   7.459  36.696  -2.122
  423    H3*    G 199           H3*        G 199   8.267  34.000  -1.134
  424    H2*    G 199           H2*        G 199   6.236  33.017  -1.899
  425   2HO*    G 199          2HO*        G 199   4.679  34.526  -1.718
  426    H1*    G 199           H1*        G 199   6.484  34.083  -4.467
  427    H8     G 199           H8         G 199   9.276  32.664  -2.236
  428    H1     G 199           H1         G 199   7.565  28.984  -7.277
  429   1H2     G 199          1H2         G 199   6.039  29.904  -8.315
  430   2H2     G 199          2H2         G 199   5.328  31.442  -7.883
  431   1H5*    A 200          1H5*        A 200   8.011  36.672   2.558
  432   2H5*    A 200          2H5*        A 200   9.640  36.839   1.904
  433    H4*    A 200           H4*        A 200   9.387  36.383   4.408
  434    H3*    A 200           H3*        A 200  11.268  34.900   2.589
  435    H2*    A 200           H2*        A 200  12.130  33.709   4.455
  436   2HO*    A 200          2HO*        A 200  10.372  34.973   6.254
  437    H1*    A 200           H1*        A 200   9.607  33.048   5.452
  438    H8     A 200           H8         A 200   9.335  32.864   1.778
  439   1H6     A 200          1H6         A 200  11.843  27.157   2.105
  440   2H6     A 200          2H6         A 200  11.034  28.292   1.048
  441    H2     A 200           H2         A 200  12.271  29.096   6.081
  442   1H5*    C 201          1H5*        C 201  15.384  37.339   6.194
  443   2H5*    C 201          2H5*        C 201  15.361  35.862   5.231
  444    H4*    C 201           H4*        C 201  12.979  36.645   6.891
  445    H3*    C 201           H3*        C 201  15.517  35.355   7.899
  446    H2*    C 201           H2*        C 201  14.215  34.123   9.435
  447   2HO*    C 201          2HO*        C 201  12.943  36.073   9.836
  448    H1*    C 201           H1*        C 201  12.171  33.687   7.441
  449   1H4     C 201          1H4         C 201  14.948  27.988   8.189
  450   2H4     C 201          2H4         C 201  16.310  28.537   7.240
  451    H5     C 201           H5         C 201  16.560  30.750   6.456
  452    H6     C 201           H6         C 201  15.554  33.005   6.387
  453   1H5*    C 202          1H5*        C 202  13.666  37.313  11.418
  454   2H5*    C 202          2H5*        C 202  14.915  37.664  12.614
  455    H4*    C 202           H4*        C 202  13.177  36.130  13.448
  456    H3*    C 202           H3*        C 202  16.023  35.140  13.304
  457    H2*    C 202           H2*        C 202  15.364  33.181  14.450
  458   2HO*    C 202          2HO*        C 202  13.398  33.253  15.602
  459    H1*    C 202           H1*        C 202  12.958  32.970  12.903
  460   1H4     C 202          1H4         C 202  16.927  28.454  10.698
  461   2H4     C 202          2H4         C 202  17.601  29.639   9.602
  462    H5     C 202           H5         C 202  17.034  31.931   9.632
  463    H6     C 202           H6         C 202  15.667  33.669  10.732
  464   1H5*    C 203          1H5*        C 203  15.525  35.468  18.030
  465   2H5*    C 203          2H5*        C 203  17.232  35.655  18.431
  466    H4*    C 203           H4*        C 203  16.108  33.673  19.460
  467    H3*    C 203           H3*        C 203  18.569  33.357  17.755
  468    H2*    C 203           H2*        C 203  18.639  31.048  18.328
  469   2HO*    C 203          2HO*        C 203  17.303  30.359  20.061
  470    H1*    C 203           H1*        C 203  15.910  30.674  17.764
  471   1H4     C 203          1H4         C 203  18.938  28.868  12.435
  472   2H4     C 203          2H4         C 203  19.006  30.541  11.928
  473    H5     C 203           H5         C 203  18.304  32.353  13.270
  474    H6     C 203           H6         C 203  17.353  33.013  15.450
  475   1H5*    U 204          1H5*        U 204  18.910  31.724  21.413
  476   2H5*    U 204          2H5*        U 204  20.398  31.829  22.352
  477    H4*    U 204           H4*        U 204  19.756  29.530  22.158
  478    H3*    U 204           H3*        U 204  22.212  30.317  20.613
  479    H2*    U 204           H2*        U 204  22.551  28.042  20.002
  480   2HO*    U 204          2HO*        U 204  21.894  26.838  21.696
  481    H1*    U 204           H1*        U 204  19.916  27.691  19.153
  482    H3     U 204           H3         U 204  22.712  27.796  15.490
  483    H5     U 204           H5         U 204  21.627  31.776  16.213
  484    H6     U 204           H6         U 204  20.638  31.018  18.326
  485   1H5*    A 205          1H5*        A 205  24.430  28.841  24.592
  486   2H5*    A 205          2H5*        A 205  26.051  29.447  24.251
  487    H4*    A 205           H4*        A 205  25.557  26.933  23.954
  488    H3*    A 205           H3*        A 205  27.080  28.646  22.002
  489    H2*    A 205           H2*        A 205  27.543  26.718  20.697
  490   2HO*    A 205          2HO*        A 205  26.270  24.785  22.034
  491    H1*    A 205           H1*        A 205  24.894  25.813  20.750
  492    H8     A 205           H8         A 205  24.686  29.472  20.428
  493   1H6     A 205          1H6         A 205  25.739  28.788  14.314
  494   2H6     A 205          2H6         A 205  25.248  29.925  15.550
  495    H2     A 205           H2         A 205  26.540  24.898  16.307
  496   1H5*    G 206          1H5*        G 206  30.856  29.366  21.557
  497   2H5*    G 206          2H5*        G 206  29.756  29.549  20.190
  498    H4*    G 206           H4*        G 206  32.064  28.697  19.654
  499    H3*    G 206           H3*        G 206  29.569  27.263  18.787
  500    H2*    G 206           H2*        G 206  30.895  25.709  17.563
  501   2HO*    G 206          2HO*        G 206  32.604  26.823  16.795
  502    H1*    G 206           H1*        G 206  32.604  25.211  19.714
  503    H8     G 206           H8         G 206  29.188  25.650  21.084
  504    H1     G 206           H1         G 206  30.157  19.774  18.551
  505   1H2     G 206          1H2         G 206  31.925  19.764  17.489
  506   2H2     G 206          2H2         G 206  32.987  21.144  17.312
  507   1H5*    U 207          1H5*        U 207  28.714  27.588  14.221
  508   2H5*    U 207          2H5*        U 207  30.223  27.653  13.311
  509    H4*    U 207           H4*        U 207  28.213  29.178  12.652
  510    H3*    U 207           H3*        U 207  31.119  29.952  12.707
  511    H2*    U 207           H2*        U 207  30.563  32.097  11.860
  512   2HO*    U 207          2HO*        U 207  27.882  31.943  11.697
  513    H1*    U 207           H1*        U 207  28.493  32.514  13.680
  514    H3     U 207           H3         U 207  31.526  35.272  15.516
  515    H5     U 207           H5         U 207  33.242  31.493  16.075
  516    H6     U 207           H6         U 207  31.383  30.565  14.773
  517   1H5*    A 208          1H5*        A 208  31.761  30.285   7.405
  518   2H5*    A 208          2H5*        A 208  30.242  29.803   6.650
  519    H4*    A 208           H4*        A 208  31.980  28.504   5.680
  520    H3*    A 208           H3*        A 208  30.122  27.026   7.487
  521    H2*    A 208           H2*        A 208  31.308  24.986   7.172
  522   2HO*    A 208          2HO*        A 208  33.311  26.159   5.609
  523    H1*    A 208           H1*        A 208  33.789  26.143   7.743
  524    H8     A 208           H8         A 208  30.564  27.054   9.604
  525   1H6     A 208          1H6         A 208  32.721  23.349  14.139
  526   2H6     A 208          2H6         A 208  31.423  24.433  13.691
  527    H2     A 208           H2         A 208  35.568  23.177  10.731
  528   1H5*    G 209          1H5*        G 209  29.118  25.003   4.507
  529   2H5*    G 209          2H5*        G 209  27.437  24.472   4.452
  530    H4*    G 209           H4*        G 209  28.955  23.038   5.821
  531    H3*    G 209           H3*        G 209  26.472  24.259   6.991
  532    H2*    G 209           H2*        G 209  26.850  23.076   9.024
  533   2HO*    G 209          2HO*        G 209  29.258  21.940   8.366
  534    H1*    G 209           H1*        G 209  29.510  23.903   9.207
  535    H8     G 209           H8         G 209  27.597  26.753   7.833
  536    H1     G 209           H1         G 209  26.902  26.119  14.235
  537   1H2     G 209          1H2         G 209  27.670  24.302  14.835
  538   2H2     G 209          2H2         G 209  28.395  23.125  13.763
  539   1H5*    A 210          1H5*        A 210  26.663  20.351   8.665
  540   2H5*    A 210          2H5*        A 210  25.090  19.642   8.294
  541    H4*    A 210           H4*        A 210  25.527  19.472  10.655
  542    H3*    A 210           H3*        A 210  23.333  21.388   9.883
  543    H2*    A 210           H2*        A 210  22.803  21.654  12.181
  544   2HO*    A 210          2HO*        A 210  24.571  20.118  13.423
  545    H1*    A 210           H1*        A 210  25.511  21.968  12.922
  546    H8     A 210           H8         A 210  24.748  23.819   9.774
  547   1H6     A 210          1H6         A 210  22.929  28.582  13.376
  548   2H6     A 210          2H6         A 210  23.280  28.101  11.731
  549    H2     A 210           H2         A 210  23.588  25.041  15.980
  550   1H5*    G 211          1H5*        G 211  21.791  18.318  12.646
  551   2H5*    G 211          2H5*        G 211  20.132  17.923  12.199
  552    H4*    G 211           H4*        G 211  20.322  18.532  14.558
  553    H3*    G 211           H3*        G 211  18.659  20.279  12.765
  554    H2*    G 211           H2*        G 211  17.972  21.554  14.657
  555   2HO*    G 211          2HO*        G 211  19.630  19.966  16.332
  556    H1*    G 211           H1*        G 211  20.585  21.896  15.584
  557    H8     G 211           H8         G 211  20.841  22.098  11.925
  558    H1     G 211           H1         G 211  18.395  27.499  14.521
  559   1H2     G 211          1H2         G 211  17.897  27.151  16.492
  560   2H2     G 211          2H2         G 211  18.110  25.625  17.317
  561   1H5*    G 212          1H5*        G 212  15.128  18.828  15.848
  562   2H5*    G 212          2H5*        G 212  14.008  18.649  14.497
  563    H4*    G 212           H4*        G 212  13.221  20.136  16.348
  564    H3*    G 212           H3*        G 212  13.366  21.098  13.504
  565    H2*    G 212           H2*        G 212  12.347  23.152  14.154
  566   2HO*    G 212          2HO*        G 212  11.994  23.058  16.709
  567    H1*    G 212           H1*        G 212  14.113  23.552  16.279
  568    H8     G 212           H8         G 212  16.002  22.021  13.468
  569    H1     G 212           H1         G 212  15.124  28.395  12.771
  570   1H2     G 212          1H2         G 212  13.766  29.061  14.173
  571   2H2     G 212          2H2         G 212  12.981  28.044  15.360
  572   1H5*    G 213          1H5*        G 213   9.074  21.451  14.750
  573   2H5*    G 213          2H5*        G 213   8.079  21.175  13.321
  574    H4*    G 213           H4*        G 213   7.651  23.349  14.402
  575    H3*    G 213           H3*        G 213   8.598  23.252  11.555
  576    H2*    G 213           H2*        G 213   8.375  25.618  11.390
  577   2HO*    G 213          2HO*        G 213   6.537  25.871  12.641
  578    H1*    G 213           H1*        G 213   9.808  26.080  13.748
  579    H8     G 213           H8         G 213  11.521  23.260  12.141
  580    H1     G 213           H1         G 213  12.867  28.902   9.271
  581   1H2     G 213          1H2         G 213  11.561  30.347   9.946
  582   2H2     G 213          2H2         G 213  10.290  30.072  11.116
  583   1H5*    G 214          1H5*        G 214   7.160  26.311   9.880
  584   2H5*    G 214          2H5*        G 214   5.987  25.554   8.803
  585    H4*    G 214           H4*        G 214   7.824  26.626   7.584
  586    H3*    G 214           H3*        G 214   7.436  23.659   7.319
  587    H2*    G 214           H2*        G 214   9.170  23.575   5.687
  588   2HO*    G 214          2HO*        G 214  10.066  25.713   5.069
  589    H1*    G 214           H1*        G 214  10.971  24.998   7.268
  590    H8     G 214           H8         G 214   9.090  22.910   9.638
  591    H1     G 214           H1         G 214  13.493  19.517   6.323
  592   1H2     G 214          1H2         G 214  14.194  20.651   4.750
  593   2H2     G 214          2H2         G 214  13.668  22.278   4.384
  594   1H5*    G 215          1H5*        G 215   7.223  25.014   3.114
  595   2H5*    G 215          2H5*        G 215   5.877  24.113   2.414
  596    H4*    G 215           H4*        G 215   8.040  23.836   1.217
  597    H3*    G 215           H3*        G 215   6.586  21.443   2.322
  598    H2*    G 215           H2*        G 215   8.171  20.018   1.258
  599   2HO*    G 215          2HO*        G 215   9.202  20.874  -0.476
  600    H1*    G 215           H1*        G 215  10.360  21.472   2.248
  601    H8     G 215           H8         G 215   7.935  21.362   5.001
  602    H1     G 215           H1         G 215  11.045  15.736   4.250
  603   1H2     G 215          1H2         G 215  12.056  15.743   2.453
  604   2H2     G 215          2H2         G 215  12.060  17.074   1.318
  605   1H5*    C 216          1H5*        C 216   4.693  21.359  -2.072
  606   2H5*    C 216          2H5*        C 216   3.277  20.353  -1.765
  607    H4*    C 216           H4*        C 216   5.201  19.332  -3.093
  608    H3*    C 216           H3*        C 216   3.894  17.981  -0.739
  609    H2*    C 216           H2*        C 216   5.189  16.038  -1.169
  610   2HO*    C 216          2HO*        C 216   5.405  15.843  -3.322
  611    H1*    C 216           H1*        C 216   7.579  17.487  -1.467
  612   1H4     C 216          1H4         C 216   7.440  15.386   4.590
  613   2H4     C 216          2H4         C 216   6.747  16.925   5.050
  614    H5     C 216           H5         C 216   6.073  18.579   3.504
  615    H6     C 216           H6         C 216   5.896  19.169   1.113
  616   1H5*    U 217          1H5*        U 217   2.059  14.642  -3.573
  617   2H5*    U 217          2H5*        U 217   1.137  14.009  -2.210
  618    H4*    U 217           H4*        U 217   3.395  12.886  -3.269
  619    H3*    U 217           H3*        U 217   2.047  12.568  -0.599
  620    H2*    U 217           H2*        U 217   3.758  11.071   0.081
  621   2HO*    U 217          2HO*        U 217   5.151  10.255  -1.565
  622    H1*    U 217           H1*        U 217   5.839  12.714  -0.764
  623    H3     U 217           H3         U 217   5.717  12.835   3.822
  624    H5     U 217           H5         U 217   3.004  15.768   2.566
  625    H6     U 217           H6         U 217   3.274  14.901   0.288
  626   1H5*    G 218          1H5*        G 218  -0.690   8.291  -1.091
  627   2H5*    G 218          2H5*        G 218   0.525   9.381  -0.426
  628    H4*    G 218           H4*        G 218   1.045   6.908  -1.388
  629    H3*    G 218           H3*        G 218   2.859   9.324  -1.244
  630    H2*    G 218           H2*        G 218   4.611   7.967  -2.032
  631   2HO*    G 218          2HO*        G 218   4.196   6.216  -0.676
  632    H1*    G 218           H1*        G 218   2.826   6.554  -3.818
  633    H8     G 218           H8         G 218   2.785  10.283  -4.111
  634    H1     G 218           H1         G 218   7.392   7.450  -7.663
  635   1H2     G 218          1H2         G 218   7.524   5.455  -7.157
  636   2H2     G 218          2H2         G 218   6.534   4.668  -5.949
  637   1H5*    C 219          1H5*        C 219   4.263   6.910   1.615
  638   2H5*    C 219          2H5*        C 219   4.065   5.423   2.542
  639    H4*    C 219           H4*        C 219   4.831   6.633   4.257
  640    H3*    C 219           H3*        C 219   1.951   7.405   4.125
  641    H2*    C 219           H2*        C 219   2.231   9.127   5.715
  642   2HO*    C 219          2HO*        C 219   4.202   9.113   6.942
  643    H1*    C 219           H1*        C 219   4.559  10.158   4.549
  644   1H4     C 219          1H4         C 219  -0.532  13.436   2.324
  645   2H4     C 219          2H4         C 219  -0.223  12.649   0.793
  646    H5     C 219           H5         C 219   1.352  10.914   0.497
  647    H6     C 219           H6         C 219   3.035   9.492   1.611
  648   1H5*    G 220          1H5*        G 220   4.906   3.520   6.069
  649   2H5*    G 220          2H5*        G 220   5.171   5.233   5.745
  650    H4*    G 220           H4*        G 220   6.589   2.967   4.740
  651    H3*    G 220           H3*        G 220   6.909   5.961   4.436
  652    H2*    G 220           H2*        G 220   8.686   5.546   2.957
  653   2HO*    G 220          2HO*        G 220   8.548   2.761   3.540
  654    H1*    G 220           H1*        G 220   7.315   3.231   1.860
  655    H8     G 220           H8         G 220   6.921   3.839  -0.550
  656    H1     G 220           H1         G 220   6.635  10.171   0.757
  657   1H2     G 220          1H2         G 220   6.757  10.460   2.796
  658   2H2     G 220          2H2         G 220   6.915   9.177   3.975
  659   1H5*    G 221          1H5*        G 221  10.264   4.903   5.107
  660   2H5*    G 221          2H5*        G 221  11.420   5.691   6.180
  661    H4*    G 221           H4*        G 221  11.901   5.761   3.684
  662    H3*    G 221           H3*        G 221  11.986   8.149   5.494
  663    H2*    G 221           H2*        G 221  12.673   9.534   3.683
  664   2HO*    G 221          2HO*        G 221  12.527   7.211   2.016
  665    H1*    G 221           H1*        G 221  10.641   8.707   1.997
  666    H8     G 221           H8         G 221  10.051   8.976   5.770
  667    H1     G 221           H1         G 221   8.037  14.040   2.281
  668   1H2     G 221          1H2         G 221   8.571  13.773   0.307
  669   2H2     G 221          2H2         G 221   9.436  12.383  -0.311
  670   1H5*    C 222          1H5*        C 222  16.069   8.016   3.825
  671   2H5*    C 222          2H5*        C 222  17.134   8.938   4.887
  672    H4*    C 222           H4*        C 222  16.677   9.903   2.586
  673    H3*    C 222           H3*        C 222  16.337  11.490   5.124
  674    H2*    C 222           H2*        C 222  15.917  13.432   3.825
  675   2HO*    C 222          2HO*        C 222  16.040  12.531   1.322
  676    H1*    C 222           H1*        C 222  14.104  12.111   2.129
  677   1H4     C 222          1H4         C 222  10.435  14.952   6.518
  678   2H4     C 222          2H4         C 222  10.719  13.609   7.604
  679    H5     C 222           H5         C 222  12.207  11.834   7.140
  680    H6     C 222           H6         C 222  13.803  10.901   5.503
  681   1H5*    U 223          1H5*        U 223  19.532  13.768   3.210
  682   2H5*    U 223          2H5*        U 223  20.280  14.760   4.461
  683    H4*    U 223           H4*        U 223  18.675  15.793   2.641
  684    H3*    U 223           H3*        U 223  18.874  16.571   5.551
  685    H2*    U 223           H2*        U 223  17.350  18.329   5.142
  686   2HO*    U 223          2HO*        U 223  17.954  19.138   3.202
  687    H1*    U 223           H1*        U 223  15.630  16.742   3.571
  688    H3     U 223           H3         U 223  13.541  17.952   7.513
  689    H5     U 223           H5         U 223  15.559  14.371   8.316
  690    H6     U 223           H6         U 223  16.660  14.617   6.139
  691   1H5*    U 224          1H5*        U 224  19.504  15.812   0.276
  692   2H5*    U 224          2H5*        U 224  19.711  17.444  -0.358
  693    H4*    U 224           H4*        U 224  17.508  15.818  -0.698
  694    H3*    U 224           H3*        U 224  17.846  18.807  -1.035
  695    H2*    U 224           H2*        U 224  15.616  18.899  -1.768
  696   2HO*    U 224          2HO*        U 224  14.782  17.059  -2.734
  697    H1*    U 224           H1*        U 224  14.829  16.853   0.131
  698    H3     U 224           H3         U 224  11.980  20.245   1.113
  699    H5     U 224           H5         U 224  15.700  21.625   2.453
  700    H6     U 224           H6         U 224  16.701  19.650   1.400
  701   1H5*    A 225          1H5*        A 225  18.981  17.812  -5.697
  702   2H5*    A 225          2H5*        A 225  19.312  19.485  -6.147
  703    H4*    A 225           H4*        A 225  17.160  18.347  -7.006
  704    H3*    A 225           H3*        A 225  17.330  21.127  -5.866
  705    H2*    A 225           H2*        A 225  15.034  21.463  -6.370
  706   2HO*    A 225          2HO*        A 225  14.099  20.088  -7.881
  707    H1*    A 225           H1*        A 225  14.230  19.026  -5.263
  708    H8     A 225           H8         A 225  17.012  20.852  -3.446
  709   1H6     A 225          1H6         A 225  12.502  23.393   0.038
  710   2H6     A 225          2H6         A 225  14.234  23.244  -0.148
  711    H2     A 225           H2         A 225  10.590  21.066  -3.228
  712   1H5*    G 226          1H5*        G 226  15.846  20.643  -9.607
  713   2H5*    G 226          2H5*        G 226  15.947  21.788 -10.944
  714    H4*    G 226           H4*        G 226  13.648  21.254 -10.556
  715    H3*    G 226           H3*        G 226  14.457  24.043  -9.775
  716    H2*    G 226           H2*        G 226  12.180  24.555  -9.296
  717   2HO*    G 226          2HO*        G 226  10.786  23.395 -10.488
  718    H1*    G 226           H1*        G 226  11.829  22.260  -7.733
  719    H8     G 226           H8         G 226  15.220  23.424  -6.954
  720    H1     G 226           H1         G 226  10.674  27.041  -4.100
  721   1H2     G 226          1H2         G 226   8.832  26.599  -4.913
  722   2H2     G 226          2H2         G 226   8.559  25.423  -6.180
  723   1H5*    G 227          1H5*        G 227  12.412  26.245 -12.655
  724   2H5*    G 227          2H5*        G 227  13.058  25.348 -14.029
  725    H4*    G 227           H4*        G 227  12.725  27.800 -14.408
  726    H3*    G 227           H3*        G 227  15.382  26.472 -14.860
  727    H2*    G 227           H2*        G 227  16.259  28.520 -15.706
  728   2HO*    G 227          2HO*        G 227  14.414  30.299 -15.536
  729    H1*    G 227           H1*        G 227  15.354  30.010 -13.530
  730    H8     G 227           H8         G 227  16.383  26.780 -12.108
  731    H1     G 227           H1         G 227  21.435  30.559 -13.548
  732   1H2     G 227          1H2         G 227  20.802  32.144 -14.707
  733   2H2     G 227          2H2         G 227  19.148  32.408 -15.212
  734   1H5*    A 228          1H5*        A 228  14.601  28.217 -18.914
  735   2H5*    A 228          2H5*        A 228  15.000  26.882 -19.994
  736    H4*    A 228           H4*        A 228  16.258  28.878 -20.569
  737    H3*    A 228           H3*        A 228  17.797  26.498 -19.575
  738    H2*    A 228           H2*        A 228  19.844  27.642 -19.971
  739   2HO*    A 228          2HO*        A 228  19.415  29.924 -20.919
  740    H1*    A 228           H1*        A 228  18.987  29.969 -18.661
  741    H8     A 228           H8         A 228  17.795  26.884 -16.904
  742   1H6     A 228          1H6         A 228  23.217  26.951 -13.813
  743   2H6     A 228          2H6         A 228  21.643  26.193 -13.898
  744    H2     A 228           H2         A 228  23.420  29.996 -17.043
  745   1H5*    G 229          1H5*        G 229  19.442  27.579 -23.487
  746   2H5*    G 229          2H5*        G 229  19.730  26.105 -24.412
  747    H4*    G 229           H4*        G 229  21.736  27.430 -24.360
  748    H3*    G 229           H3*        G 229  21.820  24.849 -22.823
  749    H2*    G 229           H2*        G 229  24.130  25.206 -22.357
  750   2HO*    G 229          2HO*        G 229  25.177  26.906 -23.509
  751    H1*    G 229           H1*        G 229  23.718  27.817 -21.458
  752    H8     G 229           H8         G 229  20.800  25.901 -20.287
  753    H1     G 229           H1         G 229  26.082  24.794 -16.715
  754   1H2     G 229          1H2         G 229  27.736  25.569 -17.672
  755   2H2     G 229          2H2         G 229  27.698  26.395 -19.213
  756   1H5*    G 230          1H5*        G 230  25.295  24.853 -25.632
  757   2H5*    G 230          2H5*        G 230  25.303  23.241 -26.349
  758    H4*    G 230           H4*        G 230  27.495  23.784 -25.497
  759    H3*    G 230           H3*        G 230  26.010  21.584 -24.091
  760    H2*    G 230           H2*        G 230  27.915  21.167 -22.724
  761   2HO*    G 230          2HO*        G 230  29.622  23.065 -23.464
  762    H1*    G 230           H1*        G 230  28.216  23.851 -22.025
  763    H8     G 230           H8         G 230  24.580  23.229 -22.198
  764    H1     G 230           H1         G 230  27.244  20.967 -16.750
  765   1H2     G 230          1H2         G 230  29.298  20.999 -16.922
  766   2H2     G 230          2H2         G 230  30.170  21.556 -18.334
  767   1H5*    G 231          1H5*        G 231  29.976  20.173 -25.015
  768   2H5*    G 231          2H5*        G 231  29.825  18.612 -25.822
  769    H4*    G 231           H4*        G 231  31.431  18.382 -24.083
  770    H3*    G 231           H3*        G 231  28.807  17.031 -23.537
  771    H2*    G 231           H2*        G 231  29.685  16.134 -21.511
  772   2HO*    G 231          2HO*        G 231  31.925  16.200 -21.234
  773    H1*    G 231           H1*        G 231  30.640  18.603 -20.630
  774    H8     G 231           H8         G 231  27.429  19.206 -22.385
  775    H1     G 231           H1         G 231  26.638  17.029 -16.342
  776   1H2     G 231          1H2         G 231  28.449  16.372 -15.605
  777   2H2     G 231          2H2         G 231  29.956  16.405 -16.491
  778   1H5*    C 232          1H5*        C 232  31.776  14.079 -23.022
  779   2H5*    C 232          2H5*        C 232  31.270  12.499 -23.621
  780    H4*    C 232           H4*        C 232  31.832  12.378 -21.270
  781    H3*    C 232           H3*        C 232  28.939  11.952 -21.984
  782    H2*    C 232           H2*        C 232  28.484  11.384 -19.723
  783   2HO*    C 232          2HO*        C 232  30.275  10.918 -18.381
  784    H1*    C 232           H1*        C 232  29.926  13.595 -18.725
  785   1H4     C 232          1H4         C 232  23.814  15.455 -18.680
  786   2H4     C 232          2H4         C 232  23.949  15.882 -20.372
  787    H5     C 232           H5         C 232  25.862  15.448 -21.689
  788    H6     C 232           H6         C 232  28.137  14.488 -21.706
  789   1H5*    A 233          1H5*        A 233  30.237   8.596 -19.773
  790   2H5*    A 233          2H5*        A 233  29.814   7.088 -20.582
  791    H4*    A 233           H4*        A 233  29.042   6.838 -18.389
  792    H3*    A 233           H3*        A 233  26.808   7.507 -20.282
  793    H2*    A 233           H2*        A 233  25.234   7.317 -18.511
  794   2HO*    A 233          2HO*        A 233  27.171   6.793 -16.562
  795    H1*    A 233           H1*        A 233  26.693   8.931 -16.770
  796    H8     A 233           H8         A 233  26.877  10.024 -20.379
  797   1H6     A 233          1H6         A 233  21.887  13.568 -19.155
  798   2H6     A 233          2H6         A 233  23.101  13.197 -20.359
  799    H2     A 233           H2         A 233  22.665  10.993 -15.618
  800   1H5*    G 234          1H5*        G 234  25.740   3.860 -18.059
  801   2H5*    G 234          2H5*        G 234  25.088   2.694 -19.210
  802    H4*    G 234           H4*        G 234  23.582   2.885 -17.360
  803    H3*    G 234           H3*        G 234  22.600   4.033 -19.953
  804    H2*    G 234           H2*        G 234  20.495   4.524 -18.951
  805   2HO*    G 234          2HO*        G 234  20.117   3.649 -16.838
  806    H1*    G 234           H1*        G 234  21.646   5.805 -16.755
  807    H8     G 234           H8         G 234  23.681   6.594 -19.763
  808    H1     G 234           H1         G 234  18.341  10.215 -19.284
  809   1H2     G 234          1H2         G 234  17.118   9.450 -17.810
  810   2H2     G 234          2H2         G 234  17.487   8.036 -16.847
  811   1H    GLY  15          1H        GLY  15   6.594  -2.747  -4.182
  812   1HA   GLY  15          1HA       GLY  15   6.260  -1.740  -1.783
  813   2HA   GLY  15          2HA       GLY  15   7.883  -2.173  -2.300
  814    H    ARG  16           H        ARG  16   9.233  -0.653  -1.604
  815    HA   ARG  16           HA       ARG  16   8.625   1.943  -0.895
  816   1HB   ARG  16          2HB       ARG  16  11.067   0.422  -1.445
  817   2HB   ARG  16          3HB       ARG  16  11.234   2.147  -1.745
  818   1HG   ARG  16          2HG       ARG  16  10.973   2.698   0.453
  819   2HG   ARG  16          3HG       ARG  16   9.983   1.279   0.805
  820   1HD   ARG  16          2HD       ARG  16  12.013  -0.129   0.550
  821   2HD   ARG  16          3HD       ARG  16  12.964   1.343   0.353
  822    HE   ARG  16           HE       ARG  16  12.889   1.635   2.616
  823   1HH1  ARG  16          2HH1      ARG  16  10.367  -0.577   1.687
  824   2HH1  ARG  16          1HH1      ARG  16   9.918  -0.954   3.317
  825   1HH2  ARG  16          2HH2      ARG  16  12.308   1.147   4.767
  826   2HH2  ARG  16          1HH2      ARG  16  11.022   0.027   5.068
  827    H    ALA  17           H        ALA  17  10.125   0.886  -3.954
  828    HA   ALA  17           HA       ALA  17  10.114   1.787  -6.044
  829   1HB   ALA  17          1HB       ALA  17   7.652   1.728  -5.683
  830   2HB   ALA  17          2HB       ALA  17   7.741   3.396  -5.117
  831   3HB   ALA  17          3HB       ALA  17   8.185   3.004  -6.778
  832    H    ARG  18           H        ARG  18  11.273   3.216  -3.549
  833    HA   ARG  18           HA       ARG  18  11.278   5.968  -3.920
  834   1HB   ARG  18          2HB       ARG  18  12.298   4.560  -2.018
  835   2HB   ARG  18          3HB       ARG  18  13.725   4.456  -3.040
  836   1HG   ARG  18          2HG       ARG  18  12.506   7.098  -2.322
  837   2HG   ARG  18          3HG       ARG  18  13.652   6.282  -1.256
  838   1HD   ARG  18          2HD       ARG  18  14.769   6.199  -3.834
  839   2HD   ARG  18          3HD       ARG  18  14.149   7.835  -3.618
  840    HE   ARG  18           HE       ARG  18  15.535   7.211  -1.308
  841   1HH1  ARG  18          2HH1      ARG  18  16.226   7.528  -4.706
  842   2HH1  ARG  18          1HH1      ARG  18  17.868   8.023  -4.459
  843   1HH2  ARG  18          2HH2      ARG  18  17.695   7.861  -0.971
  844   2HH2  ARG  18          1HH2      ARG  18  18.702   8.211  -2.335
  845    H    GLY  19           H        GLY  19  12.174   7.314  -5.359
  846   1HA   GLY  19          1HA       GLY  19  13.894   8.032  -6.829
  847   2HA   GLY  19          2HA       GLY  19  14.390   6.358  -7.025
  848    H    LEU  20           H        LEU  20  11.462   5.643  -7.390
  849    HA   LEU  20           HA       LEU  20  11.371   6.312 -10.245
  850   1HB   LEU  20          2HB       LEU  20  10.570   3.991  -8.621
  851   2HB   LEU  20          3HB       LEU  20   9.469   4.415  -9.930
  852    HG   LEU  20           HG       LEU  20  12.259   4.299 -10.774
  853   1HD1  LEU  20          1HD1      LEU  20  12.347   1.818 -10.720
  854   2HD1  LEU  20          2HD1      LEU  20  10.946   1.831  -9.650
  855   3HD1  LEU  20          3HD1      LEU  20  12.460   2.568  -9.128
  856   1HD2  LEU  20          1HD2      LEU  20  11.096   2.679 -12.420
  857   2HD2  LEU  20          2HD2      LEU  20  10.690   4.395 -12.479
  858   3HD2  LEU  20          3HD2      LEU  20   9.602   3.258 -11.680
  859    H    CYS  21           H        CYS  21   9.953   7.872 -10.935
  860    HA   CYS  21           HA       CYS  21   8.073   8.942  -9.144
  861   1HB   CYS  21          2HB       CYS  21   9.190  10.208 -10.991
  862   2HB   CYS  21          3HB       CYS  21   8.224   9.319 -12.153
  863    H    TYR  22           H        TYR  22   5.785   8.843  -9.334
  864    HA   TYR  22           HA       TYR  22   4.769   6.410 -10.650
  865   1HB   TYR  22          2HB       TYR  22   4.421   5.924  -8.427
  866   2HB   TYR  22          3HB       TYR  22   4.222   7.613  -7.976
  867    HD1  TYR  22           HD1      TYR  22   2.500   5.013 -10.042
  868    HD2  TYR  22           HD2      TYR  22   2.106   8.321  -7.396
  869    HE1  TYR  22           HE1      TYR  22   0.059   4.720 -10.050
  870    HE2  TYR  22           HE2      TYR  22  -0.337   8.038  -7.396
  871    HH   TYR  22           HH       TYR  22  -1.917   5.688  -7.957
  872    H    THR  23           H        THR  23   4.422   9.816 -10.231
  873    HA   THR  23           HA       THR  23   1.756  10.119 -11.116
  874    HB   THR  23           HB       THR  23   4.059  12.071 -11.313
  875    HG1  THR  23           HG1      THR  23   3.741  11.840  -9.188
  876   1HG2  THR  23          1HG2      THR  23   2.606  13.206 -12.609
  877   2HG2  THR  23          2HG2      THR  23   1.789  13.561 -11.087
  878   3HG2  THR  23          3HG2      THR  23   1.232  12.227 -12.098
  879    H    CYS  24           H        CYS  24   4.921  10.165 -12.884
  880    HA   CYS  24           HA       CYS  24   3.335  10.141 -15.345
  881   1HB   CYS  24          2HB       CYS  24   5.275  11.052 -16.492
  882   2HB   CYS  24          3HB       CYS  24   4.833  12.086 -15.148
  883    H    GLY  25           H        GLY  25   5.946   8.723 -13.462
  884   1HA   GLY  25          1HA       GLY  25   6.314   6.356 -13.403
  885   2HA   GLY  25          2HA       GLY  25   5.734   6.262 -15.059
  886    H    SER  26           H        SER  26   8.066   8.607 -13.859
  887    HA   SER  26           HA       SER  26  10.017   7.530 -15.763
  888   1HB   SER  26          2HB       SER  26   9.277  10.003 -15.737
  889   2HB   SER  26          3HB       SER  26  10.282  10.147 -14.295
  890    HG   SER  26           HG       SER  26  11.020   9.698 -16.951
  891    HA   PRO  27           HA       PRO  27  12.155   5.789 -12.255
  892   1HB   PRO  27          2HB       PRO  27  14.178   4.695 -13.698
  893   2HB   PRO  27          3HB       PRO  27  12.569   3.973 -13.600
  894   1HG   PRO  27          2HG       PRO  27  13.754   5.677 -15.759
  895   2HG   PRO  27          3HG       PRO  27  12.769   4.209 -15.906
  896   1HD   PRO  27          2HD       PRO  27  11.740   6.692 -16.231
  897   2HD   PRO  27          3HD       PRO  27  10.794   5.347 -15.560
  898    H    GLY  28           H        GLY  28  12.786   7.801 -11.328
  899   1HA   GLY  28          1HA       GLY  28  15.484   8.271 -11.088
  900   2HA   GLY  28          2HA       GLY  28  14.957   9.330 -12.387
  901    H    HIS  29           H        HIS  29  12.815  10.539 -11.769
  902    HA   HIS  29           HA       HIS  29  13.377  11.866  -9.224
  903   1HB   HIS  29          2HB       HIS  29  12.078  13.715 -10.062
  904   2HB   HIS  29          3HB       HIS  29  13.204  13.215 -11.321
  905    HD1  HIS  29           HD1      HIS  29  12.213  12.833 -13.559
  906    HD2  HIS  29           HD2      HIS  29   9.365  12.632 -10.542
  907    HE1  HIS  29           HE1      HIS  29  10.005  12.574 -14.736
  908    H    TYR  30           H        TYR  30  11.068  12.941  -8.461
  909    HA   TYR  30           HA       TYR  30   9.171  10.709  -8.184
  910   1HB   TYR  30          2HB       TYR  30  10.827  11.719  -6.143
  911   2HB   TYR  30          3HB       TYR  30   9.216  12.344  -5.808
  912    HD1  TYR  30           HD1      TYR  30  10.892   9.138  -6.750
  913    HD2  TYR  30           HD2      TYR  30   7.780  11.038  -4.557
  914    HE1  TYR  30           HE1      TYR  30  10.259   6.968  -5.778
  915    HE2  TYR  30           HE2      TYR  30   7.139   8.874  -3.579
  916    HH   TYR  30           HH       TYR  30   8.707   6.486  -3.209
  917    H    GLN  31           H        GLN  31   7.100  11.614  -7.014
  918    HA   GLN  31           HA       GLN  31   5.791  13.306  -8.755
  919   1HB   GLN  31          2HB       GLN  31   4.524  11.929  -7.268
  920   2HB   GLN  31          3HB       GLN  31   5.237  12.695  -5.853
  921   1HG   GLN  31          2HG       GLN  31   3.919  14.552  -6.017
  922   2HG   GLN  31          3HG       GLN  31   3.710  14.386  -7.760
  923   1HE2  GLN  31          1HE2      GLN  31   1.661  14.866  -5.841
  924   2HE2  GLN  31          2HE2      GLN  31   0.572  13.526  -5.901
  925    H    ALA  32           H        ALA  32   7.442  14.111  -5.729
  926    HA   ALA  32           HA       ALA  32   6.721  16.808  -5.577
  927   1HB   ALA  32          1HB       ALA  32   9.345  15.634  -4.674
  928   2HB   ALA  32          2HB       ALA  32   8.540  17.074  -4.049
  929   3HB   ALA  32          3HB       ALA  32   7.832  15.480  -3.780
  930    H    GLN  33           H        GLN  33   8.938  15.183  -7.663
  931    HA   GLN  33           HA       GLN  33   9.821  17.787  -8.719
  932   1HB   GLN  33          2HB       GLN  33  11.394  15.209  -8.595
  933   2HB   GLN  33          3HB       GLN  33  11.927  16.673  -9.411
  934   1HG   GLN  33          2HG       GLN  33  12.997  17.016  -7.466
  935   2HG   GLN  33          3HG       GLN  33  11.439  17.685  -6.987
  936   1HE2  GLN  33          1HE2      GLN  33  12.778  17.022  -4.926
  937   2HE2  GLN  33          2HE2      GLN  33  12.330  15.493  -4.260
  938    H    CYS  34           H        CYS  34   7.468  15.986  -9.466
  939    HA   CYS  34           HA       CYS  34   8.265  14.879 -11.979
  940   1HB   CYS  34          2HB       CYS  34   6.473  13.892 -10.522
  941   2HB   CYS  34          3HB       CYS  34   5.463  15.277 -10.883
  942    HA   PRO  35           HA       PRO  35   7.876  18.803 -14.068
  943   1HB   PRO  35          2HB       PRO  35   8.192  17.822 -16.579
  944   2HB   PRO  35          3HB       PRO  35   9.538  18.027 -15.452
  945   1HG   PRO  35          2HG       PRO  35   7.996  15.553 -16.132
  946   2HG   PRO  35          3HG       PRO  35   9.745  15.759 -15.923
  947   1HD   PRO  35          2HD       PRO  35   8.160  14.716 -13.990
  948   2HD   PRO  35          3HD       PRO  35   9.607  15.677 -13.623
  949    H    LYS  36           H        LYS  36   5.776  16.123 -14.300
  950    HA   LYS  36           HA       LYS  36   3.930  17.526 -16.091
  951   1HB   LYS  36          2HB       LYS  36   3.573  14.760 -14.946
  952   2HB   LYS  36          3HB       LYS  36   2.781  15.461 -16.352
  953   1HG   LYS  36          2HG       LYS  36   5.437  15.623 -17.015
  954   2HG   LYS  36          3HG       LYS  36   5.345  14.100 -16.128
  955   1HD   LYS  36          2HD       LYS  36   3.602  14.884 -18.467
  956   2HD   LYS  36          3HD       LYS  36   4.978  13.780 -18.534
  957   1HE   LYS  36          2HE       LYS  36   3.631  12.101 -17.991
  958   2HE   LYS  36          3HE       LYS  36   3.296  12.888 -16.448
  959   1HZ   LYS  36          1HZ       LYS  36   1.591  14.226 -17.760
  960   2HZ   LYS  36          2HZ       LYS  36   1.219  12.611 -17.423
  961   3HZ   LYS  36          3HZ       LYS  36   1.758  13.050 -18.965
  962    H    LYS  37           H        LYS  37   4.588  17.502 -12.903
  963    HA   LYS  37           HA       LYS  37   1.869  17.371 -11.905
  964   1HB   LYS  37          2HB       LYS  37   4.576  17.523 -10.732
  965   2HB   LYS  37          3HB       LYS  37   3.312  18.336  -9.819
  966   1HG   LYS  37          2HG       LYS  37   3.160  15.470 -10.720
  967   2HG   LYS  37          3HG       LYS  37   3.729  15.986  -9.130
  968   1HD   LYS  37          2HD       LYS  37   1.080  16.958 -10.087
  969   2HD   LYS  37          3HD       LYS  37   1.216  15.290  -9.526
  970   1HE   LYS  37          2HE       LYS  37   0.801  16.203  -7.510
  971   2HE   LYS  37          3HE       LYS  37   2.522  16.585  -7.547
  972   1HZ   LYS  37          1HZ       LYS  37   2.122  18.776  -7.993
  973   2HZ   LYS  37          2HZ       LYS  37   0.771  18.424  -7.039
  974   3HZ   LYS  37          3HZ       LYS  37   0.623  18.488  -8.723
  975    H    ARG  38           H        ARG  38   4.150  19.760 -12.947
  976    HA   ARG  38           HA       ARG  38   2.167  21.807 -12.936
  977   1HB   ARG  38          2HB       ARG  38   2.874  21.764 -10.527
  978   2HB   ARG  38          3HB       ARG  38   4.492  22.212 -11.051
  979   1HG   ARG  38          2HG       ARG  38   3.866  24.326 -10.835
  980   2HG   ARG  38          3HG       ARG  38   2.840  24.088 -12.250
  981   1HD   ARG  38          2HD       ARG  38   0.937  23.914 -11.013
  982   2HD   ARG  38          3HD       ARG  38   1.772  23.204  -9.631
  983    HE   ARG  38           HE       ARG  38   2.472  25.946 -10.058
  984   1HH1  ARG  38          2HH1      ARG  38   0.100  23.815  -8.657
  985   2HH1  ARG  38          1HH1      ARG  38  -0.438  24.973  -7.486
  986   1HH2  ARG  38          2HH2      ARG  38   1.770  27.478  -8.519
  987   2HH2  ARG  38          1HH2      ARG  38   0.512  27.056  -7.409
  988    H    LYS  39           H        LYS  39   2.691  23.455 -14.311
  989    HA   LYS  39           HA       LYS  39   5.397  23.382 -15.478
  990   1HB   LYS  39          2HB       LYS  39   3.099  22.734 -16.794
  991   2HB   LYS  39          3HB       LYS  39   3.220  24.451 -17.156
  992   1HG   LYS  39          2HG       LYS  39   5.787  23.407 -17.559
  993   2HG   LYS  39          3HG       LYS  39   4.668  22.245 -18.278
  994   1HD   LYS  39          2HD       LYS  39   3.793  23.822 -19.757
  995   2HD   LYS  39          3HD       LYS  39   4.386  25.184 -18.803
  996   1HE   LYS  39          2HE       LYS  39   6.730  24.242 -19.363
  997   2HE   LYS  39          3HE       LYS  39   5.895  23.360 -20.640
  998   1HZ   LYS  39          1HZ       LYS  39   6.485  26.189 -20.429
  999   2HZ   LYS  39          2HZ       LYS  39   4.940  25.821 -21.009
 1000   3HZ   LYS  39          3HZ       LYS  39   6.306  25.219 -21.803
 1001    H    SER  40           H        SER  40   5.423  25.578 -17.004
 1002    HA   SER  40           HA       SER  40   4.302  27.919 -15.957
 1003   1HB   SER  40          2HB       SER  40   5.541  27.626 -13.949
 1004   2HB   SER  40          3HB       SER  40   7.000  27.170 -14.827
 1005    HG   SER  40           HG       SER  40   7.419  29.226 -14.472
 1006    H    GLY  41           H        GLY  41   5.300  29.888 -16.847
 1007   1HA   GLY  41          1HA       GLY  41   6.772  29.259 -19.330
 1008   2HA   GLY  41          2HA       GLY  41   5.620  30.576 -19.169
 1009    H    ASN  42           H        ASN  42   6.745  32.396 -19.436
 1010    HA   ASN  42           HA       ASN  42   9.122  32.787 -17.744
 1011   1HB   ASN  42          2HB       ASN  42   9.936  34.303 -19.668
 1012   2HB   ASN  42          3HB       ASN  42  10.082  32.560 -19.873
 1013   1HD2  ASN  42          1HD2      ASN  42   8.386  35.431 -20.842
 1014   2HD2  ASN  42          2HD2      ASN  42   7.628  34.756 -22.238
 1015    H    SER  43           H        SER  43   9.182  34.639 -16.606
 1016    HA   SER  43           HA       SER  43   6.841  36.322 -16.626
 1017   1HB   SER  43          2HB       SER  43   7.744  37.323 -14.641
 1018   2HB   SER  43          3HB       SER  43   8.037  35.588 -14.529
 1019    HG   SER  43           HG       SER  43  10.134  35.910 -14.742
 1020    H    ARG  44           H        ARG  44   7.680  38.805 -16.036
 1021    HA   ARG  44           HA       ARG  44   9.088  39.634 -18.485
 1022   1HB   ARG  44          2HB       ARG  44   6.722  40.680 -17.058
 1023   2HB   ARG  44          3HB       ARG  44   7.841  41.896 -17.658
 1024   1HG   ARG  44          2HG       ARG  44   7.653  40.415 -19.859
 1025   2HG   ARG  44          3HG       ARG  44   6.087  40.032 -19.139
 1026   1HD   ARG  44          2HD       ARG  44   5.638  42.459 -18.937
 1027   2HD   ARG  44          3HD       ARG  44   7.160  42.779 -19.767
 1028    HE   ARG  44           HE       ARG  44   5.712  41.085 -21.404
 1029   1HH1  ARG  44          2HH1      ARG  44   5.361  44.280 -20.067
 1030   2HH1  ARG  44          1HH1      ARG  44   4.415  44.872 -21.391
 1031   1HH2  ARG  44          2HH2      ARG  44   4.467  41.854 -23.155
 1032   2HH2  ARG  44          1HH2      ARG  44   3.907  43.491 -23.147
 1033    H    GLU  45           H        GLU  45   8.683  40.356 -15.038
 1034    HA   GLU  45           HA       GLU  45  11.255  41.792 -15.115
 1035   1HB   GLU  45          2HB       GLU  45  10.429  42.826 -12.941
 1036   2HB   GLU  45          3HB       GLU  45   9.619  43.340 -14.414
 1037   1HG   GLU  45          2HG       GLU  45   7.818  41.700 -13.923
 1038   2HG   GLU  45          3HG       GLU  45   8.605  41.369 -12.381
 1039    H    ARG  46           H        ARG  46  12.383  39.776 -14.913
 1040    HA   ARG  46           HA       ARG  46  12.121  38.480 -12.287
 1041   1HB   ARG  46          2HB       ARG  46  12.048  37.227 -14.606
 1042   2HB   ARG  46          3HB       ARG  46  13.798  37.347 -14.485
 1043   1HG   ARG  46          2HG       ARG  46  13.889  35.987 -12.608
 1044   2HG   ARG  46          3HG       ARG  46  12.186  36.241 -12.222
 1045   1HD   ARG  46          2HD       ARG  46  12.034  35.121 -14.702
 1046   2HD   ARG  46          3HD       ARG  46  13.446  34.308 -14.030
 1047    HE   ARG  46           HE       ARG  46  11.198  34.344 -12.248
 1048   1HH1  ARG  46          2HH1      ARG  46  12.699  32.680 -14.911
 1049   2HH1  ARG  46          1HH1      ARG  46  11.940  31.163 -14.560
 1050   1HH2  ARG  46          2HH2      ARG  46  10.193  32.352 -11.775
 1051   2HH2  ARG  46          1HH2      ARG  46  10.514  30.977 -12.777
 1052    H    CYS  47           H        CYS  47  14.388  37.503 -11.487
 1053    HA   CYS  47           HA       CYS  47  16.358  39.636 -11.877
 1054   1HB   CYS  47          2HB       CYS  47  15.282  39.836  -9.664
 1055   2HB   CYS  47          3HB       CYS  47  15.737  38.187  -9.281
 1056    H    GLN  48           H        GLN  48  18.092  38.805 -12.826
 1057    HA   GLN  48           HA       GLN  48  18.596  35.929 -12.746
 1058   1HB   GLN  48          2HB       GLN  48  18.768  37.826 -14.772
 1059   2HB   GLN  48          3HB       GLN  48  20.444  37.500 -14.352
 1060   1HG   GLN  48          2HG       GLN  48  19.092  35.017 -14.504
 1061   2HG   GLN  48          3HG       GLN  48  18.674  35.955 -15.937
 1062   1HE2  GLN  48          1HE2      GLN  48  19.948  35.555 -17.581
 1063   2HE2  GLN  48          2HE2      GLN  48  21.633  35.179 -17.506
 1064    H    LEU  49           H        LEU  49  19.142  37.664 -10.443
 1065    HA   LEU  49           HA       LEU  49  22.031  37.148 -10.211
 1066   1HB   LEU  49          2HB       LEU  49  20.684  39.627 -10.018
 1067   2HB   LEU  49          3HB       LEU  49  21.217  39.194  -8.395
 1068    HG   LEU  49           HG       LEU  49  23.236  38.953 -10.541
 1069   1HD1  LEU  49          1HD1      LEU  49  21.710  41.363 -10.206
 1070   2HD1  LEU  49          2HD1      LEU  49  23.015  41.010 -11.338
 1071   3HD1  LEU  49          3HD1      LEU  49  23.387  41.625  -9.727
 1072   1HD2  LEU  49          1HD2      LEU  49  23.142  39.872  -7.683
 1073   2HD2  LEU  49          2HD2      LEU  49  24.566  40.106  -8.698
 1074   3HD2  LEU  49          3HD2      LEU  49  23.977  38.477  -8.365
 1075    H    CYS  50           H        CYS  50  18.831  37.268  -8.582
 1076    HA   CYS  50           HA       CYS  50  20.006  35.509  -6.562
 1077   1HB   CYS  50          2HB       CYS  50  18.913  36.584  -4.782
 1078   2HB   CYS  50          3HB       CYS  50  19.598  37.892  -5.726
 1079    H    ASN  51           H        ASN  51  18.338  35.471  -9.160
 1080    HA   ASN  51           HA       ASN  51  16.639  34.263 -10.071
 1081   1HB   ASN  51          2HB       ASN  51  16.573  32.735  -7.465
 1082   2HB   ASN  51          3HB       ASN  51  16.088  32.166  -9.060
 1083   1HD2  ASN  51          1HD2      ASN  51  17.527  31.105 -10.238
 1084   2HD2  ASN  51          2HD2      ASN  51  19.220  31.007  -9.905
 1085    H    GLY  52           H        GLY  52  16.118  36.594  -8.198
 1086   1HA   GLY  52          1HA       GLY  52  13.672  36.124  -6.849
 1087   2HA   GLY  52          2HA       GLY  52  14.315  37.696  -7.298
 1088    H    MET  53           H        MET  53  11.577  37.017  -7.372
 1089    HA   MET  53           HA       MET  53  11.081  37.183 -10.270
 1090   1HB   MET  53          2HB       MET  53  10.363  35.002  -9.191
 1091   2HB   MET  53          3HB       MET  53   9.180  35.936  -8.285
 1092   1HG   MET  53          2HG       MET  53   8.109  36.633 -10.336
 1093   2HG   MET  53          3HG       MET  53   9.335  35.799 -11.286
 1094   1HE   MET  53          1HE       MET  53   6.651  35.098 -12.229
 1095   2HE   MET  53          2HE       MET  53   5.666  33.945 -11.329
 1096   3HE   MET  53          3HE       MET  53   5.858  35.596 -10.735
 1097    H    GLY  54           H        GLY  54  10.772  39.337 -10.503
 1098   1HA   GLY  54          1HA       GLY  54   8.542  40.691 -10.283
 1099   2HA   GLY  54          2HA       GLY  54   9.035  40.733  -8.598
 1100    H    HIS  55           H        HIS  55  11.646  41.229  -8.613
 1101    HA   HIS  55           HA       HIS  55  11.765  43.922  -9.719
 1102   1HB   HIS  55          2HB       HIS  55  13.760  44.179  -8.279
 1103   2HB   HIS  55          3HB       HIS  55  12.344  43.661  -7.369
 1104    HD1  HIS  55           HD1      HIS  55  12.286  41.007  -6.812
 1105    HD2  HIS  55           HD2      HIS  55  15.949  42.596  -7.961
 1106    HE1  HIS  55           HE1      HIS  55  14.007  39.326  -6.079
 1107    H    ASN  56           H        ASN  56  14.358  44.425 -10.117
 1108    HA   ASN  56           HA       ASN  56  15.147  42.530 -12.232
 1109   1HB   ASN  56          2HB       ASN  56  14.449  45.205 -12.528
 1110   2HB   ASN  56          3HB       ASN  56  16.210  45.222 -12.553
 1111   1HD2  ASN  56          1HD2      ASN  56  13.362  44.484 -14.258
 1112   2HD2  ASN  56          2HD2      ASN  56  14.102  43.864 -15.691
 1113    H    ALA  57           H        ALA  57  17.385  42.204 -12.579
 1114    HA   ALA  57           HA       ALA  57  18.938  41.931 -10.282
 1115   1HB   ALA  57          1HB       ALA  57  20.848  41.856 -12.127
 1116   2HB   ALA  57          2HB       ALA  57  19.689  40.542 -11.918
 1117   3HB   ALA  57          3HB       ALA  57  19.449  41.734 -13.196
 1118    H    LYS  58           H        LYS  58  18.802  44.531 -12.653
 1119    HA   LYS  58           HA       LYS  58  21.080  45.949 -11.824
 1120   1HB   LYS  58          2HB       LYS  58  19.604  46.276 -13.919
 1121   2HB   LYS  58          3HB       LYS  58  18.602  47.283 -12.882
 1122   1HG   LYS  58          2HG       LYS  58  20.031  48.990 -12.973
 1123   2HG   LYS  58          3HG       LYS  58  21.434  47.948 -12.735
 1124   1HD   LYS  58          2HD       LYS  58  20.106  47.716 -15.355
 1125   2HD   LYS  58          3HD       LYS  58  20.895  49.262 -15.036
 1126   1HE   LYS  58          2HE       LYS  58  22.394  46.782 -14.392
 1127   2HE   LYS  58          3HE       LYS  58  22.189  47.195 -16.093
 1128   1HZ   LYS  58          1HZ       LYS  58  24.093  48.322 -15.632
 1129   2HZ   LYS  58          2HZ       LYS  58  23.699  48.589 -14.009
 1130   3HZ   LYS  58          3HZ       LYS  58  22.980  49.527 -15.219
 1131    H    GLN  59           H        GLN  59  17.967  45.596 -10.401
 1132    HA   GLN  59           HA       GLN  59  18.597  47.734  -8.474
 1133   1HB   GLN  59          2HB       GLN  59  16.432  47.761  -9.997
 1134   2HB   GLN  59          3HB       GLN  59  15.824  46.669  -8.760
 1135   1HG   GLN  59          2HG       GLN  59  16.344  48.367  -7.051
 1136   2HG   GLN  59          3HG       GLN  59  16.852  49.465  -8.334
 1137   1HE2  GLN  59          1HE2      GLN  59  15.153  50.780  -7.249
 1138   2HE2  GLN  59          2HE2      GLN  59  13.529  50.607  -7.812
 1139    H    CYS  60           H        CYS  60  19.209  44.631  -8.636
 1140    HA   CYS  60           HA       CYS  60  17.790  43.768  -6.276
 1141   1HB   CYS  60          2HB       CYS  60  18.111  42.197  -8.149
 1142   2HB   CYS  60          3HB       CYS  60  19.850  42.327  -7.979
 1143    H    ARG  61           H        ARG  61  18.772  43.488  -4.305
 1144    HA   ARG  61           HA       ARG  61  20.165  43.967  -2.569
 1145   1HB   ARG  61          2HB       ARG  61  22.188  43.195  -4.675
 1146   2HB   ARG  61          3HB       ARG  61  22.597  43.461  -2.985
 1147   1HG   ARG  61          2HG       ARG  61  20.884  41.681  -2.433
 1148   2HG   ARG  61          3HG       ARG  61  20.864  41.310  -4.158
 1149   1HD   ARG  61          2HD       ARG  61  23.565  41.435  -3.452
 1150   2HD   ARG  61          3HD       ARG  61  22.779  40.557  -2.140
 1151    HE   ARG  61           HE       ARG  61  23.194  39.644  -4.825
 1152   1HH1  ARG  61          2HH1      ARG  61  21.180  39.350  -2.001
 1153   2HH1  ARG  61          1HH1      ARG  61  20.645  37.748  -2.389
 1154   1HH2  ARG  61          2HH2      ARG  61  22.498  37.536  -5.347
 1155   2HH2  ARG  61          1HH2      ARG  61  21.396  36.717  -4.293
 1156    H    LYS  62           H        LYS  62  19.263  46.245  -3.461
 1157    HA   LYS  62           HA       LYS  62  21.382  48.092  -2.956
 1158   1HB   LYS  62          2HB       LYS  62  20.870  47.429  -5.676
 1159   2HB   LYS  62          3HB       LYS  62  20.283  49.066  -5.406
 1160   1HG   LYS  62          2HG       LYS  62  22.955  48.444  -4.323
 1161   2HG   LYS  62          3HG       LYS  62  22.808  48.491  -6.081
 1162   1HD   LYS  62          2HD       LYS  62  21.827  50.691  -4.270
 1163   2HD   LYS  62          3HD       LYS  62  23.437  50.671  -4.992
 1164   1HE   LYS  62          2HE       LYS  62  21.203  50.225  -6.857
 1165   2HE   LYS  62          3HE       LYS  62  21.268  51.828  -6.126
 1166   1HZ   LYS  62          1HZ       LYS  62  23.620  51.942  -6.861
 1167   2HZ   LYS  62          2HZ       LYS  62  22.513  51.871  -8.137
 1168   3HZ   LYS  62          3HZ       LYS  62  23.397  50.495  -7.706
 1169    H    ARG  63           H        ARG  63  18.134  47.796  -4.382
 1170    HA   ARG  63           HA       ARG  63  16.185  48.895  -3.975
 1171   1HB   ARG  63          2HB       ARG  63  17.579  48.975  -1.338
 1172   2HB   ARG  63          3HB       ARG  63  16.132  49.952  -1.543
 1173   1HG   ARG  63          2HG       ARG  63  15.122  47.712  -2.455
 1174   2HG   ARG  63          3HG       ARG  63  16.437  46.993  -1.521
 1175   1HD   ARG  63          2HD       ARG  63  15.647  48.296   0.453
 1176   2HD   ARG  63          3HD       ARG  63  14.260  48.813  -0.504
 1177    HE   ARG  63           HE       ARG  63  14.140  46.128  -0.692
 1178   1HH1  ARG  63          2HH1      ARG  63  14.461  48.294   2.014
 1179   2HH1  ARG  63          1HH1      ARG  63  13.637  47.244   3.119
 1180   1HH2  ARG  63          2HH2      ARG  63  13.052  44.738   0.753
 1181   2HH2  ARG  63          1HH2      ARG  63  12.837  45.221   2.401
 1182    H    ASP  64           H        ASP  64  16.793  50.445  -5.611
 1183    HA   ASP  64           HA       ASP  64  17.045  52.552  -6.431
 1184   1HB   ASP  64          2HB       ASP  64  15.133  52.924  -4.844
 1185   2HB   ASP  64          3HB       ASP  64  16.306  53.460  -3.644
  Start of MODEL   18
    1   1H5*    C 160          1H5*        C 160  29.224  30.432 -16.066
    2   2H5*    C 160          2H5*        C 160  28.103  29.071 -16.050
    3    H4*    C 160           H4*        C 160  30.155  28.054 -16.374
    4    H3*    C 160           H3*        C 160  29.477  27.962 -13.440
    5    H2*    C 160           H2*        C 160  31.413  26.635 -13.068
    6   2HO*    C 160          2HO*        C 160  32.420  26.575 -15.596
    7    H1*    C 160           H1*        C 160  33.049  28.336 -14.615
    8   1H4     C 160          1H4         C 160  33.938  30.020  -8.495
    9   2H4     C 160          2H4         C 160  32.671  31.210  -8.691
   10    H5     C 160           H5         C 160  31.328  31.398 -10.624
   11    H6     C 160           H6         C 160  30.868  30.482 -12.870
   12   1H5*    U 161          1H5*        U 161  29.772  23.588 -14.478
   13   2H5*    U 161          2H5*        U 161  28.499  22.841 -13.513
   14    H4*    U 161           H4*        U 161  30.670  21.860 -13.025
   15    H3*    U 161           H3*        U 161  29.295  23.374 -10.822
   16    H2*    U 161           H2*        U 161  31.014  22.731  -9.309
   17   2HO*    U 161          2HO*        U 161  32.720  21.299 -10.516
   18    H1*    U 161           H1*        U 161  33.060  23.453 -11.110
   19    H3     U 161           H3         U 161  33.194  26.344  -7.540
   20    H5     U 161           H5         U 161  30.343  27.937 -10.162
   21    H6     U 161           H6         U 161  30.505  25.855 -11.447
   22   1H5*    G 162          1H5*        G 162  30.312  19.501  -9.380
   23   2H5*    G 162          2H5*        G 162  28.882  18.701  -8.727
   24    H4*    G 162           H4*        G 162  30.545  18.400  -7.109
   25    H3*    G 162           H3*        G 162  28.630  20.583  -6.347
   26    H2*    G 162           H2*        G 162  29.753  20.852  -4.263
   27   2HO*    G 162          2HO*        G 162  31.281  19.240  -3.683
   28    H1*    G 162           H1*        G 162  32.274  21.023  -5.449
   29    H8     G 162           H8         G 162  29.836  22.731  -7.670
   30    H1     G 162           H1         G 162  31.718  26.389  -2.673
   31   1H2     G 162          1H2         G 162  32.759  25.227  -1.322
   32   2H2     G 162          2H2         G 162  33.074  23.517  -1.516
   33   1H5*    C 163          1H5*        C 163  29.057  18.063  -3.217
   34   2H5*    C 163          2H5*        C 163  27.597  17.567  -2.362
   35    H4*    C 163           H4*        C 163  29.052  18.501  -0.751
   36    H3*    C 163           H3*        C 163  26.777  20.336  -1.473
   37    H2*    C 163           H2*        C 163  27.479  21.840   0.231
   38   2HO*    C 163          2HO*        C 163  29.614  20.795   1.293
   39    H1*    C 163           H1*        C 163  30.172  21.739  -0.590
   40   1H4     C 163          1H4         C 163  27.852  27.009  -3.349
   41   2H4     C 163          2H4         C 163  27.163  26.026  -4.621
   42    H5     C 163           H5         C 163  27.202  23.665  -4.627
   43    H6     C 163           H6         C 163  27.919  21.645  -3.401
   44   1H5*    C 164          1H5*        C 164  26.928  19.928   2.566
   45   2H5*    C 164          2H5*        C 164  25.425  19.412   3.332
   46    H4*    C 164           H4*        C 164  26.069  21.245   4.593
   47    H3*    C 164           H3*        C 164  24.027  22.082   2.552
   48    H2*    C 164           H2*        C 164  24.039  24.287   3.446
   49   2HO*    C 164          2HO*        C 164  26.039  23.585   5.321
   50    H1*    C 164           H1*        C 164  26.828  24.471   3.414
   51   1H4     C 164          1H4         C 164  25.085  27.053  -2.152
   52   2H4     C 164          2H4         C 164  24.853  25.452  -2.821
   53    H5     C 164           H5         C 164  25.051  23.461  -1.566
   54    H6     C 164           H6         C 164  25.526  22.505   0.660
   55   1H5*    C 165          1H5*        C 165  21.928  23.034   6.423
   56   2H5*    C 165          2H5*        C 165  20.208  23.065   6.036
   57    H4*    C 165           H4*        C 165  21.196  25.254   6.756
   58    H3*    C 165           H3*        C 165  19.723  24.970   4.146
   59    H2*    C 165           H2*        C 165  19.881  27.323   3.827
   60   2HO*    C 165          2HO*        C 165  21.334  28.045   5.981
   61    H1*    C 165           H1*        C 165  22.625  27.376   4.426
   62   1H4     C 165          1H4         C 165  22.236  27.045  -1.955
   63   2H4     C 165          2H4         C 165  22.252  25.301  -1.829
   64    H5     C 165           H5         C 165  22.161  24.129   0.220
   65    H6     C 165           H6         C 165  22.032  24.345   2.676
   66   1H5*    U 166          1H5*        U 166  16.053  26.480   6.644
   67   2H5*    U 166          2H5*        U 166  14.723  25.916   5.633
   68    H4*    U 166           H4*        U 166  15.256  28.405   5.599
   69    H3*    U 166           H3*        U 166  14.920  26.736   3.117
   70    H2*    U 166           H2*        U 166  15.116  28.696   1.790
   71   2HO*    U 166          2HO*        U 166  14.680  30.630   2.788
   72    H1*    U 166           H1*        U 166  17.385  29.615   3.151
   73    H3     U 166           H3         U 166  18.453  28.210  -1.133
   74    H5     U 166           H5         U 166  18.974  24.890   1.366
   75    H6     U 166           H6         U 166  17.873  26.176   3.140
   76   1H5*    C 167          1H5*        C 167  10.471  28.366   3.368
   77   2H5*    C 167          2H5*        C 167   9.610  27.061   2.552
   78    H4*    C 167           H4*        C 167   9.681  29.233   1.313
   79    H3*    C 167           H3*        C 167  10.680  26.685   0.064
   80    H2*    C 167           H2*        C 167  10.997  27.835  -1.993
   81   2HO*    C 167          2HO*        C 167   9.100  29.099  -1.753
   82    H1*    C 167           H1*        C 167  12.347  29.973  -0.784
   83   1H4     C 167          1H4         C 167  16.854  25.904  -2.843
   84   2H4     C 167          2H4         C 167  16.863  25.189  -1.246
   85    H5     C 167           H5         C 167  15.333  25.758   0.459
   86    H6     C 167           H6         C 167  13.396  27.169   1.059
   87   1H5*    A 168          1H5*        A 168   9.097  25.293  -3.411
   88   2H5*    A 168          2H5*        A 168   8.562  26.609  -4.457
   89    H4*    A 168           H4*        A 168   7.121  24.198  -3.536
   90    H3*    A 168           H3*        A 168   7.463  25.712  -6.051
   91    H2*    A 168           H2*        A 168   5.236  25.467  -6.758
   92   2HO*    A 168          2HO*        A 168   3.932  23.892  -5.508
   93    H1*    A 168           H1*        A 168   3.998  26.185  -4.457
   94    H8     A 168           H8         A 168   6.380  27.199  -7.017
   95   1H6     A 168          1H6         A 168   5.546  33.127  -5.254
   96   2H6     A 168          2H6         A 168   6.222  32.100  -6.499
   97    H2     A 168           H2         A 168   3.731  30.492  -2.171
   98   1H5*    U 169          1H5*        U 169   6.405  24.954  -9.926
   99   2H5*    U 169          2H5*        U 169   7.781  23.854 -10.000
  100    H4*    U 169           H4*        U 169   8.057  26.818  -9.481
  101    H3*    U 169           H3*        U 169   7.973  25.346 -12.113
  102    H2*    U 169           H2*        U 169   9.522  26.909 -12.987
  103   2HO*    U 169          2HO*        U 169   9.517  28.901 -12.053
  104    H1*    U 169           H1*        U 169  11.119  26.817 -10.627
  105    H3     U 169           H3         U 169  13.598  25.321 -14.218
  106    H5     U 169           H5         U 169  11.504  21.983 -12.798
  107    H6     U 169           H6         U 169  10.229  23.515 -11.370
  108   1H5*    C 170          1H5*        C 170   3.967  26.511 -12.679
  109   2H5*    C 170          2H5*        C 170   3.236  27.778 -13.664
  110    H4*    C 170           H4*        C 170   2.174  27.558 -11.461
  111    H3*    C 170           H3*        C 170   3.515  30.152 -12.177
  112    H2*    C 170           H2*        C 170   2.723  31.114 -10.153
  113   2HO*    C 170          2HO*        C 170   1.401  29.305  -8.887
  114    H1*    C 170           H1*        C 170   3.578  28.968  -8.581
  115   1H4     C 170          1H4         C 170   8.287  33.327  -8.495
  116   2H4     C 170          2H4         C 170   9.075  32.409  -9.758
  117    H5     C 170           H5         C 170   8.090  30.564 -10.854
  118    H6     C 170           H6         C 170   6.086  29.130 -11.010
  119   1H5*    C 171          1H5*        C 171   0.608  31.877  -9.948
  120   2H5*    C 171          2H5*        C 171  -0.456  32.488 -11.216
  121    H4*    C 171           H4*        C 171  -0.132  34.339  -9.869
  122    H3*    C 171           H3*        C 171   1.783  34.453 -12.186
  123    H2*    C 171           H2*        C 171   2.565  36.561 -11.436
  124   2HO*    C 171          2HO*        C 171   1.209  37.728 -10.115
  125    H1*    C 171           H1*        C 171   2.737  35.683  -8.739
  126   1H4     C 171          1H4         C 171   8.757  35.394 -10.819
  127   2H4     C 171          2H4         C 171   8.373  33.959 -11.742
  128    H5     C 171           H5         C 171   6.199  33.055 -11.928
  129    H6     C 171           H6         C 171   3.833  33.310 -11.266
  130   1H5*    G 172          1H5*        G 172  -0.827  38.380 -12.974
  131   2H5*    G 172          2H5*        G 172  -0.813  38.271 -14.734
  132    H4*    G 172           H4*        G 172   0.009  40.431 -13.972
  133    H3*    G 172           H3*        G 172   1.937  38.629 -15.411
  134    H2*    G 172           H2*        G 172   3.573  40.360 -15.373
  135   2HO*    G 172          2HO*        G 172   2.364  42.278 -13.966
  136    H1*    G 172           H1*        G 172   3.254  40.834 -12.639
  137    H8     G 172           H8         G 172   2.958  37.195 -13.581
  138    H1     G 172           H1         G 172   9.017  39.157 -12.433
  139   1H2     G 172          1H2         G 172   9.049  41.207 -12.220
  140   2H2     G 172          2H2         G 172   7.642  42.242 -12.335
  141   1H5*    U 173          1H5*        U 173   1.767  42.358 -16.978
  142   2H5*    U 173          2H5*        U 173   1.556  42.551 -18.718
  143    H4*    U 173           H4*        U 173   3.342  43.956 -18.142
  144    H3*    U 173           H3*        U 173   4.252  41.423 -19.460
  145    H2*    U 173           H2*        U 173   6.517  42.130 -19.342
  146   2HO*    U 173          2HO*        U 173   6.241  44.477 -18.023
  147    H1*    U 173           H1*        U 173   6.309  42.875 -16.635
  148    H3     U 173           H3         U 173   9.062  39.230 -16.750
  149    H5     U 173           H5         U 173   5.186  37.651 -16.923
  150    H6     U 173           H6         U 173   4.370  39.947 -17.197
  151   1H5*    C 174          1H5*        C 174   6.154  44.505 -21.688
  152   2H5*    C 174          2H5*        C 174   5.819  44.289 -23.406
  153    H4*    C 174           H4*        C 174   8.149  44.462 -23.249
  154    H3*    C 174           H3*        C 174   7.232  41.639 -23.635
  155    H2*    C 174           H2*        C 174   9.478  40.857 -23.631
  156   2HO*    C 174          2HO*        C 174  10.497  43.440 -23.137
  157    H1*    C 174           H1*        C 174  10.123  42.319 -21.302
  158   1H4     C 174          1H4         C 174   8.887  36.400 -19.239
  159   2H4     C 174          2H4         C 174   7.178  36.770 -19.251
  160    H5     C 174           H5         C 174   6.275  38.791 -20.073
  161    H6     C 174           H6         C 174   6.796  40.977 -21.097
  162   1H5*    U 175          1H5*        U 175   8.395  44.353 -28.423
  163   2H5*    U 175          2H5*        U 175   6.848  44.141 -27.603
  164    H4*    U 175           H4*        U 175   5.993  42.771 -29.313
  165    H3*    U 175           H3*        U 175   8.843  42.416 -30.246
  166    H2*    U 175           H2*        U 175   8.036  41.976 -32.413
  167   2HO*    U 175          2HO*        U 175   5.619  41.664 -32.523
  168    H1*    U 175           H1*        U 175   5.994  44.012 -32.134
  169    H3     U 175           H3         U 175   8.120  45.411 -35.875
  170    H5     U 175           H5         U 175  10.958  45.988 -32.849
  171    H6     U 175           H6         U 175   9.415  44.848 -31.322
  172   1H5*    C 176          1H5*        C 176   9.595  40.154 -27.400
  173   2H5*    C 176          2H5*        C 176  10.461  41.670 -27.646
  174    H4*    C 176           H4*        C 176  12.449  40.421 -28.373
  175    H3*    C 176           H3*        C 176  10.661  38.040 -28.117
  176    H2*    C 176           H2*        C 176  12.425  36.719 -27.231
  177   2HO*    C 176          2HO*        C 176  14.556  38.018 -27.111
  178    H1*    C 176           H1*        C 176  13.176  38.592 -25.326
  179   1H4     C 176          1H4         C 176   8.856  34.833 -22.455
  180   2H4     C 176          2H4         C 176   7.616  35.978 -22.919
  181    H5     C 176           H5         C 176   8.003  37.838 -24.323
  182    H6     C 176           H6         C 176   9.689  39.068 -25.640
  183   1H5*    G 177          1H5*        G 177  14.157  36.696 -29.801
  184   2H5*    G 177          2H5*        G 177  13.910  36.039 -31.418
  185    H4*    G 177           H4*        G 177  15.246  34.459 -30.343
  186    H3*    G 177           H3*        G 177  12.385  33.617 -30.474
  187    H2*    G 177           H2*        G 177  12.847  31.600 -29.294
  188   2HO*    G 177          2HO*        G 177  15.033  31.022 -29.035
  189    H1*    G 177           H1*        G 177  14.188  32.913 -27.230
  190    H8     G 177           H8         G 177  11.424  35.156 -28.149
  191    H1     G 177           H1         G 177   9.428  30.095 -24.641
  192   1H2     G 177          1H2         G 177  10.939  28.696 -24.530
  193   2H2     G 177          2H2         G 177  12.512  28.867 -25.277
  194   1H5*    C 178          1H5*        C 178  14.396  30.038 -32.113
  195   2H5*    C 178          2H5*        C 178  13.399  29.536 -33.478
  196    H4*    C 178           H4*        C 178  13.651  27.782 -31.767
  197    H3*    C 178           H3*        C 178  10.904  28.831 -32.405
  198    H2*    C 178           H2*        C 178   9.954  27.195 -30.974
  199   2HO*    C 178          2HO*        C 178  12.542  26.194 -30.362
  200    H1*    C 178           H1*        C 178  11.813  27.712 -28.907
  201   1H4     C 178          1H4         C 178   6.577  30.974 -27.249
  202   2H4     C 178          2H4         C 178   7.061  32.267 -28.324
  203    H5     C 178           H5         C 178   8.923  32.147 -29.773
  204    H6     C 178           H6         C 178  10.798  30.744 -30.554
  205   1H5*    U 179          1H5*        U 179  10.599  24.479 -33.676
  206   2H5*    U 179          2H5*        U 179   9.338  24.472 -34.909
  207    H4*    U 179           H4*        U 179   8.858  23.116 -32.852
  208    H3*    U 179           H3*        U 179   6.969  25.251 -33.818
  209    H2*    U 179           H2*        U 179   5.410  24.609 -32.147
  210   2HO*    U 179          2HO*        U 179   6.634  22.664 -30.833
  211    H1*    U 179           H1*        U 179   7.350  24.560 -30.115
  212    H3     U 179           H3         U 179   4.418  28.068 -29.445
  213    H5     U 179           H5         U 179   7.500  29.572 -31.849
  214    H6     U 179           H6         U 179   8.290  27.266 -32.109
  215   1H5*    U 180          1H5*        U 180   5.008  21.885 -33.326
  216   2H5*    U 180          2H5*        U 180   3.856  21.309 -34.531
  217    H4*    U 180           H4*        U 180   2.720  21.459 -32.448
  218    H3*    U 180           H3*        U 180   1.950  23.549 -34.454
  219    H2*    U 180           H2*        U 180   0.346  24.451 -32.960
  220   2HO*    U 180          2HO*        U 180   0.409  23.056 -30.795
  221    H1*    U 180           H1*        U 180   2.159  24.383 -30.773
  222    H3     U 180           H3         U 180   1.353  28.813 -31.403
  223    H5     U 180           H5         U 180   3.948  27.783 -34.525
  224    H6     U 180           H6         U 180   3.686  25.444 -33.838
  225   1H5*    A 181          1H5*        A 181  -1.581  20.369 -35.702
  226   2H5*    A 181          2H5*        A 181  -1.843  21.094 -37.289
  227    H4*    A 181           H4*        A 181  -3.725  21.301 -35.603
  228    H3*    A 181           H3*        A 181  -2.602  23.641 -37.122
  229    H2*    A 181           H2*        A 181  -4.263  25.050 -36.172
  230   2HO*    A 181          2HO*        A 181  -6.087  24.060 -35.373
  231    H1*    A 181           H1*        A 181  -3.823  24.138 -33.567
  232    H8     A 181           H8         A 181  -0.611  24.368 -35.484
  233   1H6     A 181          1H6         A 181  -0.315  30.316 -33.618
  234   2H6     A 181          2H6         A 181   0.571  29.035 -34.414
  235    H2     A 181           H2         A 181  -4.303  28.706 -32.501
  236   1H5*    U 182          1H5*        U 182  -8.169  23.011 -39.136
  237   2H5*    U 182          2H5*        U 182  -7.239  23.978 -37.993
  238    H4*    U 182           H4*        U 182  -6.397  21.484 -37.325
  239    H3*    U 182           H3*        U 182  -9.143  21.146 -38.502
  240    H2*    U 182           H2*        U 182  -9.712  19.636 -36.773
  241   2HO*    U 182          2HO*        U 182  -7.994  18.449 -36.189
  242    H1*    U 182           H1*        U 182  -8.481  21.304 -34.790
  243    H3     U 182           H3         U 182 -12.786  21.195 -33.392
  244    H5     U 182           H5         U 182 -12.925  23.522 -36.871
  245    H6     U 182           H6         U 182 -10.569  22.947 -37.231
  246   1H5*    U 183          1H5*        U 183  -8.004  20.969 -40.862
  247   2H5*    U 183          2H5*        U 183  -8.311  20.290 -42.461
  248    H4*    U 183           H4*        U 183  -5.662  20.627 -41.057
  249    H3*    U 183           H3*        U 183  -6.976  21.938 -43.391
  250    H2*    U 183           H2*        U 183  -4.941  22.033 -44.610
  251   2HO*    U 183          2HO*        U 183  -3.444  20.687 -42.676
  252    H1*    U 183           H1*        U 183  -4.314  19.357 -44.206
  253    H3     U 183           H3         U 183  -5.712  20.042 -48.557
  254    H5     U 183           H5         U 183  -9.147  19.054 -46.374
  255    H6     U 183           H6         U 183  -7.799  19.287 -44.339
  256   1H5*    C 184          1H5*        C 184  -3.891  25.452 -42.076
  257   2H5*    C 184          2H5*        C 184  -3.994  25.782 -40.346
  258    H4*    C 184           H4*        C 184  -3.791  27.757 -41.988
  259    H3*    C 184           H3*        C 184  -5.324  27.553 -39.512
  260    H2*    C 184           H2*        C 184  -7.182  28.559 -40.424
  261   2HO*    C 184          2HO*        C 184  -5.279  30.684 -40.780
  262    H1*    C 184           H1*        C 184  -5.347  29.568 -42.666
  263   1H4     C 184          1H4         C 184 -11.694  29.360 -44.781
  264   2H4     C 184          2H4         C 184 -10.969  30.762 -45.534
  265    H5     C 184           H5         C 184  -8.735  31.441 -45.177
  266    H6     C 184           H6         C 184  -6.626  30.936 -43.996
  267   1H5*    G 185          1H5*        G 185  -2.395  31.201 -36.581
  268   2H5*    G 185          2H5*        G 185  -3.622  31.960 -37.595
  269    H4*    G 185           H4*        G 185  -0.671  32.374 -37.529
  270    H3*    G 185           H3*        G 185  -3.113  34.086 -37.492
  271    H2*    G 185           H2*        G 185  -1.996  35.851 -38.641
  272   2HO*    G 185          2HO*        G 185   0.349  35.309 -39.147
  273    H1*    G 185           H1*        G 185  -1.077  34.175 -40.674
  274    H8     G 185           H8         G 185  -4.251  35.083 -38.806
  275    H1     G 185           H1         G 185  -4.939  34.585 -45.221
  276   1H2     G 185          1H2         G 185  -3.196  33.853 -46.046
  277   2H2     G 185          2H2         G 185  -1.763  33.436 -45.135
  278   1H5*    G 186          1H5*        G 186  -1.315  37.645 -33.580
  279   2H5*    G 186          2H5*        G 186  -0.477  38.090 -35.067
  280    H4*    G 186           H4*        G 186   0.851  36.740 -32.707
  281    H3*    G 186           H3*        G 186   0.446  39.654 -33.290
  282    H2*    G 186           H2*        G 186   2.631  40.143 -32.477
  283   2HO*    G 186          2HO*        G 186   3.754  37.946 -31.806
  284    H1*    G 186           H1*        G 186   3.843  38.177 -34.038
  285    H8     G 186           H8         G 186   3.728  41.347 -33.810
  286    H1     G 186           H1         G 186   1.777  40.330 -39.896
  287   1H2     G 186          1H2         G 186   1.152  38.376 -40.101
  288   2H2     G 186          2H2         G 186   1.155  37.190 -38.816
  289   1H5*    G 187          1H5*        G 187  -2.121  40.121 -28.314
  290   2H5*    G 187          2H5*        G 187  -1.097  38.724 -28.648
  291    H4*    G 187           H4*        G 187  -4.004  39.046 -28.893
  292    H3*    G 187           H3*        G 187  -2.081  36.802 -28.349
  293    H2*    G 187           H2*        G 187  -3.774  35.219 -28.903
  294   2HO*    G 187          2HO*        G 187  -5.903  35.972 -29.013
  295    H1*    G 187           H1*        G 187  -4.409  36.480 -31.308
  296    H8     G 187           H8         G 187  -0.765  36.842 -30.982
  297    H1     G 187           H1         G 187  -2.496  30.873 -32.786
  298   1H2     G 187          1H2         G 187  -4.530  30.641 -32.539
  299   2H2     G 187          2H2         G 187  -5.607  31.881 -31.935
  300   1H5*    G 188          1H5*        G 188  -5.698  35.216 -26.901
  301   2H5*    G 188          2H5*        G 188  -5.434  35.159 -25.158
  302    H4*    G 188           H4*        G 188  -6.279  33.059 -25.626
  303    H3*    G 188           H3*        G 188  -3.276  32.922 -25.523
  304    H2*    G 188           H2*        G 188  -3.386  30.562 -25.834
  305   2HO*    G 188          2HO*        G 188  -6.124  30.402 -26.155
  306    H1*    G 188           H1*        G 188  -5.119  30.770 -28.020
  307    H8     G 188           H8         G 188  -2.769  33.577 -28.362
  308    H1     G 188           H1         G 188  -0.130  27.927 -30.094
  309   1H2     G 188          1H2         G 188  -1.352  26.381 -29.484
  310   2H2     G 188          2H2         G 188  -2.864  26.585 -28.631
  311   1H5*    A 189          1H5*        A 189  -4.514  29.741 -23.457
  312   2H5*    A 189          2H5*        A 189  -3.680  29.530 -21.917
  313    H4*    A 189           H4*        A 189  -3.405  27.551 -23.246
  314    H3*    A 189           H3*        A 189  -0.907  29.204 -22.904
  315    H2*    A 189           H2*        A 189   0.336  27.466 -23.947
  316   2HO*    A 189          2HO*        A 189  -1.740  25.769 -24.511
  317    H1*    A 189           H1*        A 189  -1.555  27.204 -26.038
  318    H8     A 189           H8         A 189  -0.941  30.796 -25.306
  319   1H6     A 189          1H6         A 189   3.976  30.450 -29.134
  320   2H6     A 189          2H6         A 189   2.955  31.549 -28.233
  321    H2     A 189           H2         A 189   2.487  26.328 -28.410
  322   1H5*    G 190          1H5*        G 190  -0.060  25.080 -20.816
  323   2H5*    G 190          2H5*        G 190   1.036  25.572 -19.524
  324    H4*    G 190           H4*        G 190   1.928  23.752 -20.936
  325    H3*    G 190           H3*        G 190   3.414  26.353 -20.717
  326    H2*    G 190           H2*        G 190   5.193  25.448 -22.019
  327   2HO*    G 190          2HO*        G 190   3.710  23.027 -22.277
  328    H1*    G 190           H1*        G 190   3.485  24.527 -24.025
  329    H8     G 190           H8         G 190   2.043  27.728 -22.936
  330    H1     G 190           H1         G 190   7.242  28.524 -26.706
  331   1H2     G 190          1H2         G 190   8.219  26.721 -26.921
  332   2H2     G 190          2H2         G 190   7.706  25.217 -26.190
  333   1H5*    C 191          1H5*        C 191   6.539  23.516 -18.949
  334   2H5*    C 191          2H5*        C 191   7.413  24.587 -17.854
  335    H4*    C 191           H4*        C 191   8.734  23.585 -19.764
  336    H3*    C 191           H3*        C 191   8.683  26.542 -19.197
  337    H2*    C 191           H2*        C 191  10.326  26.873 -20.879
  338   2HO*    C 191          2HO*        C 191  10.755  24.448 -21.849
  339    H1*    C 191           H1*        C 191   8.983  25.268 -22.751
  340   1H4     C 191          1H4         C 191   7.226  31.300 -23.998
  341   2H4     C 191          2H4         C 191   5.867  31.083 -22.918
  342    H5     C 191           H5         C 191   5.542  29.162 -21.582
  343    H6     C 191           H6         C 191   6.450  26.955 -20.949
  344   1H5*    G 192          1H5*        G 192  13.164  25.404 -18.723
  345   2H5*    G 192          2H5*        G 192  13.628  26.474 -17.401
  346    H4*    G 192           H4*        G 192  15.013  26.672 -19.476
  347    H3*    G 192           H3*        G 192  13.640  29.050 -18.258
  348    H2*    G 192           H2*        G 192  14.687  30.471 -19.859
  349   2HO*    G 192          2HO*        G 192  16.578  29.707 -20.618
  350    H1*    G 192           H1*        G 192  13.929  28.882 -22.022
  351    H8     G 192           H8         G 192  11.084  28.741 -19.698
  352    H1     G 192           H1         G 192  11.346  34.340 -22.933
  353   1H2     G 192          1H2         G 192  13.170  34.503 -23.881
  354   2H2     G 192          2H2         G 192  14.440  33.302 -23.811
  355   1H5*    G 193          1H5*        G 193  18.077  30.377 -18.448
  356   2H5*    G 193          2H5*        G 193  18.179  31.262 -16.927
  357    H4*    G 193           H4*        G 193  18.830  32.558 -18.966
  358    H3*    G 193           H3*        G 193  16.706  33.535 -17.080
  359    H2*    G 193           H2*        G 193  16.540  35.564 -18.319
  360   2HO*    G 193          2HO*        G 193  18.386  34.727 -20.260
  361    H1*    G 193           H1*        G 193  16.289  34.251 -20.767
  362    H8     G 193           H8         G 193  14.448  32.155 -18.372
  363    H1     G 193           H1         G 193  11.154  37.472 -20.035
  364   1H2     G 193          1H2         G 193  12.405  38.775 -21.030
  365   2H2     G 193          2H2         G 193  14.095  38.471 -21.364
  366   1H5*    A 194          1H5*        A 194  19.847  37.477 -16.516
  367   2H5*    A 194          2H5*        A 194  19.538  37.245 -14.796
  368    H4*    A 194           H4*        A 194  19.064  39.544 -15.731
  369    H3*    A 194           H3*        A 194  17.053  37.985 -14.128
  370    H2*    A 194           H2*        A 194  15.574  39.843 -14.183
  371   2HO*    A 194          2HO*        A 194  17.168  41.468 -15.760
  372    H1*    A 194           H1*        A 194  15.851  40.225 -16.937
  373    H8     A 194           H8         A 194  15.858  36.578 -16.116
  374   1H6     A 194          1H6         A 194   9.630  36.817 -16.453
  375   2H6     A 194          2H6         A 194  11.002  35.740 -16.319
  376    H2     A 194           H2         A 194  11.192  40.973 -16.617
  377   1H5*    C 195          1H5*        C 195  17.798  41.638 -11.480
  378   2H5*    C 195          2H5*        C 195  17.496  41.040  -9.849
  379    H4*    C 195           H4*        C 195  16.024  42.931 -10.658
  380    H3*    C 195           H3*        C 195  14.901  40.380  -9.514
  381    H2*    C 195           H2*        C 195  12.729  41.332  -9.592
  382   2HO*    C 195          2HO*        C 195  12.757  43.483  -9.301
  383    H1*    C 195           H1*        C 195  13.063  42.287 -12.219
  384   1H4     C 195          1H4         C 195   9.949  36.708 -12.710
  385   2H4     C 195          2H4         C 195  11.497  35.913 -12.883
  386    H5     C 195           H5         C 195  13.575  37.007 -12.631
  387    H6     C 195           H6         C 195  14.690  39.156 -12.146
  388   1H5*    G 196          1H5*        G 196  14.757  42.876  -5.524
  389   2H5*    G 196          2H5*        G 196  15.232  41.637  -4.361
  390    H4*    G 196           H4*        G 196  12.956  42.404  -3.965
  391    H3*    G 196           H3*        G 196  13.340  39.540  -4.797
  392    H2*    G 196           H2*        G 196  11.017  39.142  -4.455
  393   2HO*    G 196          2HO*        G 196  10.691  41.885  -3.753
  394    H1*    G 196           H1*        G 196  10.249  41.379  -5.952
  395    H8     G 196           H8         G 196  13.231  39.721  -7.484
  396    H1     G 196           H1         G 196   7.606  36.983  -9.138
  397   1H2     G 196          1H2         G 196   6.092  37.762  -7.975
  398   2H2     G 196          2H2         G 196   6.314  38.977  -6.736
  399   1H5*    A 197          1H5*        A 197  14.331  37.636   0.391
  400   2H5*    A 197          2H5*        A 197  12.831  36.968  -0.251
  401    H4*    A 197           H4*        A 197  13.340  38.406   2.240
  402    H3*    A 197           H3*        A 197  11.272  36.466   1.223
  403    H2*    A 197           H2*        A 197   9.900  36.998   3.088
  404   2HO*    A 197          2HO*        A 197  11.101  38.708   4.543
  405    H1*    A 197           H1*        A 197  10.266  39.773   2.757
  406    H8     A 197           H8         A 197   9.073  36.632   1.030
  407   1H6     A 197          1H6         A 197   4.399  40.109  -1.209
  408   2H6     A 197          2H6         A 197   5.017  38.478  -1.082
  409    H2     A 197           H2         A 197   7.267  42.801   0.858
  410   1H5*    U 198          1H5*        U 198  13.991  34.712   4.820
  411   2H5*    U 198          2H5*        U 198  15.349  33.718   4.292
  412    H4*    U 198           H4*        U 198  12.811  32.271   4.242
  413    H3*    U 198           H3*        U 198  13.656  33.576   6.826
  414    H2*    U 198           H2*        U 198  13.066  31.645   7.992
  415   2HO*    U 198          2HO*        U 198  11.811  30.144   6.180
  416    H1*    U 198           H1*        U 198  13.830  29.999   5.670
  417    H3     U 198           H3         U 198  18.359  29.853   7.543
  418    H5     U 198           H5         U 198  15.377  29.170  10.403
  419    H6     U 198           H6         U 198  13.750  29.976   8.754
  420   1H5*    G 199          1H5*        G 199  13.951  36.053   6.926
  421   2H5*    G 199          2H5*        G 199  14.312  35.442   8.541
  422    H4*    G 199           H4*        G 199  14.140  37.905   8.428
  423    H3*    G 199           H3*        G 199  12.254  36.380  10.218
  424    H2*    G 199           H2*        G 199  11.492  38.449  11.108
  425   2HO*    G 199          2HO*        G 199  12.727  40.373  10.088
  426    H1*    G 199           H1*        G 199  11.223  39.595   8.534
  427    H8     G 199           H8         G 199  10.056  36.021   9.063
  428    H1     G 199           H1         G 199   5.484  40.519   9.928
  429   1H2     G 199          1H2         G 199   6.338  42.394   9.838
  430   2H2     G 199          2H2         G 199   8.038  42.702   9.567
  431   1H5*    A 200          1H5*        A 200  14.026  35.429  14.469
  432   2H5*    A 200          2H5*        A 200  15.777  35.224  14.518
  433    H4*    A 200           H4*        A 200  14.982  33.056  14.297
  434    H3*    A 200           H3*        A 200  15.859  34.133  11.643
  435    H2*    A 200           H2*        A 200  14.967  32.353  10.510
  436   2HO*    A 200          2HO*        A 200  14.855  30.355  12.210
  437    H1*    A 200           H1*        A 200  13.263  31.709  12.906
  438    H8     A 200           H8         A 200  12.983  33.924   9.777
  439   1H6     A 200          1H6         A 200   7.974  30.462   8.409
  440   2H6     A 200          2H6         A 200   8.955  31.809   7.875
  441    H2     A 200           H2         A 200   9.734  28.927  12.188
  442   1H5*    C 201          1H5*        C 201  18.400  32.456  16.535
  443   2H5*    C 201          2H5*        C 201  18.387  31.709  14.937
  444    H4*    C 201           H4*        C 201  15.876  32.593  16.367
  445    H3*    C 201           H3*        C 201  17.335  29.957  16.546
  446    H2*    C 201           H2*        C 201  15.235  28.877  16.813
  447   2HO*    C 201          2HO*        C 201  13.946  31.413  16.645
  448    H1*    C 201           H1*        C 201  14.084  30.360  14.681
  449   1H4     C 201          1H4         C 201  15.539  24.599  12.291
  450   2H4     C 201          2H4         C 201  17.121  25.220  11.871
  451    H5     C 201           H5         C 201  17.904  27.358  12.496
  452    H6     C 201           H6         C 201  17.357  29.450  13.689
  453   1H5*    C 202          1H5*        C 202  14.971  30.253  20.297
  454   2H5*    C 202          2H5*        C 202  15.785  29.319  21.552
  455    H4*    C 202           H4*        C 202  13.481  28.547  21.023
  456    H3*    C 202           H3*        C 202  15.811  26.655  20.736
  457    H2*    C 202           H2*        C 202  14.274  24.884  20.352
  458   2HO*    C 202          2HO*        C 202  12.093  26.683  20.610
  459    H1*    C 202           H1*        C 202  12.764  26.432  18.520
  460   1H4     C 202          1H4         C 202  16.550  22.615  15.030
  461   2H4     C 202          2H4         C 202  17.738  23.900  15.007
  462    H5     C 202           H5         C 202  17.537  25.899  16.247
  463    H6     C 202           H6         C 202  16.134  27.171  17.832
  464   1H5*    C 203          1H5*        C 203  14.806  25.459  25.272
  465   2H5*    C 203          2H5*        C 203  16.456  25.092  25.774
  466    H4*    C 203           H4*        C 203  14.897  23.143  25.764
  467    H3*    C 203           H3*        C 203  17.457  23.103  24.186
  468    H2*    C 203           H2*        C 203  17.057  20.829  23.611
  469   2HO*    C 203          2HO*        C 203  14.629  20.472  24.776
  470    H1*    C 203           H1*        C 203  14.410  21.319  22.831
  471   1H4     C 203          1H4         C 203  18.005  21.615  17.523
  472   2H4     C 203          2H4         C 203  18.036  23.353  17.716
  473    H5     C 203           H5         C 203  17.171  24.484  19.600
  474    H6     C 203           H6         C 203  16.051  24.223  21.786
  475   1H5*    U 204          1H5*        U 204  17.073  19.972  26.698
  476   2H5*    U 204          2H5*        U 204  18.448  19.280  27.557
  477    H4*    U 204           H4*        U 204  17.365  17.576  26.246
  478    H3*    U 204           H3*        U 204  20.111  18.395  25.339
  479    H2*    U 204           H2*        U 204  20.073  16.676  23.691
  480   2HO*    U 204          2HO*        U 204  18.998  15.119  24.901
  481    H1*    U 204           H1*        U 204  17.554  17.411  22.735
  482    H3     U 204           H3         U 204  20.786  18.560  19.650
  483    H5     U 204           H5         U 204  20.412  21.860  22.201
  484    H6     U 204           H6         U 204  19.020  20.455  23.652
  485   1H5*    A 205          1H5*        A 205  21.457  14.736  28.145
  486   2H5*    A 205          2H5*        A 205  23.196  15.030  28.156
  487    H4*    A 205           H4*        A 205  22.235  13.137  26.682
  488    H3*    A 205           H3*        A 205  24.326  15.127  25.829
  489    H2*    A 205           H2*        A 205  24.552  13.983  23.761
  490   2HO*    A 205          2HO*        A 205  23.094  11.958  23.680
  491    H1*    A 205           H1*        A 205  21.794  13.844  23.315
  492    H8     A 205           H8         A 205  22.372  17.149  24.820
  493   1H6     A 205          1H6         A 205  24.111  19.186  19.182
  494   2H6     A 205          2H6         A 205  23.690  19.689  20.804
  495    H2     A 205           H2         A 205  23.834  14.754  19.034
  496   1H5*    G 206          1H5*        G 206  28.357  14.697  25.761
  497   2H5*    G 206          2H5*        G 206  27.612  15.961  24.783
  498    H4*    G 206           H4*        G 206  29.474  14.666  23.691
  499    H3*    G 206           H3*        G 206  26.769  14.989  22.425
  500    H2*    G 206           H2*        G 206  27.549  13.870  20.472
  501   2HO*    G 206          2HO*        G 206  29.917  13.255  20.607
  502    H1*    G 206           H1*        G 206  28.607  11.727  21.904
  503    H8     G 206           H8         G 206  25.440  13.777  21.552
  504    H1     G 206           H1         G 206  24.481   7.392  22.009
  505   1H2     G 206          1H2         G 206  26.265   6.457  22.447
  506   2H2     G 206          2H2         G 206  27.795   7.281  22.659
  507   1H5*    U 207          1H5*        U 207  26.902  17.461  18.631
  508   2H5*    U 207          2H5*        U 207  28.503  17.629  17.910
  509    H4*    U 207           H4*        U 207  26.875  19.656  17.966
  510    H3*    U 207           H3*        U 207  29.829  19.721  18.522
  511    H2*    U 207           H2*        U 207  29.729  22.079  18.766
  512   2HO*    U 207          2HO*        U 207  28.211  22.955  17.488
  513    H1*    U 207           H1*        U 207  27.516  22.022  20.461
  514    H3     U 207           H3         U 207  30.650  22.987  23.531
  515    H5     U 207           H5         U 207  31.689  19.114  22.324
  516    H6     U 207           H6         U 207  29.906  19.265  20.647
  517   1H5*    A 208          1H5*        A 208  31.275  22.273  14.057
  518   2H5*    A 208          2H5*        A 208  29.814  22.580  13.119
  519    H4*    A 208           H4*        A 208  31.380  21.513  11.688
  520    H3*    A 208           H3*        A 208  29.038  19.849  12.498
  521    H2*    A 208           H2*        A 208  29.836  17.980  11.258
  522   2HO*    A 208          2HO*        A 208  31.622  18.350   9.843
  523    H1*    A 208           H1*        A 208  32.393  18.112  12.385
  524    H8     A 208           H8         A 208  29.188  18.775  14.379
  525   1H6     A 208          1H6         A 208  29.933  12.974  16.557
  526   2H6     A 208          2H6         A 208  28.949  14.416  16.672
  527    H2     A 208           H2         A 208  33.123  13.755  13.565
  528   1H5*    G 209          1H5*        G 209  28.074  19.758   8.885
  529   2H5*    G 209          2H5*        G 209  26.344  19.724   8.545
  530    H4*    G 209           H4*        G 209  27.366  17.507   9.081
  531    H3*    G 209           H3*        G 209  25.020  18.577  10.623
  532    H2*    G 209           H2*        G 209  24.886  16.528  11.834
  533   2HO*    G 209          2HO*        G 209  27.172  15.502  10.536
  534    H1*    G 209           H1*        G 209  27.601  16.531  12.475
  535    H8     G 209           H8         G 209  26.497  20.053  12.610
  536    H1     G 209           H1         G 209  24.744  16.682  17.849
  537   1H2     G 209          1H2         G 209  25.045  14.671  17.507
  538   2H2     G 209          2H2         G 209  25.679  13.998  16.022
  539   1H5*    A 210          1H5*        A 210  24.214  14.420  10.214
  540   2H5*    A 210          2H5*        A 210  22.608  14.366   9.489
  541    H4*    A 210           H4*        A 210  22.648  13.029  11.491
  542    H3*    A 210           H3*        A 210  21.006  15.552  11.656
  543    H2*    A 210           H2*        A 210  20.200  14.847  13.773
  544   2HO*    A 210          2HO*        A 210  21.255  12.560  14.301
  545    H1*    A 210           H1*        A 210  22.778  14.114  14.672
  546    H8     A 210           H8         A 210  22.879  17.341  12.811
  547   1H6     A 210          1H6         A 210  21.464  20.150  18.202
  548   2H6     A 210          2H6         A 210  21.971  20.426  16.550
  549    H2     A 210           H2         A 210  21.014  15.765  18.760
  550   1H5*    G 211          1H5*        G 211  18.309  12.013  12.398
  551   2H5*    G 211          2H5*        G 211  16.792  12.393  11.582
  552    H4*    G 211           H4*        G 211  16.364  11.733  13.862
  553    H3*    G 211           H3*        G 211  15.795  14.592  13.151
  554    H2*    G 211           H2*        G 211  14.932  14.981  15.337
  555   2HO*    G 211          2HO*        G 211  14.095  13.196  16.246
  556    H1*    G 211           H1*        G 211  17.163  13.842  16.590
  557    H8     G 211           H8         G 211  18.405  15.718  13.656
  558    H1     G 211           H1         G 211  17.016  19.556  18.679
  559   1H2     G 211          1H2         G 211  15.974  18.482  20.098
  560   2H2     G 211          2H2         G 211  15.540  16.794  19.949
  561   1H5*    G 212          1H5*        G 212  11.335  13.071  12.664
  562   2H5*    G 212          2H5*        G 212  10.817  14.171  11.387
  563    H4*    G 212           H4*        G 212   9.758  14.503  13.652
  564    H3*    G 212           H3*        G 212  11.091  16.738  12.143
  565    H2*    G 212           H2*        G 212  10.360  18.277  13.808
  566   2HO*    G 212          2HO*        G 212   8.378  17.498  14.362
  567    H1*    G 212           H1*        G 212  11.291  16.690  15.916
  568    H8     G 212           H8         G 212  13.828  16.340  13.290
  569    H1     G 212           H1         G 212  14.215  22.045  16.320
  570   1H2     G 212          1H2         G 212  12.523  22.335  17.462
  571   2H2     G 212          2H2         G 212  11.196  21.201  17.580
  572   1H5*    G 213          1H5*        G 213   6.906  17.909  13.020
  573   2H5*    G 213          2H5*        G 213   6.253  18.670  11.569
  574    H4*    G 213           H4*        G 213   5.870  20.060  13.516
  575    H3*    G 213           H3*        G 213   7.709  21.116  11.395
  576    H2*    G 213           H2*        G 213   7.933  23.168  12.583
  577   2HO*    G 213          2HO*        G 213   6.550  23.396  14.497
  578    H1*    G 213           H1*        G 213   8.505  21.873  15.006
  579    H8     G 213           H8         G 213  10.270  19.927  12.450
  580    H1     G 213           H1         G 213  13.270  25.507  13.774
  581   1H2     G 213          1H2         G 213  12.017  26.717  14.877
  582   2H2     G 213          2H2         G 213  10.395  26.285  15.370
  583   1H5*    G 214          1H5*        G 214   6.316  25.161  10.603
  584   2H5*    G 214          2H5*        G 214   5.498  24.591   9.149
  585    H4*    G 214           H4*        G 214   7.202  26.207   8.579
  586    H3*    G 214           H3*        G 214   7.588  23.390   7.647
  587    H2*    G 214           H2*        G 214   9.622  23.966   6.565
  588   2HO*    G 214          2HO*        G 214   9.836  26.575   7.247
  589    H1*    G 214           H1*        G 214  10.624  25.345   8.794
  590    H8     G 214           H8         G 214   8.930  22.372  10.136
  591    H1     G 214           H1         G 214  14.695  20.965   7.554
  592   1H2     G 214          1H2         G 214  15.377  22.580   6.469
  593   2H2     G 214          2H2         G 214  14.514  24.091   6.286
  594   1H5*    G 215          1H5*        G 215   8.016  25.716   2.996
  595   2H5*    G 215          2H5*        G 215   6.674  24.619   2.670
  596    H4*    G 215           H4*        G 215   8.816  24.548   1.194
  597    H3*    G 215           H3*        G 215   7.246  22.192   2.200
  598    H2*    G 215           H2*        G 215   8.685  20.722   1.001
  599   2HO*    G 215          2HO*        G 215   8.984  21.991  -0.823
  600    H1*    G 215           H1*        G 215  11.014  21.874   1.990
  601    H8     G 215           H8         G 215   8.709  22.072   4.826
  602    H1     G 215           H1         G 215  10.884  16.050   3.882
  603   1H2     G 215          1H2         G 215  11.810  15.933   2.042
  604   2H2     G 215          2H2         G 215  11.972  17.267   0.922
  605   1H5*    C 216          1H5*        C 216   5.418  22.158  -2.131
  606   2H5*    C 216          2H5*        C 216   3.946  21.238  -1.819
  607    H4*    C 216           H4*        C 216   5.862  20.114  -3.115
  608    H3*    C 216           H3*        C 216   4.341  18.846  -0.849
  609    H2*    C 216           H2*        C 216   5.519  16.818  -1.216
  610   2HO*    C 216          2HO*        C 216   6.446  16.536  -3.221
  611    H1*    C 216           H1*        C 216   8.019  18.075  -1.346
  612   1H4     C 216          1H4         C 216   7.257  16.092   4.707
  613   2H4     C 216          2H4         C 216   6.691  17.699   5.101
  614    H5     C 216           H5         C 216   6.290  19.383   3.494
  615    H6     C 216           H6         C 216   6.335  19.945   1.090
  616   1H5*    U 217          1H5*        U 217   2.595  15.459  -3.866
  617   2H5*    U 217          2H5*        U 217   1.545  14.978  -2.533
  618    H4*    U 217           H4*        U 217   3.682  13.556  -3.440
  619    H3*    U 217           H3*        U 217   2.246  13.544  -0.799
  620    H2*    U 217           H2*        U 217   3.759  11.894   0.011
  621   2HO*    U 217          2HO*        U 217   5.034  10.813  -1.520
  622    H1*    U 217           H1*        U 217   6.024  13.292  -0.777
  623    H3     U 217           H3         U 217   5.368  13.492   3.816
  624    H5     U 217           H5         U 217   3.616  16.936   2.200
  625    H6     U 217           H6         U 217   3.923  15.931  -0.017
  626   1H5*    G 218          1H5*        G 218  -0.203   9.052  -1.814
  627   2H5*    G 218          2H5*        G 218   0.262   8.514  -0.199
  628    H4*    G 218           H4*        G 218   1.158   6.873  -1.549
  629    H3*    G 218           H3*        G 218   3.284   8.906  -0.941
  630    H2*    G 218           H2*        G 218   4.839   7.742  -2.243
  631   2HO*    G 218          2HO*        G 218   3.027   5.582  -2.593
  632    H1*    G 218           H1*        G 218   2.759   6.973  -4.147
  633    H8     G 218           H8         G 218   3.228  10.639  -3.659
  634    H1     G 218           H1         G 218   7.235   8.100  -8.063
  635   1H2     G 218          1H2         G 218   7.130   6.043  -7.984
  636   2H2     G 218          2H2         G 218   6.109   5.139  -6.888
  637   1H5*    C 219          1H5*        C 219   2.184   3.875   3.024
  638   2H5*    C 219          2H5*        C 219   0.867   4.885   2.430
  639    H4*    C 219           H4*        C 219   3.263   5.677   4.065
  640    H3*    C 219           H3*        C 219   0.423   5.386   4.611
  641    H2*    C 219           H2*        C 219   0.043   7.655   4.297
  642   2HO*    C 219          2HO*        C 219  -0.099   7.942   6.441
  643    H1*    C 219           H1*        C 219   2.970   8.195   4.994
  644   1H4     C 219          1H4         C 219   0.787  13.829   2.726
  645   2H4     C 219          2H4         C 219   1.366  13.288   1.166
  646    H5     C 219           H5         C 219   2.161  11.104   0.743
  647    H6     C 219           H6         C 219   2.602   8.881   1.722
  648   1H5*    G 220          1H5*        G 220   5.092   4.222   6.777
  649   2H5*    G 220          2H5*        G 220   4.608   5.612   5.806
  650    H4*    G 220           H4*        G 220   6.349   3.284   5.040
  651    H3*    G 220           H3*        G 220   6.694   6.288   5.051
  652    H2*    G 220           H2*        G 220   8.296   6.072   3.373
  653   2HO*    G 220          2HO*        G 220   8.624   3.364   3.337
  654    H1*    G 220           H1*        G 220   6.878   3.693   2.339
  655    H8     G 220           H8         G 220   6.772   4.227  -0.102
  656    H1     G 220           H1         G 220   5.966  10.563   0.946
  657   1H2     G 220          1H2         G 220   5.928  10.926   2.975
  658   2H2     G 220          2H2         G 220   6.090   9.697   4.210
  659   1H5*    G 221          1H5*        G 221  10.172   5.244   5.966
  660   2H5*    G 221          2H5*        G 221  11.283   6.394   6.710
  661    H4*    G 221           H4*        G 221  10.969   6.260   4.097
  662    H3*    G 221           H3*        G 221  11.406   8.727   5.772
  663    H2*    G 221           H2*        G 221  11.517  10.016   3.777
  664   2HO*    G 221          2HO*        G 221  11.371   8.643   1.746
  665    H1*    G 221           H1*        G 221   9.204   8.841   2.699
  666    H8     G 221           H8         G 221   8.660   9.380   6.326
  667    H1     G 221           H1         G 221   7.843  14.760   2.823
  668   1H2     G 221          1H2         G 221   8.536  14.446   0.906
  669   2H2     G 221          2H2         G 221   9.233  12.948   0.333
  670   1H5*    C 222          1H5*        C 222  15.959   8.798   4.559
  671   2H5*    C 222          2H5*        C 222  16.250  10.308   5.422
  672    H4*    C 222           H4*        C 222  15.675  10.125   2.781
  673    H3*    C 222           H3*        C 222  15.302  12.380   4.736
  674    H2*    C 222           H2*        C 222  14.371  13.716   3.009
  675   2HO*    C 222          2HO*        C 222  14.773  11.543   1.200
  676    H1*    C 222           H1*        C 222  12.630  11.731   2.122
  677   1H4     C 222          1H4         C 222   9.396  15.233   6.418
  678   2H4     C 222          2H4         C 222   9.785  14.016   7.613
  679    H5     C 222           H5         C 222  11.250  12.205   7.217
  680    H6     C 222           H6         C 222  12.715  11.106   5.561
  681   1H5*    U 223          1H5*        U 223  16.075  14.631   2.372
  682   2H5*    U 223          2H5*        U 223  17.805  14.746   2.052
  683    H4*    U 223           H4*        U 223  17.192  16.917   1.736
  684    H3*    U 223           H3*        U 223  18.094  16.582   4.545
  685    H2*    U 223           H2*        U 223  17.395  18.743   5.194
  686   2HO*    U 223          2HO*        U 223  17.091  20.260   3.565
  687    H1*    U 223           H1*        U 223  14.874  18.570   4.034
  688    H3     U 223           H3         U 223  14.642  18.278   8.657
  689    H5     U 223           H5         U 223  14.837  14.348   7.224
  690    H6     U 223           H6         U 223  15.369  15.282   5.021
  691   1H5*    U 224          1H5*        U 224  19.483  14.421   0.782
  692   2H5*    U 224          2H5*        U 224  20.291  15.336  -0.491
  693    H4*    U 224           H4*        U 224  18.245  14.117  -1.221
  694    H3*    U 224           H3*        U 224  18.467  17.098  -1.586
  695    H2*    U 224           H2*        U 224  16.433  17.081  -2.804
  696   2HO*    U 224          2HO*        U 224  16.919  15.133  -3.900
  697    H1*    U 224           H1*        U 224  15.146  15.415  -0.914
  698    H3     U 224           H3         U 224  12.785  18.969   0.383
  699    H5     U 224           H5         U 224  16.705  20.442   0.474
  700    H6     U 224           H6         U 224  17.443  18.245  -0.330
  701   1H5*    A 225          1H5*        A 225  20.295  16.048  -5.973
  702   2H5*    A 225          2H5*        A 225  20.438  17.725  -6.499
  703    H4*    A 225           H4*        A 225  18.453  16.180  -7.293
  704    H3*    A 225           H3*        A 225  18.400  19.123  -6.686
  705    H2*    A 225           H2*        A 225  16.105  19.212  -7.279
  706   2HO*    A 225          2HO*        A 225  16.236  17.803  -9.037
  707    H1*    A 225           H1*        A 225  15.388  17.004  -5.751
  708    H8     A 225           H8         A 225  18.111  19.052  -4.144
  709   1H6     A 225          1H6         A 225  13.537  22.312  -1.424
  710   2H6     A 225          2H6         A 225  15.269  22.067  -1.470
  711    H2     A 225           H2         A 225  11.705  19.549  -4.382
  712   1H5*    G 226          1H5*        G 226  17.652  19.348 -10.791
  713   2H5*    G 226          2H5*        G 226  18.319  20.801 -11.535
  714    H4*    G 226           H4*        G 226  15.941  21.046 -11.295
  715    H3*    G 226           H3*        G 226  17.631  22.809  -9.549
  716    H2*    G 226           H2*        G 226  15.672  23.901  -8.745
  717   2HO*    G 226          2HO*        G 226  13.638  23.233  -9.798
  718    H1*    G 226           H1*        G 226  14.377  21.512  -8.128
  719    H8     G 226           H8         G 226  17.951  20.972  -7.365
  720    H1     G 226           H1         G 226  14.912  24.403  -2.797
  721   1H2     G 226          1H2         G 226  13.060  24.987  -3.491
  722   2H2     G 226          2H2         G 226  12.425  24.603  -5.076
  723   1H5*    G 227          1H5*        G 227  17.436  25.448 -13.784
  724   2H5*    G 227          2H5*        G 227  18.894  26.404 -13.520
  725    H4*    G 227           H4*        G 227  16.730  27.668 -13.408
  726    H3*    G 227           H3*        G 227  18.740  27.732 -11.176
  727    H2*    G 227           H2*        G 227  17.408  29.332 -10.018
  728   2HO*    G 227          2HO*        G 227  15.965  30.478 -11.234
  729    H1*    G 227           H1*        G 227  15.073  27.834 -10.261
  730    H8     G 227           H8         G 227  18.297  25.887  -9.762
  731    H1     G 227           H1         G 227  15.171  27.403  -4.302
  732   1H2     G 227          1H2         G 227  13.585  28.647  -4.739
  733   2H2     G 227          2H2         G 227  13.165  29.197  -6.346
  734   1H5*    A 228          1H5*        A 228  17.547  31.980 -11.533
  735   2H5*    A 228          2H5*        A 228  19.070  32.799 -11.189
  736    H4*    A 228           H4*        A 228  17.189  33.257  -9.586
  737    H3*    A 228           H3*        A 228  19.853  32.226  -8.612
  738    H2*    A 228           H2*        A 228  19.126  32.591  -6.387
  739   2HO*    A 228          2HO*        A 228  18.107  34.596  -7.045
  740    H1*    A 228           H1*        A 228  16.563  31.468  -6.911
  741    H8     A 228           H8         A 228  19.264  29.362  -8.354
  742   1H6     A 228          1H6         A 228  19.730  26.621  -2.766
  743   2H6     A 228          2H6         A 228  20.239  26.528  -4.438
  744    H2     A 228           H2         A 228  17.097  30.176  -2.356
  745   1H5*    G 229          1H5*        G 229  19.780  36.713  -6.697
  746   2H5*    G 229          2H5*        G 229  21.537  36.866  -6.680
  747    H4*    G 229           H4*        G 229  20.411  37.201  -4.470
  748    H3*    G 229           H3*        G 229  22.590  35.162  -4.837
  749    H2*    G 229           H2*        G 229  22.550  34.712  -2.498
  750   2HO*    G 229          2HO*        G 229  20.425  36.580  -2.195
  751    H1*    G 229           H1*        G 229  19.773  34.399  -2.438
  752    H8     G 229           H8         G 229  20.975  32.942  -5.622
  753    H1     G 229           H1         G 229  21.894  29.021  -0.555
  754   1H2     G 229          1H2         G 229  21.559  30.064   1.192
  755   2H2     G 229          2H2         G 229  21.098  31.749   1.273
  756   1H5*    G 230          1H5*        G 230  24.067  38.013  -1.371
  757   2H5*    G 230          2H5*        G 230  25.805  37.921  -1.659
  758    H4*    G 230           H4*        G 230  25.073  37.317   0.655
  759    H3*    G 230           H3*        G 230  26.706  35.432  -1.024
  760    H2*    G 230           H2*        G 230  26.873  33.940   0.827
  761   2HO*    G 230          2HO*        G 230  25.342  35.149   2.662
  762    H1*    G 230           H1*        G 230  24.125  33.986   1.325
  763    H8     G 230           H8         G 230  24.444  34.068  -2.337
  764    H1     G 230           H1         G 230  25.521  28.170   0.100
  765   1H2     G 230          1H2         G 230  25.735  28.299   2.147
  766   2H2     G 230          2H2         G 230  25.637  29.784   3.066
  767   1H5*    G 231          1H5*        G 231  29.028  35.840   2.999
  768   2H5*    G 231          2H5*        G 231  30.661  35.969   2.345
  769    H4*    G 231           H4*        G 231  30.456  34.220   4.058
  770    H3*    G 231           H3*        G 231  31.265  33.455   1.267
  771    H2*    G 231           H2*        G 231  31.613  31.210   1.986
  772   2HO*    G 231          2HO*        G 231  31.249  30.891   4.374
  773    H1*    G 231           H1*        G 231  29.124  31.045   3.238
  774    H8     G 231           H8         G 231  28.643  33.064   0.177
  775    H1     G 231           H1         G 231  28.953  26.714  -1.031
  776   1H2     G 231          1H2         G 231  29.609  25.723   0.654
  777   2H2     G 231          2H2         G 231  30.014  26.497   2.170
  778   1H5*    C 232          1H5*        C 232  34.148  31.891   3.931
  779   2H5*    C 232          2H5*        C 232  35.795  32.119   3.344
  780    H4*    C 232           H4*        C 232  35.460  29.800   3.826
  781    H3*    C 232           H3*        C 232  35.710  30.495   0.917
  782    H2*    C 232           H2*        C 232  35.582  28.196   0.334
  783   2HO*    C 232          2HO*        C 232  35.840  26.671   2.023
  784    H1*    C 232           H1*        C 232  33.353  27.747   2.009
  785   1H4     C 232          1H4         C 232  30.870  28.550  -3.820
  786   2H4     C 232          2H4         C 232  30.980  30.283  -3.613
  787    H5     C 232           H5         C 232  31.995  31.325  -1.753
  788    H6     C 232           H6         C 232  33.166  30.957   0.389
  789   1H5*    A 233          1H5*        A 233  39.063  27.264   1.558
  790   2H5*    A 233          2H5*        A 233  40.316  28.020   0.573
  791    H4*    A 233           H4*        A 233  39.883  25.689  -0.068
  792    H3*    A 233           H3*        A 233  39.400  27.872  -2.075
  793    H2*    A 233           H2*        A 233  38.900  26.247  -3.734
  794   2HO*    A 233          2HO*        A 233  39.719  24.222  -3.407
  795    H1*    A 233           H1*        A 233  37.164  24.817  -2.051
  796    H8     A 233           H8         A 233  36.613  28.422  -1.429
  797   1H6     A 233          1H6         A 233  32.844  28.454  -6.403
  798   2H6     A 233          2H6         A 233  33.377  29.387  -5.022
  799    H2     A 233           H2         A 233  35.015  24.577  -6.330
  800   1H5*    G 234          1H5*        G 234  42.707  25.195  -4.254
  801   2H5*    G 234          2H5*        G 234  43.677  26.555  -4.818
  802    H4*    G 234           H4*        G 234  43.155  25.060  -6.649
  803    H3*    G 234           H3*        G 234  41.953  27.812  -6.739
  804    H2*    G 234           H2*        G 234  41.064  27.353  -8.902
  805   2HO*    G 234          2HO*        G 234  41.664  25.045  -9.645
  806    H1*    G 234           H1*        G 234  39.929  24.930  -8.109
  807    H8     G 234           H8         G 234  39.613  27.333  -5.294
  808    H1     G 234           H1         G 234  35.104  28.159  -9.863
  809   1H2     G 234          1H2         G 234  35.595  27.040 -11.525
  810   2H2     G 234          2H2         G 234  37.017  26.029 -11.660
  811   1H    GLY  15          1H        GLY  15   5.791  -2.219   0.152
  812   1HA   GLY  15          1HA       GLY  15   7.150  -2.531  -1.678
  813   2HA   GLY  15          2HA       GLY  15   5.780  -2.096  -2.690
  814    H    ARG  16           H        ARG  16   8.705  -1.025  -1.222
  815    HA   ARG  16           HA       ARG  16   8.494   1.732  -1.386
  816   1HB   ARG  16          2HB       ARG  16  10.425   0.229  -0.511
  817   2HB   ARG  16          3HB       ARG  16  11.028   0.320  -2.160
  818   1HG   ARG  16          2HG       ARG  16  11.329   2.655  -2.027
  819   2HG   ARG  16          3HG       ARG  16  10.391   2.764  -0.537
  820   1HD   ARG  16          2HD       ARG  16  12.375   0.978   0.114
  821   2HD   ARG  16          3HD       ARG  16  13.208   2.118  -0.942
  822    HE   ARG  16           HE       ARG  16  13.042   3.703   0.701
  823   1HH1  ARG  16          2HH1      ARG  16  10.843   1.097   1.406
  824   2HH1  ARG  16          1HH1      ARG  16  10.432   1.696   2.979
  825   1HH2  ARG  16          2HH2      ARG  16  12.507   4.502   2.769
  826   2HH2  ARG  16          1HH2      ARG  16  11.378   3.635   3.752
  827    H    ALA  17           H        ALA  17   8.789   3.247  -2.973
  828    HA   ALA  17           HA       ALA  17   9.159   2.252  -5.720
  829   1HB   ALA  17          1HB       ALA  17   6.779   2.741  -5.287
  830   2HB   ALA  17          2HB       ALA  17   7.215   4.407  -4.900
  831   3HB   ALA  17          3HB       ALA  17   7.475   3.783  -6.529
  832    H    ARG  18           H        ARG  18  10.459   4.063  -3.360
  833    HA   ARG  18           HA       ARG  18  11.069   6.550  -4.316
  834   1HB   ARG  18          2HB       ARG  18  12.264   4.683  -2.443
  835   2HB   ARG  18          3HB       ARG  18  13.487   5.649  -3.258
  836   1HG   ARG  18          2HG       ARG  18  11.211   7.215  -2.327
  837   2HG   ARG  18          3HG       ARG  18  12.083   6.391  -1.032
  838   1HD   ARG  18          2HD       ARG  18  13.881   7.610  -2.952
  839   2HD   ARG  18          3HD       ARG  18  12.778   8.789  -2.244
  840    HE   ARG  18           HE       ARG  18  13.870   7.170  -0.213
  841   1HH1  ARG  18          2HH1      ARG  18  14.759   9.703  -2.428
  842   2HH1  ARG  18          1HH1      ARG  18  16.005  10.339  -1.405
  843   1HH2  ARG  18          2HH2      ARG  18  15.506   7.998   1.143
  844   2HH2  ARG  18          1HH2      ARG  18  16.430   9.368   0.625
  845    H    GLY  19           H        GLY  19  12.087   7.340  -6.040
  846   1HA   GLY  19          1HA       GLY  19  14.146   7.280  -7.398
  847   2HA   GLY  19          2HA       GLY  19  13.918   5.542  -7.507
  848    H    LEU  20           H        LEU  20  11.027   5.766  -7.904
  849    HA   LEU  20           HA       LEU  20  11.065   6.719 -10.691
  850   1HB   LEU  20          2HB       LEU  20  10.040   4.293  -9.414
  851   2HB   LEU  20          3HB       LEU  20   8.902   5.055 -10.523
  852    HG   LEU  20           HG       LEU  20  11.582   4.767 -11.643
  853   1HD1  LEU  20          1HD1      LEU  20  11.419   2.342 -11.978
  854   2HD1  LEU  20          2HD1      LEU  20  10.033   2.292 -10.890
  855   3HD1  LEU  20          3HD1      LEU  20  11.617   2.764 -10.277
  856   1HD2  LEU  20          1HD2      LEU  20  10.335   3.961 -13.544
  857   2HD2  LEU  20          2HD2      LEU  20   9.548   5.399 -12.895
  858   3HD2  LEU  20          3HD2      LEU  20   8.877   3.801 -12.564
  859    H    CYS  21           H        CYS  21   9.780   8.458 -11.202
  860    HA   CYS  21           HA       CYS  21   8.120   9.546  -9.196
  861   1HB   CYS  21          2HB       CYS  21   9.350  10.891 -10.903
  862   2HB   CYS  21          3HB       CYS  21   8.269  10.278 -12.140
  863    H    TYR  22           H        TYR  22   5.835   9.763  -9.312
  864    HA   TYR  22           HA       TYR  22   4.482   7.669 -10.885
  865   1HB   TYR  22          2HB       TYR  22   4.103   6.931  -8.745
  866   2HB   TYR  22          3HB       TYR  22   4.180   8.549  -8.056
  867    HD1  TYR  22           HD1      TYR  22   2.020   6.556 -10.370
  868    HD2  TYR  22           HD2      TYR  22   2.215   9.471  -7.277
  869    HE1  TYR  22           HE1      TYR  22  -0.438   6.633 -10.295
  870    HE2  TYR  22           HE2      TYR  22  -0.242   9.554  -7.192
  871    HH   TYR  22           HH       TYR  22  -2.214   8.072  -9.585
  872    H    THR  23           H        THR  23   4.579  11.006 -10.001
  873    HA   THR  23           HA       THR  23   1.961  11.762 -10.729
  874    HB   THR  23           HB       THR  23   4.505  13.399 -10.772
  875    HG1  THR  23           HG1      THR  23   2.433  13.284  -8.818
  876   1HG2  THR  23          1HG2      THR  23   2.797  14.443 -12.151
  877   2HG2  THR  23          2HG2      THR  23   2.991  15.346 -10.649
  878   3HG2  THR  23          3HG2      THR  23   1.613  14.266 -10.857
  879    H    CYS  24           H        CYS  24   5.044  11.602 -12.626
  880    HA   CYS  24           HA       CYS  24   3.389  12.084 -14.995
  881   1HB   CYS  24          2HB       CYS  24   5.384  12.914 -16.114
  882   2HB   CYS  24          3HB       CYS  24   5.100  13.817 -14.641
  883    H    GLY  25           H        GLY  25   5.892  10.173 -13.424
  884   1HA   GLY  25          1HA       GLY  25   5.981   7.788 -13.667
  885   2HA   GLY  25          2HA       GLY  25   5.353   7.969 -15.298
  886    H    SER  26           H        SER  26   7.961   9.887 -13.926
  887    HA   SER  26           HA       SER  26   9.732   8.833 -16.011
  888   1HB   SER  26          2HB       SER  26   9.252  11.358 -15.668
  889   2HB   SER  26          3HB       SER  26  10.343  11.223 -14.288
  890    HG   SER  26           HG       SER  26  10.961  10.548 -16.977
  891    HA   PRO  27           HA       PRO  27  11.782   6.503 -12.811
  892   1HB   PRO  27          2HB       PRO  27  13.673   5.425 -14.433
  893   2HB   PRO  27          3HB       PRO  27  12.005   4.840 -14.380
  894   1HG   PRO  27          2HG       PRO  27  13.302   6.687 -16.346
  895   2HG   PRO  27          3HG       PRO  27  12.186   5.342 -16.643
  896   1HD   PRO  27          2HD       PRO  27  11.382   7.927 -16.634
  897   2HD   PRO  27          3HD       PRO  27  10.330   6.598 -16.106
  898    H    GLY  28           H        GLY  28  12.676   8.185 -11.586
  899   1HA   GLY  28          1HA       GLY  28  15.380   8.426 -11.386
  900   2HA   GLY  28          2HA       GLY  28  14.947   9.679 -12.540
  901    H    HIS  29           H        HIS  29  12.992  11.048 -11.756
  902    HA   HIS  29           HA       HIS  29  13.689  11.985  -9.079
  903   1HB   HIS  29          2HB       HIS  29  12.589  14.042  -9.667
  904   2HB   HIS  29          3HB       HIS  29  13.630  13.578 -11.009
  905    HD1  HIS  29           HD1      HIS  29  12.558  13.555 -13.246
  906    HD2  HIS  29           HD2      HIS  29   9.765  13.325 -10.178
  907    HE1  HIS  29           HE1      HIS  29  10.312  13.672 -14.371
  908    H    TYR  30           H        TYR  30  11.482  13.209  -8.186
  909    HA   TYR  30           HA       TYR  30   9.358  11.181  -8.145
  910   1HB   TYR  30          2HB       TYR  30  11.150  11.699  -6.019
  911   2HB   TYR  30          3HB       TYR  30   9.600  12.388  -5.551
  912    HD1  TYR  30           HD1      TYR  30  10.845   9.262  -7.193
  913    HD2  TYR  30           HD2      TYR  30   8.225  11.008  -4.331
  914    HE1  TYR  30           HE1      TYR  30  10.045   7.021  -6.568
  915    HE2  TYR  30           HE2      TYR  30   7.419   8.773  -3.696
  916    HH   TYR  30           HH       TYR  30   8.720   6.199  -3.974
  917    H    GLN  31           H        GLN  31   7.451  12.157  -6.731
  918    HA   GLN  31           HA       GLN  31   6.283  14.191  -8.162
  919   1HB   GLN  31          2HB       GLN  31   5.011  12.752  -6.671
  920   2HB   GLN  31          3HB       GLN  31   5.817  13.448  -5.270
  921   1HG   GLN  31          2HG       GLN  31   4.484  15.242  -5.235
  922   2HG   GLN  31          3HG       GLN  31   4.481  15.403  -6.989
  923   1HE2  GLN  31          1HE2      GLN  31   2.312  15.710  -7.219
  924   2HE2  GLN  31          2HE2      GLN  31   1.134  14.492  -6.883
  925    H    ALA  32           H        ALA  32   8.188  14.447  -5.188
  926    HA   ALA  32           HA       ALA  32   7.841  17.165  -4.689
  927   1HB   ALA  32          1HB       ALA  32  10.287  15.481  -4.155
  928   2HB   ALA  32          2HB       ALA  32   9.915  17.035  -3.405
  929   3HB   ALA  32          3HB       ALA  32   8.884  15.637  -3.096
  930    H    GLN  33           H        GLN  33   9.874  15.524  -7.006
  931    HA   GLN  33           HA       GLN  33  10.888  18.139  -7.910
  932   1HB   GLN  33          2HB       GLN  33  12.212  15.448  -8.279
  933   2HB   GLN  33          3HB       GLN  33  12.864  17.009  -8.758
  934   1HG   GLN  33          2HG       GLN  33  13.680  17.401  -6.732
  935   2HG   GLN  33          3HG       GLN  33  12.176  16.929  -5.945
  936   1HE2  GLN  33          1HE2      GLN  33  12.231  15.170  -4.746
  937   2HE2  GLN  33          2HE2      GLN  33  13.417  13.917  -4.834
  938    H    CYS  34           H        CYS  34   8.314  16.755  -8.674
  939    HA   CYS  34           HA       CYS  34   8.856  15.817 -11.336
  940   1HB   CYS  34          2HB       CYS  34   7.078  14.822  -9.868
  941   2HB   CYS  34          3HB       CYS  34   6.177  16.319 -10.001
  942    HA   PRO  35           HA       PRO  35   8.690  19.970 -12.962
  943   1HB   PRO  35          2HB       PRO  35   8.758  19.255 -15.580
  944   2HB   PRO  35          3HB       PRO  35  10.185  19.220 -14.537
  945   1HG   PRO  35          2HG       PRO  35   8.387  16.973 -15.362
  946   2HG   PRO  35          3HG       PRO  35  10.157  17.010 -15.260
  947   1HD   PRO  35          2HD       PRO  35   8.609  15.890 -13.341
  948   2HD   PRO  35          3HD       PRO  35  10.157  16.681 -12.979
  949    H    LYS  36           H        LYS  36   6.351  17.509 -13.341
  950    HA   LYS  36           HA       LYS  36   4.529  19.255 -14.828
  951   1HB   LYS  36          2HB       LYS  36   4.806  16.356 -14.458
  952   2HB   LYS  36          3HB       LYS  36   3.146  16.928 -14.365
  953   1HG   LYS  36          2HG       LYS  36   3.217  17.803 -16.551
  954   2HG   LYS  36          3HG       LYS  36   4.973  17.652 -16.636
  955   1HD   LYS  36          2HD       LYS  36   4.699  15.658 -17.583
  956   2HD   LYS  36          3HD       LYS  36   4.004  15.080 -16.067
  957   1HE   LYS  36          2HE       LYS  36   1.792  15.970 -16.865
  958   2HE   LYS  36          3HE       LYS  36   2.552  16.258 -18.430
  959   1HZ   LYS  36          1HZ       LYS  36   2.622  13.592 -17.161
  960   2HZ   LYS  36          2HZ       LYS  36   2.842  13.993 -18.789
  961   3HZ   LYS  36          3HZ       LYS  36   1.301  14.081 -18.099
  962    H    LYS  37           H        LYS  37   5.380  18.825 -11.718
  963    HA   LYS  37           HA       LYS  37   3.085  18.417 -10.240
  964   1HB   LYS  37          2HB       LYS  37   5.608  19.929  -9.798
  965   2HB   LYS  37          3HB       LYS  37   4.279  20.239  -8.689
  966   1HG   LYS  37          2HG       LYS  37   4.571  17.420  -9.033
  967   2HG   LYS  37          3HG       LYS  37   6.137  18.128  -8.630
  968   1HD   LYS  37          2HD       LYS  37   4.950  17.492  -6.607
  969   2HD   LYS  37          3HD       LYS  37   5.116  19.248  -6.694
  970   1HE   LYS  37          2HE       LYS  37   2.694  18.498  -7.991
  971   2HE   LYS  37          3HE       LYS  37   2.753  17.708  -6.417
  972   1HZ   LYS  37          1HZ       LYS  37   2.652  20.562  -7.064
  973   2HZ   LYS  37          2HZ       LYS  37   3.487  20.096  -5.669
  974   3HZ   LYS  37          3HZ       LYS  37   1.851  19.704  -5.846
  975    H    ARG  38           H        ARG  38   1.925  20.149  -8.929
  976    HA   ARG  38           HA       ARG  38   1.624  22.759  -9.986
  977   1HB   ARG  38          2HB       ARG  38  -0.755  22.437 -10.787
  978   2HB   ARG  38          3HB       ARG  38   0.499  21.785 -11.833
  979   1HG   ARG  38          2HG       ARG  38  -0.032  19.593 -11.326
  980   2HG   ARG  38          3HG       ARG  38  -0.826  20.031  -9.812
  981   1HD   ARG  38          2HD       ARG  38  -2.799  20.324 -10.818
  982   2HD   ARG  38          3HD       ARG  38  -2.081  21.256 -12.131
  983    HE   ARG  38           HE       ARG  38  -2.006  19.348 -13.408
  984   1HH1  ARG  38          2HH1      ARG  38  -2.684  18.509 -10.097
  985   2HH1  ARG  38          1HH1      ARG  38  -3.054  16.855 -10.456
  986   1HH2  ARG  38          2HH2      ARG  38  -2.492  17.172 -13.892
  987   2HH2  ARG  38          1HH2      ARG  38  -2.945  16.096 -12.615
  988    H    LYS  39           H        LYS  39  -0.257  23.906  -8.981
  989    HA   LYS  39           HA       LYS  39  -1.519  22.668  -6.710
  990   1HB   LYS  39          2HB       LYS  39  -0.517  23.951  -4.982
  991   2HB   LYS  39          3HB       LYS  39   0.807  23.269  -5.916
  992   1HG   LYS  39          2HG       LYS  39   1.130  25.384  -7.055
  993   2HG   LYS  39          3HG       LYS  39  -0.246  26.077  -6.194
  994   1HD   LYS  39          2HD       LYS  39   2.019  24.885  -4.651
  995   2HD   LYS  39          3HD       LYS  39   2.186  26.501  -5.341
  996   1HE   LYS  39          2HE       LYS  39   1.174  27.252  -3.503
  997   2HE   LYS  39          3HE       LYS  39  -0.307  26.550  -4.149
  998   1HZ   LYS  39          1HZ       LYS  39  -0.163  25.627  -2.056
  999   2HZ   LYS  39          2HZ       LYS  39   1.519  25.459  -2.112
 1000   3HZ   LYS  39          3HZ       LYS  39   0.535  24.418  -3.012
 1001    H    SER  40           H        SER  40  -2.328  24.835  -5.292
 1002    HA   SER  40           HA       SER  40  -3.643  26.555  -7.291
 1003   1HB   SER  40          2HB       SER  40  -4.808  24.851  -5.201
 1004   2HB   SER  40          3HB       SER  40  -5.421  26.504  -5.199
 1005    HG   SER  40           HG       SER  40  -6.692  25.517  -6.641
 1006    H    GLY  41           H        GLY  41  -3.622  26.476  -3.733
 1007   1HA   GLY  41          1HA       GLY  41  -2.005  28.119  -2.676
 1008   2HA   GLY  41          2HA       GLY  41  -2.708  29.282  -3.791
 1009    H    ASN  42           H        ASN  42  -3.124  30.458  -1.753
 1010    HA   ASN  42           HA       ASN  42  -5.779  29.755  -0.751
 1011   1HB   ASN  42          2HB       ASN  42  -3.704  29.078   0.788
 1012   2HB   ASN  42          3HB       ASN  42  -3.837  30.768   1.267
 1013   1HD2  ASN  42          1HD2      ASN  42  -4.823  27.712   1.956
 1014   2HD2  ASN  42          2HD2      ASN  42  -6.259  28.067   2.849
 1015    H    SER  43           H        SER  43  -3.162  32.163  -0.629
 1016    HA   SER  43           HA       SER  43  -3.172  34.432  -0.799
 1017   1HB   SER  43          2HB       SER  43  -5.989  34.474  -1.792
 1018   2HB   SER  43          3HB       SER  43  -4.588  35.388  -2.349
 1019    HG   SER  43           HG       SER  43  -5.443  32.832  -3.040
 1020    H    ARG  44           H        ARG  44  -3.138  35.266   1.197
 1021    HA   ARG  44           HA       ARG  44  -5.617  36.190   2.355
 1022   1HB   ARG  44          2HB       ARG  44  -4.662  33.726   3.204
 1023   2HB   ARG  44          3HB       ARG  44  -4.072  34.844   4.426
 1024   1HG   ARG  44          2HG       ARG  44  -6.108  34.237   5.292
 1025   2HG   ARG  44          3HG       ARG  44  -6.521  35.717   4.425
 1026   1HD   ARG  44          2HD       ARG  44  -7.737  34.621   2.860
 1027   2HD   ARG  44          3HD       ARG  44  -6.679  33.210   2.876
 1028    HE   ARG  44           HE       ARG  44  -8.078  32.241   4.396
 1029   1HH1  ARG  44          2HH1      ARG  44  -8.655  35.674   4.373
 1030   2HH1  ARG  44          1HH1      ARG  44 -10.019  35.584   5.439
 1031   1HH2  ARG  44          2HH2      ARG  44  -9.871  32.109   5.799
 1032   2HH2  ARG  44          1HH2      ARG  44 -10.709  33.555   6.249
 1033    H    GLU  45           H        GLU  45  -5.211  37.548   4.311
 1034    HA   GLU  45           HA       GLU  45  -3.303  39.500   3.812
 1035   1HB   GLU  45          2HB       GLU  45  -3.789  40.334   6.073
 1036   2HB   GLU  45          3HB       GLU  45  -5.258  39.909   5.206
 1037   1HG   GLU  45          2HG       GLU  45  -5.196  37.702   6.413
 1038   2HG   GLU  45          3HG       GLU  45  -3.912  38.381   7.412
 1039    H    ARG  46           H        ARG  46  -3.034  36.514   5.571
 1040    HA   ARG  46           HA       ARG  46  -0.379  37.261   6.565
 1041   1HB   ARG  46          2HB       ARG  46  -2.208  36.156   8.022
 1042   2HB   ARG  46          3HB       ARG  46  -1.789  34.677   7.167
 1043   1HG   ARG  46          2HG       ARG  46   0.411  34.690   8.024
 1044   2HG   ARG  46          3HG       ARG  46   0.243  36.344   8.620
 1045   1HD   ARG  46          2HD       ARG  46  -0.147  35.286  10.579
 1046   2HD   ARG  46          3HD       ARG  46  -1.785  35.186   9.936
 1047    HE   ARG  46           HE       ARG  46  -0.356  32.941   9.070
 1048   1HH1  ARG  46          2HH1      ARG  46  -1.605  34.321  12.013
 1049   2HH1  ARG  46          1HH1      ARG  46  -1.818  32.789  12.794
 1050   1HH2  ARG  46          2HH2      ARG  46  -0.633  30.918  10.088
 1051   2HH2  ARG  46          1HH2      ARG  46  -1.264  30.854  11.698
 1052    H    CYS  47           H        CYS  47   1.354  35.419   6.479
 1053    HA   CYS  47           HA       CYS  47   1.117  34.163   3.841
 1054   1HB   CYS  47          2HB       CYS  47   2.773  35.983   3.837
 1055   2HB   CYS  47          3HB       CYS  47   3.622  35.239   5.178
 1056    H    GLN  48           H        GLN  48   1.002  32.030   4.029
 1057    HA   GLN  48           HA       GLN  48   1.838  30.711   6.498
 1058   1HB   GLN  48          2HB       GLN  48  -0.369  30.394   4.844
 1059   2HB   GLN  48          3HB       GLN  48   0.635  28.999   4.474
 1060   1HG   GLN  48          2HG       GLN  48  -0.576  28.145   6.190
 1061   2HG   GLN  48          3HG       GLN  48   0.769  28.833   7.100
 1062   1HE2  GLN  48          1HE2      GLN  48  -2.501  28.588   6.959
 1063   2HE2  GLN  48          2HE2      GLN  48  -2.937  29.978   7.888
 1064    H    LEU  49           H        LEU  49   3.807  31.661   4.575
 1065    HA   LEU  49           HA       LEU  49   5.073  29.078   3.950
 1066   1HB   LEU  49          2HB       LEU  49   4.237  31.005   2.101
 1067   2HB   LEU  49          3HB       LEU  49   5.986  31.186   2.213
 1068    HG   LEU  49           HG       LEU  49   4.935  28.438   1.848
 1069   1HD1  LEU  49          1HD1      LEU  49   3.555  29.285   0.219
 1070   2HD1  LEU  49          2HD1      LEU  49   5.036  29.010  -0.697
 1071   3HD1  LEU  49          3HD1      LEU  49   4.630  30.635  -0.145
 1072   1HD2  LEU  49          1HD2      LEU  49   7.371  29.998   1.320
 1073   2HD2  LEU  49          2HD2      LEU  49   6.947  28.814   0.081
 1074   3HD2  LEU  49          3HD2      LEU  49   7.179  28.299   1.754
 1075    H    CYS  50           H        CYS  50   5.476  32.523   4.879
 1076    HA   CYS  50           HA       CYS  50   8.093  31.739   5.923
 1077   1HB   CYS  50          2HB       CYS  50   9.148  33.703   5.175
 1078   2HB   CYS  50          3HB       CYS  50   8.248  33.127   3.785
 1079    H    ASN  51           H        ASN  51   5.162  32.188   6.769
 1080    HA   ASN  51           HA       ASN  51   4.013  32.962   8.572
 1081   1HB   ASN  51          2HB       ASN  51   6.721  32.524   9.465
 1082   2HB   ASN  51          3HB       ASN  51   6.003  33.872  10.342
 1083   1HD2  ASN  51          1HD2      ASN  51   5.757  30.476   9.601
 1084   2HD2  ASN  51          2HD2      ASN  51   4.695  30.067  10.901
 1085    H    GLY  52           H        GLY  52   5.080  34.834   6.433
 1086   1HA   GLY  52          1HA       GLY  52   5.637  37.345   7.593
 1087   2HA   GLY  52          2HA       GLY  52   5.031  37.081   5.965
 1088    H    MET  53           H        MET  53   4.285  39.251   7.604
 1089    HA   MET  53           HA       MET  53   1.435  38.636   8.027
 1090   1HB   MET  53          2HB       MET  53   3.017  39.218  10.072
 1091   2HB   MET  53          3HB       MET  53   2.726  40.866   9.531
 1092   1HG   MET  53          2HG       MET  53   0.907  40.807  10.797
 1093   2HG   MET  53          3HG       MET  53   0.209  39.774   9.552
 1094   1HE   MET  53          1HE       MET  53   0.439  39.712  13.487
 1095   2HE   MET  53          2HE       MET  53   1.868  38.687  13.623
 1096   3HE   MET  53          3HE       MET  53   1.958  40.214  12.743
 1097    H    GLY  54           H        GLY  54   0.691  39.369   6.071
 1098   1HA   GLY  54          1HA       GLY  54  -0.225  41.790   5.585
 1099   2HA   GLY  54          2HA       GLY  54   1.467  42.046   5.182
 1100    H    HIS  55           H        HIS  55   2.286  40.038   3.751
 1101    HA   HIS  55           HA       HIS  55   0.665  40.196   1.351
 1102   1HB   HIS  55          2HB       HIS  55   2.590  39.121   0.250
 1103   2HB   HIS  55          3HB       HIS  55   3.073  40.548   1.162
 1104    HD1  HIS  55           HD1      HIS  55   4.180  40.010   3.575
 1105    HD2  HIS  55           HD2      HIS  55   3.961  36.855   0.880
 1106    HE1  HIS  55           HE1      HIS  55   5.804  38.287   4.424
 1107    H    ASN  56           H        ASN  56   1.083  37.910   0.020
 1108    HA   ASN  56           HA       ASN  56  -0.109  35.831   1.736
 1109   1HB   ASN  56          2HB       ASN  56  -1.337  35.070  -0.313
 1110   2HB   ASN  56          3HB       ASN  56  -1.824  36.660   0.265
 1111   1HD2  ASN  56          1HD2      ASN  56  -1.171  34.948  -2.416
 1112   2HD2  ASN  56          2HD2      ASN  56  -0.692  36.220  -3.483
 1113    H    ALA  57           H        ALA  57   0.365  33.643   1.193
 1114    HA   ALA  57           HA       ALA  57   3.029  33.099   0.645
 1115   1HB   ALA  57          1HB       ALA  57   2.003  30.729   0.078
 1116   2HB   ALA  57          2HB       ALA  57   2.035  31.356   1.727
 1117   3HB   ALA  57          3HB       ALA  57   0.556  31.460   0.773
 1118    H    LYS  58           H        LYS  58   0.227  32.958  -1.526
 1119    HA   LYS  58           HA       LYS  58   1.501  31.921  -3.778
 1120   1HB   LYS  58          2HB       LYS  58  -1.033  33.020  -3.153
 1121   2HB   LYS  58          3HB       LYS  58  -0.446  33.869  -4.576
 1122   1HG   LYS  58          2HG       LYS  58  -0.764  30.891  -4.264
 1123   2HG   LYS  58          3HG       LYS  58  -1.764  31.969  -5.242
 1124   1HD   LYS  58          2HD       LYS  58  -0.390  31.586  -6.950
 1125   2HD   LYS  58          3HD       LYS  58   0.876  32.432  -6.058
 1126   1HE   LYS  58          2HE       LYS  58   1.594  30.201  -6.788
 1127   2HE   LYS  58          3HE       LYS  58   1.579  30.350  -5.031
 1128   1HZ   LYS  58          1HZ       LYS  58  -0.687  29.189  -6.543
 1129   2HZ   LYS  58          2HZ       LYS  58  -0.375  29.080  -4.884
 1130   3HZ   LYS  58          3HZ       LYS  58   0.605  28.250  -5.986
 1131    H    GLN  59           H        GLN  59   1.682  35.057  -2.352
 1132    HA   GLN  59           HA       GLN  59   3.201  36.031  -4.680
 1133   1HB   GLN  59          2HB       GLN  59   1.006  37.201  -3.425
 1134   2HB   GLN  59          3HB       GLN  59   2.387  38.104  -2.817
 1135   1HG   GLN  59          2HG       GLN  59   2.541  37.682  -5.677
 1136   2HG   GLN  59          3HG       GLN  59   1.060  38.514  -5.205
 1137   1HE2  GLN  59          1HE2      GLN  59   3.414  39.476  -6.668
 1138   2HE2  GLN  59          2HE2      GLN  59   3.990  40.843  -5.782
 1139    H    CYS  60           H        CYS  60   4.017  34.428  -2.119
 1140    HA   CYS  60           HA       CYS  60   5.709  36.369  -0.825
 1141   1HB   CYS  60          2HB       CYS  60   4.592  34.651   0.527
 1142   2HB   CYS  60          3HB       CYS  60   5.397  33.382  -0.374
 1143    H    ARG  61           H        ARG  61   7.747  36.722  -1.431
 1144    HA   ARG  61           HA       ARG  61   8.889  35.219  -3.637
 1145   1HB   ARG  61          2HB       ARG  61  10.027  37.610  -2.179
 1146   2HB   ARG  61          3HB       ARG  61  10.565  36.968  -3.725
 1147   1HG   ARG  61          2HG       ARG  61   9.186  38.375  -4.727
 1148   2HG   ARG  61          3HG       ARG  61   7.831  37.487  -4.027
 1149   1HD   ARG  61          2HD       ARG  61   7.519  39.009  -2.353
 1150   2HD   ARG  61          3HD       ARG  61   9.218  39.480  -2.318
 1151    HE   ARG  61           HE       ARG  61   8.701  41.169  -3.753
 1152   1HH1  ARG  61          2HH1      ARG  61   6.280  38.687  -4.062
 1153   2HH1  ARG  61          1HH1      ARG  61   5.311  39.588  -5.181
 1154   1HH2  ARG  61          2HH2      ARG  61   7.435  42.366  -5.225
 1155   2HH2  ARG  61          1HH2      ARG  61   5.970  41.680  -5.842
 1156    H    LYS  62           H        LYS  62  10.680  33.944  -3.552
 1157    HA   LYS  62           HA       LYS  62  11.383  32.811  -1.032
 1158   1HB   LYS  62          2HB       LYS  62  12.885  32.434  -3.619
 1159   2HB   LYS  62          3HB       LYS  62  12.775  31.322  -2.261
 1160   1HG   LYS  62          2HG       LYS  62  11.228  30.293  -3.499
 1161   2HG   LYS  62          3HG       LYS  62  10.158  31.588  -2.955
 1162   1HD   LYS  62          2HD       LYS  62  10.149  32.610  -4.976
 1163   2HD   LYS  62          3HD       LYS  62  11.827  32.181  -5.320
 1164   1HE   LYS  62          2HE       LYS  62  11.134  29.884  -5.805
 1165   2HE   LYS  62          3HE       LYS  62   9.460  30.315  -5.461
 1166   1HZ   LYS  62          1HZ       LYS  62  10.168  32.153  -7.297
 1167   2HZ   LYS  62          2HZ       LYS  62   9.355  30.711  -7.643
 1168   3HZ   LYS  62          3HZ       LYS  62  11.033  30.799  -7.826
 1169    H    ARG  63           H        ARG  63  13.913  32.417  -0.731
 1170    HA   ARG  63           HA       ARG  63  14.988  35.006  -0.102
 1171   1HB   ARG  63          2HB       ARG  63  15.213  32.876   1.293
 1172   2HB   ARG  63          3HB       ARG  63  16.437  32.375   0.134
 1173   1HG   ARG  63          2HG       ARG  63  17.692  34.457   0.654
 1174   2HG   ARG  63          3HG       ARG  63  16.514  34.791   1.924
 1175   1HD   ARG  63          2HD       ARG  63  17.223  32.213   2.470
 1176   2HD   ARG  63          3HD       ARG  63  18.735  32.882   1.862
 1177    HE   ARG  63           HE       ARG  63  17.436  33.510   4.347
 1178   1HH1  ARG  63          2HH1      ARG  63  19.645  34.642   1.905
 1179   2HH1  ARG  63          1HH1      ARG  63  20.465  35.736   2.969
 1180   1HH2  ARG  63          2HH2      ARG  63  18.508  34.947   5.758
 1181   2HH2  ARG  63          1HH2      ARG  63  19.818  35.909   5.160
 1182    H    ASP  64           H        ASP  64  15.284  35.952  -2.160
 1183    HA   ASP  64           HA       ASP  64  17.577  34.864  -3.659
 1184   1HB   ASP  64          2HB       ASP  64  16.564  36.103  -5.642
 1185   2HB   ASP  64          3HB       ASP  64  15.710  34.660  -5.104
  Start of MODEL   19
    1   1H5*    C 160          1H5*        C 160  13.513  12.099 -18.242
    2   2H5*    C 160          2H5*        C 160  13.505  13.430 -17.085
    3    H4*    C 160           H4*        C 160  13.832  11.457 -15.835
    4    H3*    C 160           H3*        C 160  16.369  13.045 -16.164
    5    H2*    C 160           H2*        C 160  17.476  11.536 -14.694
    6   2HO*    C 160          2HO*        C 160  15.241   9.883 -14.377
    7    H1*    C 160           H1*        C 160  16.475   9.272 -16.039
    8   1H4     C 160          1H4         C 160  22.317  10.148 -18.466
    9   2H4     C 160          2H4         C 160  21.670  11.357 -19.552
   10    H5     C 160           H5         C 160  19.436  12.123 -19.487
   11    H6     C 160           H6         C 160  17.253  11.915 -18.353
   12   1H5*    U 161          1H5*        U 161  15.763  12.928 -11.719
   13   2H5*    U 161          2H5*        U 161  16.382  14.468 -11.124
   14    H4*    U 161           H4*        U 161  17.494  12.498 -10.127
   15    H3*    U 161           H3*        U 161  19.121  14.504 -11.674
   16    H2*    U 161           H2*        U 161  21.104  13.364 -11.033
   17   2HO*    U 161          2HO*        U 161  20.741  12.695  -8.984
   18    H1*    U 161           H1*        U 161  20.072  10.838 -11.699
   19    H3     U 161           H3         U 161  23.409  11.992 -14.669
   20    H5     U 161           H5         U 161  19.863  13.546 -16.266
   21    H6     U 161           H6         U 161  18.777  12.987 -14.139
   22   1H5*    G 162          1H5*        G 162  20.857  14.631  -7.473
   23   2H5*    G 162          2H5*        G 162  21.179  16.345  -7.209
   24    H4*    G 162           H4*        G 162  23.163  14.991  -6.809
   25    H3*    G 162           H3*        G 162  23.231  16.963  -9.073
   26    H2*    G 162           H2*        G 162  25.525  16.449  -9.457
   27   2HO*    G 162          2HO*        G 162  26.621  15.323  -7.833
   28    H1*    G 162           H1*        G 162  25.079  13.695  -9.498
   29    H8     G 162           H8         G 162  22.146  15.255 -11.116
   30    H1     G 162           H1         G 162  27.301  14.971 -15.020
   31   1H2     G 162          1H2         G 162  28.970  14.463 -13.920
   32   2H2     G 162          2H2         G 162  28.972  14.159 -12.197
   33   1H5*    C 163          1H5*        C 163  26.495  17.485  -6.740
   34   2H5*    C 163          2H5*        C 163  26.859  19.130  -6.221
   35    H4*    C 163           H4*        C 163  28.843  18.330  -7.170
   36    H3*    C 163           H3*        C 163  27.371  20.164  -9.038
   37    H2*    C 163           H2*        C 163  29.139  19.991 -10.619
   38   2HO*    C 163          2HO*        C 163  30.792  18.245  -9.451
   39    H1*    C 163           H1*        C 163  29.227  17.189 -10.449
   40   1H4     C 163          1H4         C 163  25.517  18.343 -15.514
   41   2H4     C 163          2H4         C 163  24.164  18.635 -14.445
   42    H5     C 163           H5         C 163  24.332  18.677 -12.090
   43    H6     C 163           H6         C 163  25.855  18.446 -10.160
   44   1H5*    C 164          1H5*        C 164  31.297  21.726  -8.885
   45   2H5*    C 164          2H5*        C 164  31.242  23.452  -8.524
   46    H4*    C 164           H4*        C 164  32.558  23.208 -10.469
   47    H3*    C 164           H3*        C 164  29.816  24.298 -11.008
   48    H2*    C 164           H2*        C 164  30.319  24.511 -13.316
   49   2HO*    C 164          2HO*        C 164  32.879  23.436 -13.137
   50    H1*    C 164           H1*        C 164  31.427  21.914 -13.463
   51   1H4     C 164          1H4         C 164  25.490  21.194 -15.682
   52   2H4     C 164          2H4         C 164  24.874  21.237 -14.045
   53    H5     C 164           H5         C 164  26.214  21.661 -12.148
   54    H6     C 164           H6         C 164  28.497  22.152 -11.345
   55   1H5*    C 165          1H5*        C 165  32.662  26.831 -12.719
   56   2H5*    C 165          2H5*        C 165  32.298  28.555 -12.660
   57    H4*    C 165           H4*        C 165  32.589  27.887 -14.945
   58    H3*    C 165           H3*        C 165  29.767  28.589 -14.168
   59    H2*    C 165           H2*        C 165  29.107  28.374 -16.439
   60   2HO*    C 165          2HO*        C 165  30.832  29.208 -17.524
   61    H1*    C 165           H1*        C 165  30.501  25.924 -16.739
   62   1H4     C 165          1H4         C 165  24.397  24.273 -15.809
   63   2H4     C 165          2H4         C 165  24.640  24.423 -14.082
   64    H5     C 165           H5         C 165  26.630  25.231 -13.099
   65    H6     C 165           H6         C 165  28.900  26.101 -13.535
   66   1H5*    U 166          1H5*        U 166  30.806  31.697 -17.286
   67   2H5*    U 166          2H5*        U 166  29.911  33.140 -16.807
   68    H4*    U 166           H4*        U 166  29.369  32.322 -19.085
   69    H3*    U 166           H3*        U 166  27.205  32.551 -17.007
   70    H2*    U 166           H2*        U 166  25.585  32.009 -18.661
   71   2HO*    U 166          2HO*        U 166  27.328  31.585 -20.749
   72    H1*    U 166           H1*        U 166  27.066  29.810 -19.604
   73    H3     U 166           H3         U 166  23.252  28.282 -17.524
   74    H5     U 166           H5         U 166  26.112  28.688 -14.493
   75    H6     U 166           H6         U 166  27.535  29.836 -16.126
   76   1H5*    C 167          1H5*        C 167  26.054  34.798 -20.358
   77   2H5*    C 167          2H5*        C 167  25.426  36.394 -19.952
   78    H4*    C 167           H4*        C 167  23.802  35.372 -21.317
   79    H3*    C 167           H3*        C 167  23.030  35.421 -18.417
   80    H2*    C 167           H2*        C 167  20.928  34.444 -18.942
   81   2HO*    C 167          2HO*        C 167  20.303  35.191 -20.885
   82    H1*    C 167           H1*        C 167  22.091  32.446 -20.553
   83   1H4     C 167          1H4         C 167  21.225  29.641 -14.882
   84   2H4     C 167          2H4         C 167  22.704  30.376 -14.306
   85    H5     C 167           H5         C 167  23.972  31.931 -15.552
   86    H6     C 167           H6         C 167  24.135  33.175 -17.678
   87   1H5*    A 168          1H5*        A 168  21.398  39.862 -17.479
   88   2H5*    A 168          2H5*        A 168  22.569  39.268 -16.302
   89    H4*    A 168           H4*        A 168  20.604  39.467 -15.080
   90    H3*    A 168           H3*        A 168  21.001  36.612 -15.935
   91    H2*    A 168           H2*        A 168  19.061  35.979 -14.731
   92   2HO*    A 168          2HO*        A 168  18.124  37.675 -13.340
   93    H1*    A 168           H1*        A 168  17.582  38.203 -15.726
   94    H8     A 168           H8         A 168  19.759  35.663 -17.617
   95   1H6     A 168          1H6         A 168  14.354  33.432 -19.798
   96   2H6     A 168          2H6         A 168  16.092  33.245 -19.859
   97    H2     A 168           H2         A 168  13.456  36.785 -17.025
   98   1H5*    U 169          1H5*        U 169  25.147  36.215 -13.094
   99   2H5*    U 169          2H5*        U 169  24.329  34.824 -12.382
  100    H4*    U 169           H4*        U 169  24.216  36.374 -10.252
  101    H3*    U 169           H3*        U 169  26.354  37.698 -11.903
  102    H2*    U 169           H2*        U 169  27.619  38.092  -9.932
  103   2HO*    U 169          2HO*        U 169  25.787  36.820  -8.245
  104    H1*    U 169           H1*        U 169  27.293  35.460  -8.998
  105    H3     U 169           H3         U 169  31.667  35.345 -10.062
  106    H5     U 169           H5         U 169  29.788  35.680 -13.790
  107    H6     U 169           H6         U 169  27.667  35.937 -12.587
  108   1H5*    C 170          1H5*        C 170  23.990  39.550 -13.692
  109   2H5*    C 170          2H5*        C 170  24.491  41.230 -13.884
  110    H4*    C 170           H4*        C 170  22.330  41.190 -14.735
  111    H3*    C 170           H3*        C 170  22.336  42.235 -11.921
  112    H2*    C 170           H2*        C 170  19.993  42.599 -12.029
  113   2HO*    C 170          2HO*        C 170  19.845  41.578 -14.657
  114    H1*    C 170           H1*        C 170  19.508  40.045 -13.145
  115   1H4     C 170          1H4         C 170  18.230  39.402  -6.918
  116   2H4     C 170          2H4         C 170  19.936  39.170  -6.610
  117    H5     C 170           H5         C 170  21.612  39.388  -8.259
  118    H6     C 170           H6         C 170  22.068  39.887 -10.633
  119   1H5*    C 171          1H5*        C 171  20.082  45.064 -13.892
  120   2H5*    C 171          2H5*        C 171  20.724  46.682 -13.606
  121    H4*    C 171           H4*        C 171  18.454  46.757 -12.987
  122    H3*    C 171           H3*        C 171  20.314  46.681 -10.636
  123    H2*    C 171           H2*        C 171  18.483  46.811  -9.133
  124   2HO*    C 171          2HO*        C 171  16.414  47.335 -10.044
  125    H1*    C 171           H1*        C 171  17.029  44.808 -10.493
  126   1H4     C 171          1H4         C 171  19.819  41.798  -5.595
  127   2H4     C 171          2H4         C 171  21.277  41.639  -6.549
  128    H5     C 171           H5         C 171  21.568  42.615  -8.679
  129    H6     C 171           H6         C 171  20.522  43.997 -10.438
  130   1H5*    G 172          1H5*        G 172  17.665  50.136  -9.920
  131   2H5*    G 172          2H5*        G 172  18.741  51.491  -9.585
  132    H4*    G 172           H4*        G 172  17.119  51.438  -7.859
  133    H3*    G 172           H3*        G 172  19.838  50.500  -7.003
  134    H2*    G 172           H2*        G 172  19.064  50.260  -4.763
  135   2HO*    G 172          2HO*        G 172  16.460  51.044  -5.600
  136    H1*    G 172           H1*        G 172  16.823  48.778  -5.514
  137    H8     G 172           H8         G 172  19.662  47.828  -7.723
  138    H1     G 172           H1         G 172  19.818  44.890  -1.957
  139   1H2     G 172          1H2         G 172  18.429  45.758  -0.705
  140   2H2     G 172          2H2         G 172  17.378  47.084  -1.149
  141   1H5*    U 173          1H5*        U 173  18.549  53.202  -4.054
  142   2H5*    U 173          2H5*        U 173  19.792  54.424  -3.791
  143    H4*    U 173           H4*        U 173  19.205  53.536  -1.672
  144    H3*    U 173           H3*        U 173  21.890  52.625  -2.670
  145    H2*    U 173           H2*        U 173  22.270  51.485  -0.623
  146   2HO*    U 173          2HO*        U 173  19.718  52.418   0.267
  147    H1*    U 173           H1*        U 173  19.712  50.298  -0.629
  148    H3     U 173           H3         U 173  22.684  46.884  -1.236
  149    H5     U 173           H5         U 173  22.276  48.628  -5.021
  150    H6     U 173           H6         U 173  20.993  50.421  -3.948
  151   1H5*    C 174          1H5*        C 174  22.471  54.071   1.077
  152   2H5*    C 174          2H5*        C 174  23.791  55.228   1.249
  153    H4*    C 174           H4*        C 174  24.244  53.576   2.832
  154    H3*    C 174           H3*        C 174  25.918  53.165   0.363
  155    H2*    C 174           H2*        C 174  27.047  51.381   1.445
  156   2HO*    C 174          2HO*        C 174  25.843  51.244   3.817
  157    H1*    C 174           H1*        C 174  24.619  50.260   2.397
  158   1H4     C 174          1H4         C 174  26.067  46.726  -2.714
  159   2H4     C 174          2H4         C 174  25.521  48.017  -3.760
  160    H5     C 174           H5         C 174  24.823  50.135  -2.982
  161    H6     C 174           H6         C 174  24.476  51.550  -0.989
  162   1H5*    U 175          1H5*        U 175  28.968  56.535  -0.631
  163   2H5*    U 175          2H5*        U 175  28.141  55.003  -0.913
  164    H4*    U 175           H4*        U 175  29.994  53.756  -0.027
  165    H3*    U 175           H3*        U 175  31.048  56.419   0.894
  166    H2*    U 175           H2*        U 175  33.272  55.611   0.653
  167   2HO*    U 175          2HO*        U 175  33.516  53.327   0.274
  168    H1*    U 175           H1*        U 175  32.769  54.565  -1.913
  169    H3     U 175           H3         U 175  35.622  58.065  -2.554
  170    H5     U 175           H5         U 175  31.858  59.841  -2.094
  171    H6     U 175           H6         U 175  31.001  57.629  -1.468
  172   1H5*    C 176          1H5*        C 176  29.479  53.525   3.604
  173   2H5*    C 176          2H5*        C 176  29.355  53.753   5.348
  174    H4*    C 176           H4*        C 176  30.724  51.949   5.824
  175    H3*    C 176           H3*        C 176  31.932  52.319   3.091
  176    H2*    C 176           H2*        C 176  32.612  50.044   3.109
  177   2HO*    C 176          2HO*        C 176  31.721  49.097   5.402
  178    H1*    C 176           H1*        C 176  30.090  49.147   4.004
  179   1H4     C 176          1H4         C 176  30.061  48.297  -2.336
  180   2H4     C 176          2H4         C 176  29.507  49.945  -2.525
  181    H5     C 176           H5         C 176  29.308  51.480  -0.741
  182    H6     C 176           H6         C 176  29.596  51.813   1.689
  183   1H5*    G 177          1H5*        G 177  35.698  50.828   5.493
  184   2H5*    G 177          2H5*        G 177  36.853  51.971   4.810
  185    H4*    G 177           H4*        G 177  37.609  49.658   4.582
  186    H3*    G 177           H3*        G 177  37.070  51.244   2.088
  187    H2*    G 177           H2*        G 177  37.884  49.437   0.764
  188   2HO*    G 177          2HO*        G 177  38.296  47.694   2.882
  189    H1*    G 177           H1*        G 177  36.294  47.546   2.060
  190    H8     G 177           H8         G 177  34.294  50.650   1.814
  191    H1     G 177           H1         G 177  34.448  47.316  -3.730
  192   1H2     G 177          1H2         G 177  35.883  45.839  -3.606
  193   2H2     G 177          2H2         G 177  36.893  45.548  -2.207
  194   1H5*    C 178          1H5*        C 178  40.861  49.645   1.757
  195   2H5*    C 178          2H5*        C 178  42.085  50.782   1.189
  196    H4*    C 178           H4*        C 178  42.126  48.865  -0.230
  197    H3*    C 178           H3*        C 178  40.991  51.343  -1.492
  198    H2*    C 178           H2*        C 178  40.763  50.205  -3.560
  199   2HO*    C 178          2HO*        C 178  42.515  48.906  -3.696
  200    H1*    C 178           H1*        C 178  39.625  47.917  -2.328
  201   1H4     C 178          1H4         C 178  34.647  51.132  -4.709
  202   2H4     C 178          2H4         C 178  34.685  52.195  -3.320
  203    H5     C 178           H5         C 178  36.354  52.118  -1.650
  204    H6     C 178           H6         C 178  38.417  50.991  -0.894
  205   1H5*    U 179          1H5*        U 179  44.633  50.403  -4.071
  206   2H5*    U 179          2H5*        U 179  45.164  51.972  -4.676
  207    H4*    U 179           H4*        U 179  44.541  50.309  -6.435
  208    H3*    U 179           H3*        U 179  43.223  53.011  -6.306
  209    H2*    U 179           H2*        U 179  42.089  52.541  -8.338
  210   2HO*    U 179          2HO*        U 179  42.756  50.291  -9.230
  211    H1*    U 179           H1*        U 179  41.288  49.980  -7.494
  212    H3     U 179           H3         U 179  37.586  52.705  -7.797
  213    H5     U 179           H5         U 179  39.117  53.293  -3.943
  214    H6     U 179           H6         U 179  41.087  52.008  -4.638
  215   1H5*    U 180          1H5*        U 180  44.633  52.558  -9.958
  216   2H5*    U 180          2H5*        U 180  45.505  53.878 -10.737
  217    H4*    U 180           H4*        U 180  43.664  53.324 -12.126
  218    H3*    U 180           H3*        U 180  43.361  55.916 -10.649
  219    H2*    U 180           H2*        U 180  41.267  56.310 -11.687
  220   2HO*    U 180          2HO*        U 180  40.753  54.401 -13.291
  221    H1*    U 180           H1*        U 180  40.395  53.643 -11.222
  222    H3     U 180           H3         U 180  37.500  56.012  -8.680
  223    H5     U 180           H5         U 180  41.132  56.358  -6.625
  224    H6     U 180           H6         U 180  42.200  55.230  -8.522
  225   1H5*    A 181          1H5*        A 181  45.180  57.845 -14.729
  226   2H5*    A 181          2H5*        A 181  45.723  59.350 -13.989
  227    H4*    A 181           H4*        A 181  43.796  59.527 -15.609
  228    H3*    A 181           H3*        A 181  43.671  60.652 -12.820
  229    H2*    A 181           H2*        A 181  41.562  61.621 -13.322
  230   2HO*    A 181          2HO*        A 181  40.897  61.525 -15.587
  231    H1*    A 181           H1*        A 181  40.551  59.265 -14.460
  232    H8     A 181           H8         A 181  42.679  58.600 -11.439
  233   1H6     A 181          1H6         A 181  37.473  59.251  -8.060
  234   2H6     A 181          2H6         A 181  39.155  58.778  -7.993
  235    H2     A 181           H2         A 181  36.572  60.445 -12.244
  236   1H5*    U 182          1H5*        U 182  43.644  64.761 -11.794
  237   2H5*    U 182          2H5*        U 182  44.527  63.928 -10.515
  238    H4*    U 182           H4*        U 182  41.761  63.332 -11.563
  239    H3*    U 182           H3*        U 182  42.845  64.401  -8.982
  240    H2*    U 182           H2*        U 182  41.122  63.309  -7.763
  241   2HO*    U 182          2HO*        U 182  39.401  63.530  -9.133
  242    H1*    U 182           H1*        U 182  41.525  60.845  -8.963
  243    H3     U 182           H3         U 182  43.308  60.517  -4.770
  244    H5     U 182           H5         U 182  46.313  62.311  -7.069
  245    H6     U 182           H6         U 182  44.673  62.506  -8.883
  246   1H5*    U 183          1H5*        U 183  38.324  68.256  -8.349
  247   2H5*    U 183          2H5*        U 183  39.956  68.358  -7.690
  248    H4*    U 183           H4*        U 183  38.587  65.857  -7.010
  249    H3*    U 183           H3*        U 183  37.231  68.450  -6.380
  250    H2*    U 183           H2*        U 183  36.753  67.723  -4.168
  251   2HO*    U 183          2HO*        U 183  37.765  65.372  -3.881
  252    H1*    U 183           H1*        U 183  39.356  66.926  -3.635
  253    H3     U 183           H3         U 183  39.316  70.780  -1.316
  254    H5     U 183           H5         U 183  39.138  72.071  -5.296
  255    H6     U 183           H6         U 183  38.955  69.715  -5.949
  256   1H5*    C 184          1H5*        C 184  32.825  68.111  -5.086
  257   2H5*    C 184          2H5*        C 184  33.777  68.309  -3.614
  258    H4*    C 184           H4*        C 184  31.797  66.232  -4.346
  259    H3*    C 184           H3*        C 184  32.535  67.795  -1.897
  260    H2*    C 184           H2*        C 184  31.640  66.096  -0.496
  261   2HO*    C 184          2HO*        C 184  30.989  64.421  -2.653
  262    H1*    C 184           H1*        C 184  32.990  64.036  -1.817
  263   1H4     C 184          1H4         C 184  36.721  65.735   3.107
  264   2H4     C 184          2H4         C 184  37.562  66.829   2.032
  265    H5     C 184           H5         C 184  36.888  67.270  -0.188
  266    H6     C 184           H6         C 184  35.223  66.766  -1.940
  267   1H5*    G 185          1H5*        G 185  27.523  69.705  -0.901
  268   2H5*    G 185          2H5*        G 185  27.552  68.369   0.251
  269    H4*    G 185           H4*        G 185  25.342  68.471  -0.504
  270    H3*    G 185           H3*        G 185  26.871  66.256  -1.830
  271    H2*    G 185           H2*        G 185  24.904  65.574  -2.990
  272   2HO*    G 185          2HO*        G 185  23.126  67.428  -2.282
  273    H1*    G 185           H1*        G 185  24.345  68.148  -3.909
  274    H8     G 185           H8         G 185  28.032  67.691  -3.925
  275    H1     G 185           H1         G 185  25.116  65.026  -9.052
  276   1H2     G 185          1H2         G 185  23.076  65.012  -8.752
  277   2H2     G 185          2H2         G 185  22.275  65.630  -7.327
  278   1H5*    G 186          1H5*        G 186  28.298  63.295   1.490
  279   2H5*    G 186          2H5*        G 186  28.402  63.233  -0.271
  280    H4*    G 186           H4*        G 186  28.243  60.999   0.595
  281    H3*    G 186           H3*        G 186  25.868  61.997  -0.940
  282    H2*    G 186           H2*        G 186  24.807  59.875  -0.721
  283   2HO*    G 186          2HO*        G 186  27.047  58.994   0.814
  284    H1*    G 186           H1*        G 186  25.218  59.762   2.037
  285    H8     G 186           H8         G 186  24.373  63.035   0.238
  286    H1     G 186           H1         G 186  19.387  60.080   3.117
  287   1H2     G 186          1H2         G 186  20.014  58.281   3.904
  288   2H2     G 186          2H2         G 186  21.647  57.664   3.799
  289   1H5*    G 187          1H5*        G 187  27.350  59.407  -5.007
  290   2H5*    G 187          2H5*        G 187  28.861  60.143  -4.475
  291    H4*    G 187           H4*        G 187  27.154  61.396  -6.621
  292    H3*    G 187           H3*        G 187  29.005  59.065  -6.899
  293    H2*    G 187           H2*        G 187  29.920  59.955  -8.912
  294   2HO*    G 187          2HO*        G 187  28.403  62.317  -8.719
  295    H1*    G 187           H1*        G 187  30.413  62.459  -7.785
  296    H8     G 187           H8         G 187  31.121  60.054  -5.098
  297    H1     G 187           H1         G 187  35.846  60.271  -9.516
  298   1H2     G 187          1H2         G 187  35.192  61.309 -11.173
  299   2H2     G 187          2H2         G 187  33.600  62.014 -11.341
  300   1H5*    G 188          1H5*        G 188  27.990  59.859 -10.857
  301   2H5*    G 188          2H5*        G 188  26.956  58.506 -11.318
  302    H4*    G 188           H4*        G 188  28.422  58.676 -13.100
  303    H3*    G 188           H3*        G 188  29.389  56.550 -11.207
  304    H2*    G 188           H2*        G 188  31.167  56.035 -12.708
  305   2HO*    G 188          2HO*        G 188  30.290  58.117 -14.438
  306    H1*    G 188           H1*        G 188  31.942  58.708 -12.969
  307    H8     G 188           H8         G 188  30.973  58.337  -9.445
  308    H1     G 188           H1         G 188  36.765  55.732 -10.686
  309   1H2     G 188          1H2         G 188  37.040  55.606 -12.726
  310   2H2     G 188          2H2         G 188  35.876  56.128 -13.922
  311   1H5*    A 189          1H5*        A 189  29.497  54.088 -15.082
  312   2H5*    A 189          2H5*        A 189  28.819  52.607 -14.406
  313    H4*    A 189           H4*        A 189  31.085  52.367 -15.434
  314    H3*    A 189           H3*        A 189  30.581  51.571 -12.574
  315    H2*    A 189           H2*        A 189  32.781  50.678 -12.459
  316   2HO*    A 189          2HO*        A 189  33.947  50.526 -14.487
  317    H1*    A 189           H1*        A 189  33.935  52.965 -13.627
  318    H8     A 189           H8         A 189  31.212  53.826 -11.200
  319   1H6     A 189          1H6         A 189  35.603  53.752  -6.766
  320   2H6     A 189          2H6         A 189  33.934  54.156  -7.102
  321    H2     A 189           H2         A 189  37.388  52.172 -10.515
  322   1H5*    G 190          1H5*        G 190  32.227  48.169 -14.788
  323   2H5*    G 190          2H5*        G 190  31.327  46.719 -14.345
  324    H4*    G 190           H4*        G 190  33.665  46.265 -14.139
  325    H3*    G 190           H3*        G 190  32.168  46.454 -11.540
  326    H2*    G 190           H2*        G 190  34.137  45.812 -10.362
  327   2HO*    G 190          2HO*        G 190  35.736  45.753 -12.656
  328    H1*    G 190           H1*        G 190  35.732  47.704 -11.653
  329    H8     G 190           H8         G 190  32.402  49.240 -11.116
  330    H1     G 190           H1         G 190  36.093  49.289  -5.800
  331   1H2     G 190          1H2         G 190  37.743  48.088  -6.095
  332   2H2     G 190          2H2         G 190  38.076  47.199  -7.565
  333   1H5*    C 191          1H5*        C 191  34.049  42.516 -11.485
  334   2H5*    C 191          2H5*        C 191  33.014  41.405 -10.588
  335    H4*    C 191           H4*        C 191  35.268  41.675  -9.608
  336    H3*    C 191           H3*        C 191  32.839  42.392  -7.980
  337    H2*    C 191           H2*        C 191  34.230  42.757  -6.092
  338   2HO*    C 191          2HO*        C 191  36.672  42.298  -6.892
  339    H1*    C 191           H1*        C 191  36.095  44.273  -7.577
  340   1H4     C 191          1H4         C 191  32.364  48.552  -4.632
  341   2H4     C 191          2H4         C 191  31.237  48.446  -5.965
  342    H5     C 191           H5         C 191  31.446  46.907  -7.745
  343    H6     C 191           H6         C 191  32.802  45.074  -8.692
  344   1H5*    G 192          1H5*        G 192  34.718  39.057  -5.420
  345   2H5*    G 192          2H5*        G 192  33.284  38.069  -5.142
  346    H4*    G 192           H4*        G 192  34.343  38.554  -3.041
  347    H3*    G 192           H3*        G 192  31.681  39.867  -3.507
  348    H2*    G 192           H2*        G 192  31.724  40.740  -1.291
  349   2HO*    G 192          2HO*        G 192  34.283  39.724  -0.755
  350    H1*    G 192           H1*        G 192  34.301  41.776  -1.563
  351    H8     G 192           H8         G 192  32.518  42.168  -4.805
  352    H1     G 192           H1         G 192  31.012  46.753  -0.492
  353   1H2     G 192          1H2         G 192  31.762  46.231   1.357
  354   2H2     G 192          2H2         G 192  32.664  44.770   1.689
  355   1H5*    G 193          1H5*        G 193  31.373  37.534   0.111
  356   2H5*    G 193          2H5*        G 193  29.741  36.922   0.379
  357    H4*    G 193           H4*        G 193  30.581  38.407   2.182
  358    H3*    G 193           H3*        G 193  28.055  39.072   0.698
  359    H2*    G 193           H2*        G 193  27.689  40.923   2.153
  360   2HO*    G 193          2HO*        G 193  30.138  40.322   3.478
  361    H1*    G 193           H1*        G 193  30.275  41.918   1.817
  362    H8     G 193           H8         G 193  29.284  40.578  -1.471
  363    H1     G 193           H1         G 193  26.576  46.319  -0.212
  364   1H2     G 193          1H2         G 193  26.852  46.789   1.777
  365   2H2     G 193          2H2         G 193  27.691  45.778   2.932
  366   1H5*    A 194          1H5*        A 194  26.589  38.917   4.931
  367   2H5*    A 194          2H5*        A 194  25.128  37.938   4.799
  368    H4*    A 194           H4*        A 194  24.642  40.045   5.884
  369    H3*    A 194           H3*        A 194  23.415  39.592   3.178
  370    H2*    A 194           H2*        A 194  22.217  41.637   3.378
  371   2HO*    A 194          2HO*        A 194  22.753  42.729   5.597
  372    H1*    A 194           H1*        A 194  24.498  43.068   4.195
  373    H8     A 194           H8         A 194  25.249  40.596   1.476
  374   1H6     A 194          1H6         A 194  23.780  45.116  -2.569
  375   2H6     A 194          2H6         A 194  24.454  43.508  -2.423
  376    H2     A 194           H2         A 194  22.707  46.502   1.513
  377   1H5*    C 195          1H5*        C 195  20.048  40.298   5.905
  378   2H5*    C 195          2H5*        C 195  18.656  39.367   5.352
  379    H4*    C 195           H4*        C 195  18.195  41.770   5.436
  380    H3*    C 195           H3*        C 195  18.087  40.392   2.762
  381    H2*    C 195           H2*        C 195  17.267  42.393   1.784
  382   2HO*    C 195          2HO*        C 195  16.928  44.176   3.486
  383    H1*    C 195           H1*        C 195  19.208  43.986   3.090
  384   1H4     C 195          1H4         C 195  21.458  43.086  -2.826
  385   2H4     C 195          2H4         C 195  22.145  41.563  -2.306
  386    H5     C 195           H5         C 195  21.792  40.621  -0.170
  387    H6     C 195           H6         C 195  20.681  40.909   2.016
  388   1H5*    G 196          1H5*        G 196  13.868  42.032   3.422
  389   2H5*    G 196          2H5*        G 196  12.851  40.696   2.885
  390    H4*    G 196           H4*        G 196  12.178  42.736   1.790
  391    H3*    G 196           H3*        G 196  13.407  40.615   0.060
  392    H2*    G 196           H2*        G 196  13.010  41.943  -1.878
  393   2HO*    G 196          2HO*        G 196  11.293  43.251  -1.657
  394    H1*    G 196           H1*        G 196  14.169  44.223  -0.762
  395    H8     G 196           H8         G 196  16.171  41.350   0.417
  396    H1     G 196           H1         G 196  17.552  43.026  -5.680
  397   1H2     G 196          1H2         G 196  16.129  44.350  -6.369
  398   2H2     G 196          2H2         G 196  14.766  44.922  -5.435
  399   1H5*    A 197          1H5*        A 197  11.550  38.380  -2.749
  400   2H5*    A 197          2H5*        A 197  11.512  39.763  -3.843
  401    H4*    A 197           H4*        A 197   9.057  38.282  -2.873
  402    H3*    A 197           H3*        A 197  10.730  37.876  -5.349
  403    H2*    A 197           H2*        A 197   8.777  37.302  -6.544
  404   2HO*    A 197          2HO*        A 197   7.295  36.273  -5.330
  405    H1*    A 197           H1*        A 197   7.282  39.406  -5.265
  406    H8     A 197           H8         A 197  10.092  38.619  -7.684
  407   1H6     A 197          1H6         A 197   7.860  43.307 -11.148
  408   2H6     A 197          2H6         A 197   9.026  42.003 -11.109
  409    H2     A 197           H2         A 197   5.640  43.242  -7.298
  410   1H5*    U 198          1H5*        U 198  10.112  33.622  -2.138
  411   2H5*    U 198          2H5*        U 198  11.680  34.404  -2.331
  412    H4*    U 198           H4*        U 198  11.803  31.919  -3.706
  413    H3*    U 198           H3*        U 198  10.096  31.708  -1.348
  414    H2*    U 198           H2*        U 198  11.836  31.085   0.023
  415   2HO*    U 198          2HO*        U 198  12.313  28.794  -0.529
  416    H1*    U 198           H1*        U 198  13.419  30.460  -2.529
  417    H3     U 198           H3         U 198  17.537  30.080  -0.832
  418    H5     U 198           H5         U 198  15.414  31.794   2.345
  419    H6     U 198           H6         U 198  13.461  31.876   0.866
  420   1H5*    G 199          1H5*        G 199   7.612  31.505  -4.049
  421   2H5*    G 199          2H5*        G 199   8.660  32.621  -3.172
  422    H4*    G 199           H4*        G 199   6.624  33.719  -3.198
  423    H3*    G 199           H3*        G 199   6.953  32.273  -0.585
  424    H2*    G 199           H2*        G 199   4.891  33.187   0.178
  425   2HO*    G 199          2HO*        G 199   4.012  34.532  -1.947
  426    H1*    G 199           H1*        G 199   3.506  32.442  -2.127
  427    H8     G 199           H8         G 199   6.207  30.145  -0.710
  428    H1     G 199           H1         G 199   0.161  28.752   1.133
  429   1H2     G 199          1H2         G 199  -1.126  30.197   0.421
  430   2H2     G 199          2H2         G 199  -0.641  31.580  -0.533
  431   1H5*    A 200          1H5*        A 200   8.766  36.727   1.798
  432   2H5*    A 200          2H5*        A 200  10.291  36.642   0.915
  433    H4*    A 200           H4*        A 200  10.404  36.341   3.426
  434    H3*    A 200           H3*        A 200  11.646  34.406   1.487
  435    H2*    A 200           H2*        A 200  12.596  33.209   3.305
  436   2HO*    A 200          2HO*        A 200  11.559  34.665   5.370
  437    H1*    A 200           H1*        A 200  10.199  33.136   4.750
  438    H8     A 200           H8         A 200   9.336  32.675   1.184
  439   1H6     A 200          1H6         A 200  10.750  26.636   1.872
  440   2H6     A 200          2H6         A 200  10.020  27.807   0.797
  441    H2     A 200           H2         A 200  12.119  28.806   5.500
  442   1H5*    C 201          1H5*        C 201  16.810  35.775   3.583
  443   2H5*    C 201          2H5*        C 201  16.028  34.425   2.762
  444    H4*    C 201           H4*        C 201  14.458  35.871   4.843
  445    H3*    C 201           H3*        C 201  16.858  34.152   5.475
  446    H2*    C 201           H2*        C 201  15.732  33.380   7.406
  447   2HO*    C 201          2HO*        C 201  13.471  34.633   7.537
  448    H1*    C 201           H1*        C 201  13.259  33.126   5.983
  449   1H4     C 201          1H4         C 201  15.284  27.110   6.559
  450   2H4     C 201          2H4         C 201  16.551  27.416   5.392
  451    H5     C 201           H5         C 201  16.982  29.536   4.444
  452    H6     C 201           H6         C 201  16.298  31.908   4.383
  453   1H5*    C 202          1H5*        C 202  16.087  36.727   8.925
  454   2H5*    C 202          2H5*        C 202  17.550  37.009   9.869
  455    H4*    C 202           H4*        C 202  15.789  35.927  11.182
  456    H3*    C 202           H3*        C 202  18.349  34.401  10.725
  457    H2*    C 202           H2*        C 202  17.588  32.731  12.221
  458   2HO*    C 202          2HO*        C 202  15.800  33.266  13.574
  459    H1*    C 202           H1*        C 202  14.972  32.748  11.080
  460   1H4     C 202          1H4         C 202  17.877  27.516   8.806
  461   2H4     C 202          2H4         C 202  18.523  28.487   7.502
  462    H5     C 202           H5         C 202  18.287  30.833   7.368
  463    H6     C 202           H6         C 202  17.364  32.845   8.461
  464   1H5*    C 203          1H5*        C 203  18.491  35.249  15.311
  465   2H5*    C 203          2H5*        C 203  20.220  35.152  15.641
  466    H4*    C 203           H4*        C 203  18.806  33.517  16.895
  467    H3*    C 203           H3*        C 203  21.082  32.593  15.155
  468    H2*    C 203           H2*        C 203  20.755  30.372  15.947
  469   2HO*    C 203          2HO*        C 203  18.678  30.527  17.552
  470    H1*    C 203           H1*        C 203  17.981  30.464  15.507
  471   1H4     C 203          1H4         C 203  20.426  27.664  10.302
  472   2H4     C 203          2H4         C 203  20.678  29.249   9.602
  473    H5     C 203           H5         C 203  20.307  31.273  10.760
  474    H6     C 203           H6         C 203  19.596  32.287  12.896
  475   1H5*    U 204          1H5*        U 204  21.250  31.336  18.974
  476   2H5*    U 204          2H5*        U 204  22.758  31.175  19.875
  477    H4*    U 204           H4*        U 204  21.549  29.085  19.889
  478    H3*    U 204           H3*        U 204  24.139  29.130  18.366
  479    H2*    U 204           H2*        U 204  23.943  26.792  17.967
  480   2HO*    U 204          2HO*        U 204  22.314  25.663  19.150
  481    H1*    U 204           H1*        U 204  21.312  26.985  17.060
  482    H3     U 204           H3         U 204  24.196  26.116  13.547
  483    H5     U 204           H5         U 204  23.882  30.285  13.800
  484    H6     U 204           H6         U 204  22.713  29.968  15.933
  485   1H5*    A 205          1H5*        A 205  25.895  27.519  22.508
  486   2H5*    A 205          2H5*        A 205  27.608  27.842  22.239
  487    H4*    A 205           H4*        A 205  26.818  25.419  22.120
  488    H3*    A 205           H3*        A 205  28.553  26.729  20.041
  489    H2*    A 205           H2*        A 205  28.757  24.650  18.913
  490   2HO*    A 205          2HO*        A 205  28.378  22.822  20.109
  491    H1*    A 205           H1*        A 205  26.013  24.116  18.995
  492    H8     A 205           H8         A 205  26.290  27.733  18.387
  493   1H6     A 205          1H6         A 205  27.284  26.437  12.363
  494   2H6     A 205          2H6         A 205  26.938  27.722  13.498
  495    H2     A 205           H2         A 205  27.555  22.645  14.664
  496   1H5*    G 206          1H5*        G 206  30.589  24.710  18.112
  497   2H5*    G 206          2H5*        G 206  32.171  24.728  18.891
  498    H4*    G 206           H4*        G 206  30.985  26.861  17.106
  499    H3*    G 206           H3*        G 206  33.029  24.731  16.684
  500    H2*    G 206           H2*        G 206  34.413  26.189  15.403
  501   2HO*    G 206          2HO*        G 206  33.290  28.516  15.427
  502    H1*    G 206           H1*        G 206  34.376  28.201  17.333
  503    H8     G 206           H8         G 206  34.422  24.731  18.802
  504    H1     G 206           H1         G 206  40.285  27.127  17.474
  505   1H2     G 206          1H2         G 206  40.086  28.888  16.418
  506   2H2     G 206          2H2         G 206  38.558  29.608  15.962
  507   1H5*    U 207          1H5*        U 207  30.110  24.779  12.303
  508   2H5*    U 207          2H5*        U 207  31.366  24.448  11.110
  509    H4*    U 207           H4*        U 207  29.716  26.316  10.594
  510    H3*    U 207           H3*        U 207  32.702  26.625  10.391
  511    H2*    U 207           H2*        U 207  32.406  28.808   9.502
  512   2HO*    U 207          2HO*        U 207  30.188  29.406   8.955
  513    H1*    U 207           H1*        U 207  30.571  29.567  11.473
  514    H3     U 207           H3         U 207  34.089  31.977  12.891
  515    H5     U 207           H5         U 207  35.359  28.031  13.483
  516    H6     U 207           H6         U 207  33.284  27.304  12.398
  517   1H5*    A 208          1H5*        A 208  32.978  26.595   5.031
  518   2H5*    A 208          2H5*        A 208  31.371  26.254   4.391
  519    H4*    A 208           H4*        A 208  32.880  24.641   3.501
  520    H3*    A 208           H3*        A 208  30.911  23.621   5.499
  521    H2*    A 208           H2*        A 208  31.786  21.412   5.353
  522   2HO*    A 208          2HO*        A 208  33.864  22.092   3.621
  523    H1*    A 208           H1*        A 208  34.430  22.252   5.713
  524    H8     A 208           H8         A 208  31.458  23.777   7.592
  525   1H6     A 208          1H6         A 208  33.316  20.243  12.389
  526   2H6     A 208          2H6         A 208  32.157  21.452  11.885
  527    H2     A 208           H2         A 208  35.937  19.357   8.913
  528   1H5*    G 209          1H5*        G 209  29.528  21.499   2.755
  529   2H5*    G 209          2H5*        G 209  27.790  21.201   2.773
  530    H4*    G 209           H4*        G 209  29.112  19.693   4.246
  531    H3*    G 209           H3*        G 209  26.893  21.387   5.356
  532    H2*    G 209           H2*        G 209  27.171  20.354   7.485
  533   2HO*    G 209          2HO*        G 209  29.089  18.685   7.347
  534    H1*    G 209           H1*        G 209  29.934  20.769   7.511
  535    H8     G 209           H8         G 209  28.353  23.729   5.929
  536    H1     G 209           H1         G 209  28.023  23.833  12.392
  537   1H2     G 209          1H2         G 209  28.579  21.993  13.139
  538   2H2     G 209          2H2         G 209  29.062  20.625  12.160
  539   1H5*    A 210          1H5*        A 210  26.583  17.652   7.433
  540   2H5*    A 210          2H5*        A 210  24.944  17.124   7.054
  541    H4*    A 210           H4*        A 210  25.216  17.022   9.414
  542    H3*    A 210           H3*        A 210  23.477  19.299   8.491
  543    H2*    A 210           H2*        A 210  22.971  19.805  10.756
  544   2HO*    A 210          2HO*        A 210  24.566  17.850  11.888
  545    H1*    A 210           H1*        A 210  25.656  19.665  11.567
  546    H8     A 210           H8         A 210  25.228  21.283   8.204
  547   1H6     A 210          1H6         A 210  24.583  26.678  11.277
  548   2H6     A 210          2H6         A 210  24.759  25.962   9.690
  549    H2     A 210           H2         A 210  24.608  23.377  14.252
  550   1H5*    G 211          1H5*        G 211  21.610  16.894  11.485
  551   2H5*    G 211          2H5*        G 211  19.881  16.683  11.208
  552    H4*    G 211           H4*        G 211  20.320  17.493  13.458
  553    H3*    G 211           H3*        G 211  18.819  19.309  11.594
  554    H2*    G 211           H2*        G 211  18.481  20.851  13.378
  555   2HO*    G 211          2HO*        G 211  19.761  19.838  15.424
  556    H1*    G 211           H1*        G 211  21.177  20.857  14.108
  557    H8     G 211           H8         G 211  21.187  20.657  10.439
  558    H1     G 211           H1         G 211  19.805  26.608  12.574
  559   1H2     G 211          1H2         G 211  19.407  26.540  14.596
  560   2H2     G 211          2H2         G 211  19.444  25.086  15.568
  561   1H5*    G 212          1H5*        G 212  15.955  18.914  15.151
  562   2H5*    G 212          2H5*        G 212  14.472  18.502  14.292
  563    H4*    G 212           H4*        G 212  14.063  20.335  15.800
  564    H3*    G 212           H3*        G 212  13.925  20.966  12.867
  565    H2*    G 212           H2*        G 212  13.212  23.182  13.377
  566   2HO*    G 212          2HO*        G 212  12.700  23.620  15.612
  567    H1*    G 212           H1*        G 212  15.278  23.608  15.204
  568    H8     G 212           H8         G 212  16.524  21.552  12.348
  569    H1     G 212           H1         G 212  16.442  27.905  11.112
  570   1H2     G 212          1H2         G 212  15.420  28.885  12.611
  571   2H2     G 212          2H2         G 212  14.693  28.103  13.996
  572   1H5*    G 213          1H5*        G 213   9.827  21.869  14.572
  573   2H5*    G 213          2H5*        G 213   8.664  21.648  13.265
  574    H4*    G 213           H4*        G 213   8.681  23.925  14.289
  575    H3*    G 213           H3*        G 213   9.097  23.528  11.339
  576    H2*    G 213           H2*        G 213   9.100  25.890  11.025
  577   2HO*    G 213          2HO*        G 213   8.895  26.465  13.753
  578    H1*    G 213           H1*        G 213  10.966  26.328  13.055
  579    H8     G 213           H8         G 213  12.033  23.201  11.443
  580    H1     G 213           H1         G 213  13.512  28.419   7.911
  581   1H2     G 213          1H2         G 213  12.524  30.064   8.666
  582   2H2     G 213          2H2         G 213  11.454  30.035  10.049
  583   1H5*    G 214          1H5*        G 214   7.662  26.509   9.763
  584   2H5*    G 214          2H5*        G 214   6.289  25.843   8.878
  585    H4*    G 214           H4*        G 214   7.952  26.683   7.340
  586    H3*    G 214           H3*        G 214   7.512  23.712   7.368
  587    H2*    G 214           H2*        G 214   9.011  23.473   5.532
  588   2HO*    G 214          2HO*        G 214   8.292  25.446   4.561
  589    H1*    G 214           H1*        G 214  11.013  24.989   6.742
  590    H8     G 214           H8         G 214   9.321  23.034   9.404
  591    H1     G 214           H1         G 214  13.619  19.551   6.045
  592   1H2     G 214          1H2         G 214  14.209  20.610   4.377
  593   2H2     G 214          2H2         G 214  13.627  22.203   3.950
  594   1H5*    G 215          1H5*        G 215   6.634  24.904   3.207
  595   2H5*    G 215          2H5*        G 215   5.314  23.886   2.629
  596    H4*    G 215           H4*        G 215   7.416  23.755   1.288
  597    H3*    G 215           H3*        G 215   6.179  21.291   2.491
  598    H2*    G 215           H2*        G 215   7.783  19.950   1.348
  599   2HO*    G 215          2HO*        G 215   9.349  21.497   0.048
  600    H1*    G 215           H1*        G 215   9.937  21.525   2.207
  601    H8     G 215           H8         G 215   7.673  21.352   5.089
  602    H1     G 215           H1         G 215  10.993  15.860   4.249
  603   1H2     G 215          1H2         G 215  11.903  15.881   2.399
  604   2H2     G 215          2H2         G 215  11.783  17.191   1.246
  605   1H5*    C 216          1H5*        C 216   4.124  21.077  -1.790
  606   2H5*    C 216          2H5*        C 216   2.905  19.833  -1.511
  607    H4*    C 216           H4*        C 216   5.060  19.203  -2.769
  608    H3*    C 216           H3*        C 216   3.845  17.591  -0.533
  609    H2*    C 216           H2*        C 216   5.466  15.899  -0.908
  610   2HO*    C 216          2HO*        C 216   6.956  16.574  -2.853
  611    H1*    C 216           H1*        C 216   7.600  17.723  -1.025
  612   1H4     C 216          1H4         C 216   7.483  15.524   4.988
  613   2H4     C 216          2H4         C 216   6.420  16.849   5.410
  614    H5     C 216           H5         C 216   5.505  18.353   3.836
  615    H6     C 216           H6         C 216   5.385  18.963   1.446
  616   1H5*    U 217          1H5*        U 217   3.260  14.786  -3.972
  617   2H5*    U 217          2H5*        U 217   1.909  13.744  -3.522
  618    H4*    U 217           H4*        U 217   4.079  12.561  -3.725
  619    H3*    U 217           H3*        U 217   2.566  12.510  -1.123
  620    H2*    U 217           H2*        U 217   4.143  10.945  -0.263
  621   2HO*    U 217          2HO*        U 217   5.576   9.973  -1.767
  622    H1*    U 217           H1*        U 217   6.341  12.479  -1.096
  623    H3     U 217           H3         U 217   6.277  12.722   3.465
  624    H5     U 217           H5         U 217   3.457  15.549   2.204
  625    H6     U 217           H6         U 217   3.728  14.662  -0.065
  626   1H5*    G 218          1H5*        G 218  -0.409   8.375  -1.487
  627   2H5*    G 218          2H5*        G 218   0.847   9.422  -0.826
  628    H4*    G 218           H4*        G 218   1.240   6.860  -1.568
  629    H3*    G 218           H3*        G 218   3.209   9.155  -1.532
  630    H2*    G 218           H2*        G 218   4.898   7.626  -2.126
  631   2HO*    G 218          2HO*        G 218   4.277   5.305  -1.934
  632    H1*    G 218           H1*        G 218   3.122   6.216  -3.912
  633    H8     G 218           H8         G 218   3.254   9.908  -4.456
  634    H1     G 218           H1         G 218   7.961   6.677  -7.505
  635   1H2     G 218          1H2         G 218   7.989   4.721  -6.852
  636   2H2     G 218          2H2         G 218   6.899   4.055  -5.657
  637   1H5*    C 219          1H5*        C 219   4.329   6.880   1.569
  638   2H5*    C 219          2H5*        C 219   3.979   5.487   2.592
  639    H4*    C 219           H4*        C 219   4.773   6.771   4.242
  640    H3*    C 219           H3*        C 219   1.958   7.713   3.939
  641    H2*    C 219           H2*        C 219   2.294   9.526   5.411
  642   2HO*    C 219          2HO*        C 219   4.983   8.774   5.873
  643    H1*    C 219           H1*        C 219   4.723  10.322   4.272
  644   1H4     C 219          1H4         C 219  -0.059  13.720   1.592
  645   2H4     C 219          2H4         C 219   0.255  12.798   0.138
  646    H5     C 219           H5         C 219   1.724  10.952   0.042
  647    H6     C 219           H6         C 219   3.271   9.522   1.329
  648   1H5*    G 220          1H5*        G 220   4.577   3.818   6.299
  649   2H5*    G 220          2H5*        G 220   4.955   5.481   5.852
  650    H4*    G 220           H4*        G 220   6.274   3.063   5.094
  651    H3*    G 220           H3*        G 220   6.784   6.000   4.577
  652    H2*    G 220           H2*        G 220   8.587   5.371   3.206
  653   2HO*    G 220          2HO*        G 220   9.558   3.380   3.622
  654    H1*    G 220           H1*        G 220   7.113   3.068   2.226
  655    H8     G 220           H8         G 220   6.836   3.512  -0.236
  656    H1     G 220           H1         G 220   6.953   9.930   0.582
  657   1H2     G 220          1H2         G 220   7.028  10.367   2.597
  658   2H2     G 220          2H2         G 220   7.055   9.172   3.873
  659   1H5*    G 221          1H5*        G 221  10.003   4.970   5.307
  660   2H5*    G 221          2H5*        G 221  11.132   5.700   6.449
  661    H4*    G 221           H4*        G 221  11.704   5.785   3.954
  662    H3*    G 221           H3*        G 221  11.893   8.093   5.857
  663    H2*    G 221           H2*        G 221  12.720   9.498   4.124
  664   2HO*    G 221          2HO*        G 221  13.595   8.489   2.355
  665    H1*    G 221           H1*        G 221  10.693   8.880   2.350
  666    H8     G 221           H8         G 221  10.003   9.008   6.114
  667    H1     G 221           H1         G 221   8.417  14.348   2.819
  668   1H2     G 221          1H2         G 221   8.995  14.140   0.850
  669   2H2     G 221          2H2         G 221   9.791  12.729   0.191
  670   1H5*    C 222          1H5*        C 222  15.812   8.061   3.499
  671   2H5*    C 222          2H5*        C 222  16.897   8.959   4.560
  672    H4*    C 222           H4*        C 222  16.367   9.963   2.277
  673    H3*    C 222           H3*        C 222  16.179  11.501   4.859
  674    H2*    C 222           H2*        C 222  15.738  13.478   3.622
  675   2HO*    C 222          2HO*        C 222  16.041  11.889   1.255
  676    H1*    C 222           H1*        C 222  13.825  12.234   1.983
  677   1H4     C 222          1H4         C 222  10.466  15.059   6.633
  678   2H4     C 222          2H4         C 222  10.696  13.639   7.628
  679    H5     C 222           H5         C 222  12.064  11.812   7.018
  680    H6     C 222           H6         C 222  13.561  10.889   5.285
  681   1H5*    U 223          1H5*        U 223  19.456  13.615   2.860
  682   2H5*    U 223          2H5*        U 223  20.276  14.614   4.060
  683    H4*    U 223           H4*        U 223  18.637  15.652   2.276
  684    H3*    U 223           H3*        U 223  18.962  16.485   5.158
  685    H2*    U 223           H2*        U 223  17.472  18.276   4.766
  686   2HO*    U 223          2HO*        U 223  17.838  19.074   2.782
  687    H1*    U 223           H1*        U 223  15.650  16.705   3.298
  688    H3     U 223           H3         U 223  13.751  18.049   7.291
  689    H5     U 223           H5         U 223  15.703  14.432   8.091
  690    H6     U 223           H6         U 223  16.724  14.604   5.867
  691   1H5*    U 224          1H5*        U 224  19.424  15.618  -0.130
  692   2H5*    U 224          2H5*        U 224  19.564  17.240  -0.805
  693    H4*    U 224           H4*        U 224  17.369  15.554  -0.958
  694    H3*    U 224           H3*        U 224  17.669  18.520  -1.484
  695    H2*    U 224           H2*        U 224  15.403  18.562  -2.104
  696   2HO*    U 224          2HO*        U 224  14.929  15.842  -1.909
  697    H1*    U 224           H1*        U 224  14.719  16.650  -0.036
  698    H3     U 224           H3         U 224  11.961  20.144   0.863
  699    H5     U 224           H5         U 224  15.757  21.531   1.961
  700    H6     U 224           H6         U 224  16.680  19.483   0.977
  701   1H5*    A 225          1H5*        A 225  18.557  17.265  -6.139
  702   2H5*    A 225          2H5*        A 225  18.884  18.908  -6.689
  703    H4*    A 225           H4*        A 225  16.695  17.754  -7.413
  704    H3*    A 225           H3*        A 225  16.917  20.580  -6.401
  705    H2*    A 225           H2*        A 225  14.607  20.906  -6.846
  706   2HO*    A 225          2HO*        A 225  13.581  19.395  -8.202
  707    H1*    A 225           H1*        A 225  13.833  18.521  -5.609
  708    H8     A 225           H8         A 225  16.667  20.405  -3.943
  709   1H6     A 225          1H6         A 225  12.258  23.141  -0.476
  710   2H6     A 225          2H6         A 225  13.984  22.967  -0.694
  711    H2     A 225           H2         A 225  10.253  20.693  -3.595
  712   1H5*    G 226          1H5*        G 226  15.414  19.974 -10.242
  713   2H5*    G 226          2H5*        G 226  15.507  21.160 -11.544
  714    H4*    G 226           H4*        G 226  13.212  20.520 -11.171
  715    H3*    G 226           H3*        G 226  13.973  23.341 -10.518
  716    H2*    G 226           H2*        G 226  11.725  23.852  -9.917
  717   2HO*    G 226          2HO*        G 226  10.944  22.428 -11.612
  718    H1*    G 226           H1*        G 226  11.504  21.627  -8.233
  719    H8     G 226           H8         G 226  14.922  22.860  -7.724
  720    H1     G 226           H1         G 226  10.518  26.557  -4.753
  721   1H2     G 226          1H2         G 226   8.634  26.060  -5.427
  722   2H2     G 226          2H2         G 226   8.297  24.825  -6.620
  723   1H5*    G 227          1H5*        G 227  11.530  24.545 -14.280
  724   2H5*    G 227          2H5*        G 227  12.368  23.252 -15.139
  725    H4*    G 227           H4*        G 227  11.711  25.151 -16.584
  726    H3*    G 227           H3*        G 227  14.598  24.357 -16.342
  727    H2*    G 227           H2*        G 227  15.180  25.966 -18.002
  728   2HO*    G 227          2HO*        G 227  13.478  26.880 -19.210
  729    H1*    G 227           H1*        G 227  13.780  28.025 -16.742
  730    H8     G 227           H8         G 227  15.225  26.044 -14.004
  731    H1     G 227           H1         G 227  19.622  29.796 -16.915
  732   1H2     G 227          1H2         G 227  18.839  30.538 -18.672
  733   2H2     G 227          2H2         G 227  17.230  30.194 -19.269
  734   1H5*    A 228          1H5*        A 228  13.724  24.465 -20.599
  735   2H5*    A 228          2H5*        A 228  14.390  22.996 -21.310
  736    H4*    A 228           H4*        A 228  15.202  24.875 -22.542
  737    H3*    A 228           H3*        A 228  17.238  23.453 -20.861
  738    H2*    A 228           H2*        A 228  18.951  24.895 -21.667
  739   2HO*    A 228          2HO*        A 228  18.480  26.147 -23.499
  740    H1*    A 228           H1*        A 228  17.459  27.214 -21.159
  741    H8     A 228           H8         A 228  16.890  24.788 -18.402
  742   1H6     A 228          1H6         A 228  22.112  26.973 -15.772
  743   2H6     A 228          2H6         A 228  20.711  25.958 -15.512
  744    H2     A 228           H2         A 228  21.831  28.624 -19.888
  745   1H5*    G 229          1H5*        G 229  18.752  23.770 -24.909
  746   2H5*    G 229          2H5*        G 229  19.338  22.195 -25.443
  747    H4*    G 229           H4*        G 229  21.025  23.799 -25.921
  748    H3*    G 229           H3*        G 229  21.666  21.948 -23.650
  749    H2*    G 229           H2*        G 229  23.823  22.936 -23.428
  750   2HO*    G 229          2HO*        G 229  24.335  23.367 -25.534
  751    H1*    G 229           H1*        G 229  22.815  25.537 -23.369
  752    H8     G 229           H8         G 229  20.382  23.446 -21.542
  753    H1     G 229           H1         G 229  25.625  24.835 -18.012
  754   1H2     G 229          1H2         G 229  27.079  25.649 -19.228
  755   2H2     G 229          2H2         G 229  26.903  25.915 -20.948
  756   1H5*    G 230          1H5*        G 230  25.156  21.796 -26.596
  757   2H5*    G 230          2H5*        G 230  25.643  20.102 -26.567
  758    H4*    G 230           H4*        G 230  27.508  21.650 -26.138
  759    H3*    G 230           H3*        G 230  26.741  19.634 -24.050
  760    H2*    G 230           H2*        G 230  28.594  20.307 -22.710
  761   2HO*    G 230          2HO*        G 230  30.229  21.394 -23.740
  762    H1*    G 230           H1*        G 230  27.958  23.018 -22.892
  763    H8     G 230           H8         G 230  24.722  21.280 -22.689
  764    H1     G 230           H1         G 230  27.698  21.629 -16.953
  765   1H2     G 230          1H2         G 230  29.652  22.232 -17.226
  766   2H2     G 230          2H2         G 230  30.375  22.589 -18.779
  767   1H5*    G 231          1H5*        G 231  31.235  18.804 -24.765
  768   2H5*    G 231          2H5*        G 231  31.190  17.043 -24.853
  769    H4*    G 231           H4*        G 231  32.846  17.824 -23.242
  770    H3*    G 231           H3*        G 231  30.516  16.226 -22.222
  771    H2*    G 231           H2*        G 231  31.465  16.232 -20.036
  772   2HO*    G 231          2HO*        G 231  33.614  17.863 -20.848
  773    H1*    G 231           H1*        G 231  31.875  18.993 -20.036
  774    H8     G 231           H8         G 231  28.687  18.409 -21.811
  775    H1     G 231           H1         G 231  28.080  18.002 -15.381
  776   1H2     G 231          1H2         G 231  29.951  17.943 -14.514
  777   2H2     G 231          2H2         G 231  31.460  17.997 -15.398
  778   1H5*    C 232          1H5*        C 232  33.950  14.558 -20.868
  779   2H5*    C 232          2H5*        C 232  34.110  12.804 -20.969
  780    H4*    C 232           H4*        C 232  34.483  13.385 -18.714
  781    H3*    C 232           H3*        C 232  31.794  12.141 -19.189
  782    H2*    C 232           H2*        C 232  31.305  12.242 -16.870
  783   2HO*    C 232          2HO*        C 232  33.038  12.294 -15.516
  784    H1*    C 232           H1*        C 232  32.191  14.919 -16.651
  785   1H4     C 232          1H4         C 232  25.828  15.292 -17.130
  786   2H4     C 232          2H4         C 232  25.976  15.209 -18.871
  787    H5     C 232           H5         C 232  28.015  14.832 -20.002
  788    H6     C 232           H6         C 232  30.438  14.439 -19.738
  789   1H5*    A 233          1H5*        A 233  33.784   9.513 -16.090
  790   2H5*    A 233          2H5*        A 233  33.348   7.868 -16.553
  791    H4*    A 233           H4*        A 233  32.756   8.285 -14.245
  792    H3*    A 233           H3*        A 233  30.518   7.822 -16.183
  793    H2*    A 233           H2*        A 233  28.920   7.975 -14.431
  794   2HO*    A 233          2HO*        A 233  29.705   7.878 -12.287
  795    H1*    A 233           H1*        A 233  30.024  10.341 -13.401
  796    H8     A 233           H8         A 233  30.152  10.535 -17.098
  797   1H6     A 233          1H6         A 233  24.229  12.496 -16.949
  798   2H6     A 233          2H6         A 233  25.631  12.295 -17.976
  799    H2     A 233           H2         A 233  25.317  11.051 -12.890
  800   1H5*    G 234          1H5*        G 234  29.957   4.794 -12.887
  801   2H5*    G 234          2H5*        G 234  29.549   3.295 -13.721
  802    H4*    G 234           H4*        G 234  27.920   3.796 -11.995
  803    H3*    G 234           H3*        G 234  26.974   3.862 -14.846
  804    H2*    G 234           H2*        G 234  24.742   4.226 -14.096
  805   2HO*    G 234          2HO*        G 234  24.914   2.871 -12.275
  806    H1*    G 234           H1*        G 234  25.471   6.319 -12.401
  807    H8     G 234           H8         G 234  27.606   6.643 -15.391
  808    H1     G 234           H1         G 234  21.582   8.783 -16.393
  809   1H2     G 234          1H2         G 234  20.373   8.197 -14.829
  810   2H2     G 234          2H2         G 234  20.912   7.264 -13.450
  811   1H    GLY  15          1H        GLY  15   5.482  -3.242   1.429
  812   1HA   GLY  15          1HA       GLY  15   6.651  -3.183  -1.075
  813   2HA   GLY  15          2HA       GLY  15   5.211  -2.275  -0.637
  814    H    ARG  16           H        ARG  16   8.532  -2.117  -1.415
  815    HA   ARG  16           HA       ARG  16   8.539   0.779  -0.864
  816   1HB   ARG  16          2HB       ARG  16  10.507  -1.298  -0.316
  817   2HB   ARG  16          3HB       ARG  16  11.188   0.034  -1.242
  818   1HG   ARG  16          2HG       ARG  16  10.709   1.595   0.437
  819   2HG   ARG  16          3HG       ARG  16   9.591   0.500   1.253
  820   1HD   ARG  16          2HD       ARG  16  11.242  -0.578   2.343
  821   2HD   ARG  16          3HD       ARG  16  12.338  -0.505   0.964
  822    HE   ARG  16           HE       ARG  16  12.236   1.301   3.171
  823   1HH1  ARG  16          2HH1      ARG  16  12.964   1.052  -0.225
  824   2HH1  ARG  16          1HH1      ARG  16  14.065   2.391  -0.220
  825   1HH2  ARG  16          2HH2      ARG  16  13.683   3.065   3.190
  826   2HH2  ARG  16          1HH2      ARG  16  14.474   3.534   1.723
  827    H    ALA  17           H        ALA  17   9.499   2.153  -2.421
  828    HA   ALA  17           HA       ALA  17  10.270   1.040  -4.987
  829   1HB   ALA  17          1HB       ALA  17   7.767   2.655  -4.607
  830   2HB   ALA  17          2HB       ALA  17   8.609   2.586  -6.155
  831   3HB   ALA  17          3HB       ALA  17   7.970   1.110  -5.434
  832    H    ARG  18           H        ARG  18  11.292   2.788  -2.725
  833    HA   ARG  18           HA       ARG  18  11.567   5.437  -3.465
  834   1HB   ARG  18          2HB       ARG  18  12.863   3.618  -1.643
  835   2HB   ARG  18          3HB       ARG  18  14.055   4.670  -2.393
  836   1HG   ARG  18          2HG       ARG  18  11.741   6.172  -1.563
  837   2HG   ARG  18          3HG       ARG  18  12.422   5.253  -0.220
  838   1HD   ARG  18          2HD       ARG  18  14.208   6.837  -2.022
  839   2HD   ARG  18          3HD       ARG  18  13.313   7.642  -0.733
  840    HE   ARG  18           HE       ARG  18  14.693   5.380   0.269
  841   1HH1  ARG  18          2HH1      ARG  18  15.193   8.649  -0.819
  842   2HH1  ARG  18          1HH1      ARG  18  16.606   8.894   0.154
  843   1HH2  ARG  18          2HH2      ARG  18  16.552   5.691   1.553
  844   2HH2  ARG  18          1HH2      ARG  18  17.379   7.210   1.502
  845    H    GLY  19           H        GLY  19  12.714   6.536  -4.950
  846   1HA   GLY  19          1HA       GLY  19  14.550   6.903  -6.403
  847   2HA   GLY  19          2HA       GLY  19  14.879   5.176  -6.381
  848    H    LEU  20           H        LEU  20  11.914   4.711  -6.830
  849    HA   LEU  20           HA       LEU  20  12.009   5.088  -9.742
  850   1HB   LEU  20          2HB       LEU  20  11.041   2.966  -7.968
  851   2HB   LEU  20          3HB       LEU  20   9.948   3.358  -9.293
  852    HG   LEU  20           HG       LEU  20  12.689   3.026 -10.196
  853   1HD1  LEU  20          1HD1      LEU  20  13.024   1.446  -8.496
  854   2HD1  LEU  20          2HD1      LEU  20  12.567   0.501  -9.913
  855   3HD1  LEU  20          3HD1      LEU  20  11.384   0.813  -8.643
  856   1HD2  LEU  20          1HD2      LEU  20  11.500   1.381 -11.699
  857   2HD2  LEU  20          2HD2      LEU  20  10.927   3.047 -11.773
  858   3HD2  LEU  20          3HD2      LEU  20  10.010   1.837 -10.874
  859    H    CYS  21           H        CYS  21  10.680   6.592 -10.689
  860    HA   CYS  21           HA       CYS  21   8.807   7.956  -9.071
  861   1HB   CYS  21          2HB       CYS  21  10.104   9.004 -10.935
  862   2HB   CYS  21          3HB       CYS  21   9.153   8.084 -12.084
  863    H    TYR  22           H        TYR  22   6.535   7.965  -9.366
  864    HA   TYR  22           HA       TYR  22   5.438   5.506 -10.562
  865   1HB   TYR  22          2HB       TYR  22   4.960   5.233  -8.321
  866   2HB   TYR  22          3HB       TYR  22   4.801   6.962  -8.033
  867    HD1  TYR  22           HD1      TYR  22   3.108   4.263  -9.995
  868    HD2  TYR  22           HD2      TYR  22   2.682   7.775  -7.632
  869    HE1  TYR  22           HE1      TYR  22   0.662   4.055 -10.138
  870    HE2  TYR  22           HE2      TYR  22   0.234   7.576  -7.767
  871    HH   TYR  22           HH       TYR  22  -1.460   5.961  -8.205
  872    H    THR  23           H        THR  23   5.295   8.947 -10.436
  873    HA   THR  23           HA       THR  23   2.703   9.335 -11.498
  874    HB   THR  23           HB       THR  23   5.075  11.174 -11.847
  875    HG1  THR  23           HG1      THR  23   3.449  10.604  -9.632
  876   1HG2  THR  23          1HG2      THR  23   2.541  11.365 -12.886
  877   2HG2  THR  23          2HG2      THR  23   3.632  12.720 -12.602
  878   3HG2  THR  23          3HG2      THR  23   2.415  12.301 -11.397
  879    H    CYS  24           H        CYS  24   5.961   9.054 -13.063
  880    HA   CYS  24           HA       CYS  24   4.522   8.932 -15.611
  881   1HB   CYS  24          2HB       CYS  24   6.587   9.630 -16.697
  882   2HB   CYS  24          3HB       CYS  24   6.118  10.796 -15.476
  883    H    GLY  25           H        GLY  25   6.933   7.520 -13.471
  884   1HA   GLY  25          1HA       GLY  25   7.147   5.148 -13.212
  885   2HA   GLY  25          2HA       GLY  25   6.659   4.958 -14.890
  886    H    SER  26           H        SER  26   9.056   7.256 -13.733
  887    HA   SER  26           HA       SER  26  11.051   5.895 -15.401
  888   1HB   SER  26          2HB       SER  26  10.414   8.414 -15.636
  889   2HB   SER  26          3HB       SER  26  11.436   8.629 -14.213
  890    HG   SER  26           HG       SER  26  12.982   7.284 -15.601
  891    HA   PRO  27           HA       PRO  27  12.832   4.472 -11.552
  892   1HB   PRO  27          2HB       PRO  27  14.799   3.007 -12.716
  893   2HB   PRO  27          3HB       PRO  27  13.125   2.450 -12.604
  894   1HG   PRO  27          2HG       PRO  27  14.551   3.710 -14.915
  895   2HG   PRO  27          3HG       PRO  27  13.439   2.329 -14.906
  896   1HD   PRO  27          2HD       PRO  27  12.662   4.819 -15.633
  897   2HD   PRO  27          3HD       PRO  27  11.569   3.674 -14.830
  898    H    GLY  28           H        GLY  28  13.612   6.535 -10.889
  899   1HA   GLY  28          1HA       GLY  28  16.345   6.789 -10.605
  900   2HA   GLY  28          2HA       GLY  28  15.937   7.724 -12.036
  901    H    HIS  29           H        HIS  29  13.456   8.737 -11.263
  902    HA   HIS  29           HA       HIS  29  14.184  10.417  -8.953
  903   1HB   HIS  29          2HB       HIS  29  13.143  12.310 -10.021
  904   2HB   HIS  29          3HB       HIS  29  14.301  11.609 -11.148
  905    HD1  HIS  29           HD1      HIS  29  13.438  11.126 -13.423
  906    HD2  HIS  29           HD2      HIS  29  10.376  11.482 -10.638
  907    HE1  HIS  29           HE1      HIS  29  11.306  10.995 -14.749
  908    H    TYR  30           H        TYR  30  11.970  11.748  -8.411
  909    HA   TYR  30           HA       TYR  30   9.836   9.738  -8.145
  910   1HB   TYR  30          2HB       TYR  30  11.423  10.849  -6.056
  911   2HB   TYR  30          3HB       TYR  30   9.789  11.481  -5.886
  912    HD1  TYR  30           HD1      TYR  30  11.502   8.223  -6.556
  913    HD2  TYR  30           HD2      TYR  30   8.305  10.254  -4.617
  914    HE1  TYR  30           HE1      TYR  30  10.803   6.110  -5.507
  915    HE2  TYR  30           HE2      TYR  30   7.598   8.147  -3.564
  916    HH   TYR  30           HH       TYR  30   7.915   5.947  -3.453
  917    H    GLN  31           H        GLN  31   7.785  10.916  -7.214
  918    HA   GLN  31           HA       GLN  31   6.796  12.601  -9.170
  919   1HB   GLN  31          2HB       GLN  31   4.899  12.950  -7.762
  920   2HB   GLN  31          3HB       GLN  31   5.458  11.306  -7.484
  921   1HG   GLN  31          2HG       GLN  31   5.083  11.992  -5.343
  922   2HG   GLN  31          3HG       GLN  31   6.787  12.409  -5.522
  923   1HE2  GLN  31          1HE2      GLN  31   6.905  14.091  -4.144
  924   2HE2  GLN  31          2HE2      GLN  31   6.021  15.564  -4.325
  925    H    ALA  32           H        ALA  32   8.347  13.415  -6.108
  926    HA   ALA  32           HA       ALA  32   7.836  16.170  -6.109
  927   1HB   ALA  32          1HB       ALA  32  10.096  16.167  -4.770
  928   2HB   ALA  32          2HB       ALA  32   8.636  15.447  -4.088
  929   3HB   ALA  32          3HB       ALA  32   9.869  14.418  -4.819
  930    H    GLN  33           H        GLN  33   9.891  14.284  -8.086
  931    HA   GLN  33           HA       GLN  33  11.068  16.741  -9.195
  932   1HB   GLN  33          2HB       GLN  33  12.439  14.131  -8.581
  933   2HB   GLN  33          3HB       GLN  33  13.092  15.271  -9.752
  934   1HG   GLN  33          2HG       GLN  33  13.526  16.879  -8.131
  935   2HG   GLN  33          3HG       GLN  33  12.431  16.137  -6.967
  936   1HE2  GLN  33          1HE2      GLN  33  14.058  16.124  -5.397
  937   2HE2  GLN  33          2HE2      GLN  33  15.355  14.983  -5.443
  938    H    CYS  34           H        CYS  34   8.670  14.974  -9.952
  939    HA   CYS  34           HA       CYS  34   9.540  13.650 -12.320
  940   1HB   CYS  34          2HB       CYS  34   7.583  12.918 -10.921
  941   2HB   CYS  34          3HB       CYS  34   6.708  14.334 -11.472
  942    HA   PRO  35           HA       PRO  35   9.590  17.406 -14.730
  943   1HB   PRO  35          2HB       PRO  35   9.993  16.201 -17.129
  944   2HB   PRO  35          3HB       PRO  35  11.275  16.402 -15.927
  945   1HG   PRO  35          2HG       PRO  35   9.595  13.996 -16.522
  946   2HG   PRO  35          3HG       PRO  35  11.338  14.094 -16.205
  947   1HD   PRO  35          2HD       PRO  35   9.554  13.328 -14.317
  948   2HD   PRO  35          3HD       PRO  35  11.043  14.211 -13.922
  949    H    LYS  36           H        LYS  36   7.309  14.873 -14.902
  950    HA   LYS  36           HA       LYS  36   5.701  16.247 -16.928
  951   1HB   LYS  36          2HB       LYS  36   5.459  13.526 -15.642
  952   2HB   LYS  36          3HB       LYS  36   4.235  14.193 -16.714
  953   1HG   LYS  36          2HG       LYS  36   6.410  14.510 -18.256
  954   2HG   LYS  36          3HG       LYS  36   6.899  13.092 -17.326
  955   1HD   LYS  36          2HD       LYS  36   5.680  11.850 -18.714
  956   2HD   LYS  36          3HD       LYS  36   4.238  12.627 -18.055
  957   1HE   LYS  36          2HE       LYS  36   3.883  13.294 -20.165
  958   2HE   LYS  36          3HE       LYS  36   5.119  14.504 -19.822
  959   1HZ   LYS  36          1HZ       LYS  36   6.567  13.515 -21.184
  960   2HZ   LYS  36          2HZ       LYS  36   5.223  12.726 -21.841
  961   3HZ   LYS  36          3HZ       LYS  36   6.167  11.954 -20.668
  962    H    LYS  37           H        LYS  37   6.144  16.450 -13.707
  963    HA   LYS  37           HA       LYS  37   3.362  16.613 -12.903
  964   1HB   LYS  37          2HB       LYS  37   5.976  16.586 -11.561
  965   2HB   LYS  37          3HB       LYS  37   4.801  17.667 -10.823
  966   1HG   LYS  37          2HG       LYS  37   4.324  14.750 -11.396
  967   2HG   LYS  37          3HG       LYS  37   4.814  15.409  -9.833
  968   1HD   LYS  37          2HD       LYS  37   2.602  16.927 -10.626
  969   2HD   LYS  37          3HD       LYS  37   2.191  15.256 -11.017
  970   1HE   LYS  37          2HE       LYS  37   2.696  14.577  -8.742
  971   2HE   LYS  37          3HE       LYS  37   3.195  16.219  -8.341
  972   1HZ   LYS  37          1HZ       LYS  37   0.721  16.615  -9.294
  973   2HZ   LYS  37          2HZ       LYS  37   1.089  16.422  -7.655
  974   3HZ   LYS  37          3HZ       LYS  37   0.539  15.102  -8.560
  975    H    ARG  38           H        ARG  38   5.893  18.720 -13.973
  976    HA   ARG  38           HA       ARG  38   4.042  20.983 -13.789
  977   1HB   ARG  38          2HB       ARG  38   6.473  20.681 -12.268
  978   2HB   ARG  38          3HB       ARG  38   6.605  22.059 -13.352
  979   1HG   ARG  38          2HG       ARG  38   5.695  23.071 -11.528
  980   2HG   ARG  38          3HG       ARG  38   4.223  22.622 -12.391
  981   1HD   ARG  38          2HD       ARG  38   3.561  21.399 -10.662
  982   2HD   ARG  38          3HD       ARG  38   5.025  20.424 -10.773
  983    HE   ARG  38           HE       ARG  38   5.469  22.909  -9.436
  984   1HH1  ARG  38          2HH1      ARG  38   4.274  19.664  -9.031
  985   2HH1  ARG  38          1HH1      ARG  38   4.595  19.618  -7.329
  986   1HH2  ARG  38          2HH2      ARG  38   5.897  22.861  -7.195
  987   2HH2  ARG  38          1HH2      ARG  38   5.517  21.438  -6.285
  988    H    LYS  39           H        LYS  39   4.261  22.519 -15.409
  989    HA   LYS  39           HA       LYS  39   6.414  22.331 -17.327
  990   1HB   LYS  39          2HB       LYS  39   3.807  21.100 -17.805
  991   2HB   LYS  39          3HB       LYS  39   4.253  22.259 -19.050
  992   1HG   LYS  39          2HG       LYS  39   6.165  20.131 -18.167
  993   2HG   LYS  39          3HG       LYS  39   4.914  19.803 -19.368
  994   1HD   LYS  39          2HD       LYS  39   6.271  22.256 -19.999
  995   2HD   LYS  39          3HD       LYS  39   7.442  20.952 -19.789
  996   1HE   LYS  39          2HE       LYS  39   5.729  19.625 -21.281
  997   2HE   LYS  39          3HE       LYS  39   5.253  21.245 -21.789
  998   1HZ   LYS  39          1HZ       LYS  39   7.431  21.686 -22.561
  999   2HZ   LYS  39          2HZ       LYS  39   7.002  20.171 -23.179
 1000   3HZ   LYS  39          3HZ       LYS  39   8.055  20.279 -21.859
 1001    H    SER  40           H        SER  40   6.206  24.006 -19.042
 1002    HA   SER  40           HA       SER  40   4.306  26.119 -18.700
 1003   1HB   SER  40          2HB       SER  40   6.034  27.857 -18.118
 1004   2HB   SER  40          3HB       SER  40   5.677  26.720 -16.818
 1005    HG   SER  40           HG       SER  40   7.797  26.584 -16.829
 1006    H    GLY  41           H        GLY  41   4.111  25.469 -20.943
 1007   1HA   GLY  41          1HA       GLY  41   6.297  26.498 -22.641
 1008   2HA   GLY  41          2HA       GLY  41   5.170  25.241 -23.128
 1009    H    ASN  42           H        ASN  42   4.800  28.496 -21.720
 1010    HA   ASN  42           HA       ASN  42   3.794  29.723 -24.021
 1011   1HB   ASN  42          2HB       ASN  42   1.952  27.923 -23.104
 1012   2HB   ASN  42          3HB       ASN  42   1.441  29.395 -22.284
 1013   1HD2  ASN  42          1HD2      ASN  42  -0.330  29.943 -23.387
 1014   2HD2  ASN  42          2HD2      ASN  42  -0.383  30.247 -25.087
 1015    H    SER  43           H        SER  43   3.517  31.896 -23.713
 1016    HA   SER  43           HA       SER  43   4.119  32.877 -21.024
 1017   1HB   SER  43          2HB       SER  43   4.034  35.032 -22.851
 1018   2HB   SER  43          3HB       SER  43   5.463  34.277 -22.144
 1019    HG   SER  43           HG       SER  43   4.873  34.311 -24.646
 1020    H    ARG  44           H        ARG  44   2.475  33.444 -19.777
 1021    HA   ARG  44           HA       ARG  44   0.255  34.951 -20.953
 1022   1HB   ARG  44          2HB       ARG  44   0.072  32.397 -19.401
 1023   2HB   ARG  44          3HB       ARG  44  -1.211  33.591 -19.254
 1024   1HG   ARG  44          2HG       ARG  44  -0.792  33.347 -21.990
 1025   2HG   ARG  44          3HG       ARG  44  -0.682  31.700 -21.367
 1026   1HD   ARG  44          2HD       ARG  44  -2.966  32.123 -21.925
 1027   2HD   ARG  44          3HD       ARG  44  -2.834  32.090 -20.168
 1028    HE   ARG  44           HE       ARG  44  -2.559  34.737 -20.971
 1029   1HH1  ARG  44          2HH1      ARG  44  -4.977  32.234 -21.030
 1030   2HH1  ARG  44          1HH1      ARG  44  -6.310  33.340 -20.956
 1031   1HH2  ARG  44          2HH2      ARG  44  -4.304  36.202 -20.873
 1032   2HH2  ARG  44          1HH2      ARG  44  -5.925  35.596 -20.868
 1033    H    GLU  45           H        GLU  45   2.010  36.413 -19.797
 1034    HA   GLU  45           HA       GLU  45   2.479  37.873 -18.116
 1035   1HB   GLU  45          2HB       GLU  45  -0.317  37.660 -18.285
 1036   2HB   GLU  45          3HB       GLU  45   0.056  37.612 -16.568
 1037   1HG   GLU  45          2HG       GLU  45   0.132  39.824 -16.633
 1038   2HG   GLU  45          3HG       GLU  45   1.637  39.664 -17.534
 1039    H    ARG  46           H        ARG  46   3.004  34.985 -17.737
 1040    HA   ARG  46           HA       ARG  46   2.818  34.760 -14.817
 1041   1HB   ARG  46          2HB       ARG  46   2.113  32.900 -16.531
 1042   2HB   ARG  46          3HB       ARG  46   3.839  32.565 -16.575
 1043   1HG   ARG  46          2HG       ARG  46   3.898  31.919 -14.342
 1044   2HG   ARG  46          3HG       ARG  46   2.366  32.713 -13.975
 1045   1HD   ARG  46          2HD       ARG  46   2.295  30.579 -16.019
 1046   2HD   ARG  46          3HD       ARG  46   2.607  30.069 -14.359
 1047    HE   ARG  46           HE       ARG  46   0.404  31.826 -14.419
 1048   1HH1  ARG  46          2HH1      ARG  46   1.311  28.586 -15.309
 1049   2HH1  ARG  46          1HH1      ARG  46  -0.292  27.950 -15.139
 1050   1HH2  ARG  46          2HH2      ARG  46  -1.711  31.003 -14.192
 1051   2HH2  ARG  46          1HH2      ARG  46  -2.011  29.326 -14.505
 1052    H    CYS  47           H        CYS  47   4.844  33.535 -13.789
 1053    HA   CYS  47           HA       CYS  47   7.224  34.757 -14.985
 1054   1HB   CYS  47          2HB       CYS  47   6.525  35.985 -12.958
 1055   2HB   CYS  47          3HB       CYS  47   6.601  34.505 -12.024
 1056    H    GLN  48           H        GLN  48   8.554  33.202 -15.623
 1057    HA   GLN  48           HA       GLN  48   8.319  30.503 -14.531
 1058   1HB   GLN  48          2HB       GLN  48   8.692  31.469 -17.106
 1059   2HB   GLN  48          3HB       GLN  48  10.279  30.860 -16.655
 1060   1HG   GLN  48          2HG       GLN  48   8.566  28.869 -15.819
 1061   2HG   GLN  48          3HG       GLN  48   7.856  29.422 -17.336
 1062   1HE2  GLN  48          1HE2      GLN  48  10.104  27.406 -15.950
 1063   2HE2  GLN  48          2HE2      GLN  48  11.049  27.047 -17.351
 1064    H    LEU  49           H        LEU  49   9.584  32.691 -13.030
 1065    HA   LEU  49           HA       LEU  49  12.253  31.488 -12.718
 1066   1HB   LEU  49          2HB       LEU  49  11.611  34.160 -13.386
 1067   2HB   LEU  49          3HB       LEU  49  12.224  34.165 -11.733
 1068    HG   LEU  49           HG       LEU  49  13.824  32.655 -13.703
 1069   1HD1  LEU  49          1HD1      LEU  49  13.431  34.428 -15.161
 1070   2HD1  LEU  49          2HD1      LEU  49  14.926  34.881 -14.345
 1071   3HD1  LEU  49          3HD1      LEU  49  13.400  35.618 -13.860
 1072   1HD2  LEU  49          1HD2      LEU  49  15.651  33.613 -12.445
 1073   2HD2  LEU  49          2HD2      LEU  49  14.459  32.934 -11.336
 1074   3HD2  LEU  49          3HD2      LEU  49  14.541  34.679 -11.585
 1075    H    CYS  50           H        CYS  50   9.434  33.060 -11.135
 1076    HA   CYS  50           HA       CYS  50  10.379  31.824  -8.656
 1077   1HB   CYS  50          2HB       CYS  50   9.826  33.696  -7.350
 1078   2HB   CYS  50          3HB       CYS  50  10.690  34.362  -8.722
 1079    H    ASN  51           H        ASN  51   8.434  31.375 -11.013
 1080    HA   ASN  51           HA       ASN  51   6.388  30.450 -11.370
 1081   1HB   ASN  51          2HB       ASN  51   6.161  29.990  -8.403
 1082   2HB   ASN  51          3HB       ASN  51   5.528  29.004  -9.718
 1083   1HD2  ASN  51          1HD2      ASN  51   6.766  27.435 -10.580
 1084   2HD2  ASN  51          2HD2      ASN  51   8.369  27.060 -10.053
 1085    H    GLY  52           H        GLY  52   6.710  33.328 -10.454
 1086   1HA   GLY  52          1HA       GLY  52   4.426  34.058  -8.953
 1087   2HA   GLY  52          2HA       GLY  52   5.366  35.129  -9.981
 1088    H    MET  53           H        MET  53   2.550  35.225  -9.683
 1089    HA   MET  53           HA       MET  53   1.722  34.498 -12.415
 1090   1HB   MET  53          2HB       MET  53   0.096  34.414  -9.871
 1091   2HB   MET  53          3HB       MET  53  -0.609  34.301 -11.478
 1092   1HG   MET  53          2HG       MET  53   1.172  32.356 -11.715
 1093   2HG   MET  53          3HG       MET  53   0.996  32.328  -9.962
 1094   1HE   MET  53          1HE       MET  53  -0.507  29.907  -9.519
 1095   2HE   MET  53          2HE       MET  53  -0.642  31.470  -8.716
 1096   3HE   MET  53          3HE       MET  53  -2.097  30.609  -9.220
 1097    H    GLY  54           H        GLY  54   1.996  36.448 -13.400
 1098   1HA   GLY  54          1HA       GLY  54   0.203  38.354 -13.656
 1099   2HA   GLY  54          2HA       GLY  54   0.905  38.845 -12.122
 1100    H    HIS  55           H        HIS  55   3.502  38.657 -12.330
 1101    HA   HIS  55           HA       HIS  55   4.158  40.606 -14.379
 1102   1HB   HIS  55          2HB       HIS  55   6.322  40.775 -13.197
 1103   2HB   HIS  55          3HB       HIS  55   4.954  41.013 -12.113
 1104    HD1  HIS  55           HD1      HIS  55   4.319  38.838 -10.624
 1105    HD2  HIS  55           HD2      HIS  55   8.075  38.854 -12.398
 1106    HE1  HIS  55           HE1      HIS  55   5.653  37.102  -9.388
 1107    H    ASN  56           H        ASN  56   6.721  40.191 -15.011
 1108    HA   ASN  56           HA       ASN  56   6.732  37.543 -16.304
 1109   1HB   ASN  56          2HB       ASN  56   6.823  40.130 -17.481
 1110   2HB   ASN  56          3HB       ASN  56   8.401  39.385 -17.718
 1111   1HD2  ASN  56          1HD2      ASN  56   6.446  40.008 -19.714
 1112   2HD2  ASN  56          2HD2      ASN  56   6.001  38.519 -20.470
 1113    H    ALA  57           H        ALA  57   8.760  36.517 -16.587
 1114    HA   ALA  57           HA       ALA  57  10.488  36.635 -14.405
 1115   1HB   ALA  57          1HB       ALA  57  10.205  35.050 -16.721
 1116   2HB   ALA  57          2HB       ALA  57  11.886  35.578 -16.655
 1117   3HB   ALA  57          3HB       ALA  57  11.178  34.721 -15.286
 1118    H    LYS  58           H        LYS  58  10.687  38.185 -17.563
 1119    HA   LYS  58           HA       LYS  58  13.328  39.122 -17.383
 1120   1HB   LYS  58          2HB       LYS  58  10.947  39.729 -19.019
 1121   2HB   LYS  58          3HB       LYS  58  12.117  41.036 -18.887
 1122   1HG   LYS  58          2HG       LYS  58  13.030  38.284 -19.600
 1123   2HG   LYS  58          3HG       LYS  58  12.303  39.326 -20.825
 1124   1HD   LYS  58          2HD       LYS  58  14.116  40.648 -20.941
 1125   2HD   LYS  58          3HD       LYS  58  14.346  40.644 -19.190
 1126   1HE   LYS  58          2HE       LYS  58  15.705  38.808 -19.236
 1127   2HE   LYS  58          3HE       LYS  58  14.942  38.144 -20.680
 1128   1HZ   LYS  58          1HZ       LYS  58  17.030  38.836 -21.390
 1129   2HZ   LYS  58          2HZ       LYS  58  16.983  40.270 -20.493
 1130   3HZ   LYS  58          3HZ       LYS  58  16.017  40.104 -21.873
 1131    H    GLN  59           H        GLN  59  10.434  40.148 -15.830
 1132    HA   GLN  59           HA       GLN  59  11.818  42.548 -14.829
 1133   1HB   GLN  59          2HB       GLN  59   9.550  42.647 -16.216
 1134   2HB   GLN  59          3HB       GLN  59   8.855  42.314 -14.636
 1135   1HG   GLN  59          2HG       GLN  59   8.834  44.573 -14.559
 1136   2HG   GLN  59          3HG       GLN  59  10.455  44.297 -13.924
 1137   1HE2  GLN  59          1HE2      GLN  59  11.098  46.356 -14.608
 1138   2HE2  GLN  59          2HE2      GLN  59  11.425  46.698 -16.269
 1139    H    CYS  60           H        CYS  60  11.603  39.549 -13.865
 1140    HA   CYS  60           HA       CYS  60  10.261  39.949 -11.348
 1141   1HB   CYS  60          2HB       CYS  60  10.036  37.797 -12.511
 1142   2HB   CYS  60          3HB       CYS  60  11.769  37.550 -12.440
 1143    H    ARG  61           H        ARG  61  11.312  40.200  -9.422
 1144    HA   ARG  61           HA       ARG  61  12.925  40.891  -7.972
 1145   1HB   ARG  61          2HB       ARG  61  13.731  38.468  -9.024
 1146   2HB   ARG  61          3HB       ARG  61  15.149  39.484  -9.246
 1147   1HG   ARG  61          2HG       ARG  61  15.608  39.537  -7.055
 1148   2HG   ARG  61          3HG       ARG  61  13.910  39.692  -6.599
 1149   1HD   ARG  61          2HD       ARG  61  14.290  37.599  -5.801
 1150   2HD   ARG  61          3HD       ARG  61  13.860  37.176  -7.457
 1151    HE   ARG  61           HE       ARG  61  16.579  37.552  -7.484
 1152   1HH1  ARG  61          2HH1      ARG  61  14.346  35.500  -5.774
 1153   2HH1  ARG  61          1HH1      ARG  61  15.477  34.201  -5.590
 1154   1HH2  ARG  61          2HH2      ARG  61  18.077  35.847  -7.249
 1155   2HH2  ARG  61          1HH2      ARG  61  17.599  34.400  -6.430
 1156    H    LYS  62           H        LYS  62  12.535  42.376 -10.498
 1157    HA   LYS  62           HA       LYS  62  15.069  43.854 -10.444
 1158   1HB   LYS  62          2HB       LYS  62  14.699  42.290 -12.510
 1159   2HB   LYS  62          3HB       LYS  62  13.584  43.547 -13.029
 1160   1HG   LYS  62          2HG       LYS  62  15.449  45.188 -12.811
 1161   2HG   LYS  62          3HG       LYS  62  16.532  43.829 -12.502
 1162   1HD   LYS  62          2HD       LYS  62  15.628  42.873 -14.711
 1163   2HD   LYS  62          3HD       LYS  62  15.026  44.506 -15.009
 1164   1HE   LYS  62          2HE       LYS  62  17.566  45.051 -14.283
 1165   2HE   LYS  62          3HE       LYS  62  17.785  43.464 -15.018
 1166   1HZ   LYS  62          1HZ       LYS  62  16.111  45.150 -16.598
 1167   2HZ   LYS  62          2HZ       LYS  62  17.515  44.316 -17.036
 1168   3HZ   LYS  62          3HZ       LYS  62  17.627  45.853 -16.337
 1169    H    ARG  63           H        ARG  63  14.884  46.088 -11.076
 1170    HA   ARG  63           HA       ARG  63  12.161  47.135 -10.673
 1171   1HB   ARG  63          2HB       ARG  63  14.137  47.617  -9.014
 1172   2HB   ARG  63          3HB       ARG  63  14.616  48.790 -10.233
 1173   1HG   ARG  63          2HG       ARG  63  12.529  49.955 -10.016
 1174   2HG   ARG  63          3HG       ARG  63  11.905  48.712  -8.930
 1175   1HD   ARG  63          2HD       ARG  63  12.618  50.070  -7.296
 1176   2HD   ARG  63          3HD       ARG  63  14.215  49.428  -7.678
 1177    HE   ARG  63           HE       ARG  63  13.772  51.585  -9.369
 1178   1HH1  ARG  63          2HH1      ARG  63  14.094  50.986  -5.955
 1179   2HH1  ARG  63          1HH1      ARG  63  14.746  52.553  -5.609
 1180   1HH2  ARG  63          2HH2      ARG  63  14.629  53.651  -8.926
 1181   2HH2  ARG  63          1HH2      ARG  63  15.049  54.070  -7.300
 1182    H    ASP  64           H        ASP  64  15.240  47.941 -12.280
 1183    HA   ASP  64           HA       ASP  64  13.680  49.009 -14.533
 1184   1HB   ASP  64          2HB       ASP  64  16.097  50.281 -13.237
 1185   2HB   ASP  64          3HB       ASP  64  15.436  50.782 -14.791
  Start of MODEL   20
    1   1H5*    C 160          1H5*        C 160  13.263  12.579 -17.061
    2   2H5*    C 160          2H5*        C 160  13.827  13.974 -16.142
    3    H4*    C 160           H4*        C 160  14.140  11.840 -14.953
    4    H3*    C 160           H3*        C 160  16.584  13.471 -15.641
    5    H2*    C 160           H2*        C 160  17.888  11.991 -14.332
    6   2HO*    C 160          2HO*        C 160  16.834  10.907 -12.718
    7    H1*    C 160           H1*        C 160  16.553   9.700 -15.391
    8   1H4     C 160          1H4         C 160  22.229   9.955 -18.338
    9   2H4     C 160          2H4         C 160  21.527  11.037 -19.521
   10    H5     C 160           H5         C 160  19.342  11.918 -19.366
   11    H6     C 160           H6         C 160  17.270  11.980 -18.024
   12   1H5*    U 161          1H5*        U 161  16.330  13.289 -11.197
   13   2H5*    U 161          2H5*        U 161  16.964  14.801 -10.549
   14    H4*    U 161           H4*        U 161  18.110  12.834  -9.639
   15    H3*    U 161           H3*        U 161  19.698  14.823 -11.241
   16    H2*    U 161           H2*        U 161  21.694  13.637 -10.717
   17   2HO*    U 161          2HO*        U 161  20.968  11.576  -9.304
   18    H1*    U 161           H1*        U 161  20.593  11.155 -11.419
   19    H3     U 161           H3         U 161  23.785  12.385 -14.517
   20    H5     U 161           H5         U 161  20.176  14.016 -15.875
   21    H6     U 161           H6         U 161  19.196  13.394 -13.715
   22   1H5*    G 162          1H5*        G 162  21.659  14.260  -7.467
   23   2H5*    G 162          2H5*        G 162  21.866  15.834  -6.699
   24    H4*    G 162           H4*        G 162  23.947  14.795  -6.503
   25    H3*    G 162           H3*        G 162  23.910  16.810  -8.720
   26    H2*    G 162           H2*        G 162  26.206  16.384  -9.190
   27   2HO*    G 162          2HO*        G 162  27.390  15.421  -7.586
   28    H1*    G 162           H1*        G 162  25.848  13.619  -9.306
   29    H8     G 162           H8         G 162  22.863  15.346 -10.742
   30    H1     G 162           H1         G 162  27.770  14.764 -14.922
   31   1H2     G 162          1H2         G 162  29.455  14.121 -13.921
   32   2H2     G 162          2H2         G 162  29.527  13.789 -12.206
   33   1H5*    C 163          1H5*        C 163  27.320  17.296  -6.526
   34   2H5*    C 163          2H5*        C 163  27.673  18.953  -6.041
   35    H4*    C 163           H4*        C 163  29.615  18.130  -7.097
   36    H3*    C 163           H3*        C 163  28.062  20.059  -8.790
   37    H2*    C 163           H2*        C 163  29.698  19.920 -10.503
   38   2HO*    C 163          2HO*        C 163  31.712  19.386  -9.833
   39    H1*    C 163           H1*        C 163  29.795  17.098 -10.383
   40   1H4     C 163          1H4         C 163  25.938  18.327 -15.316
   41   2H4     C 163          2H4         C 163  24.631  18.667 -14.204
   42    H5     C 163           H5         C 163  24.880  18.715 -11.856
   43    H6     C 163           H6         C 163  26.462  18.445  -9.978
   44   1H5*    C 164          1H5*        C 164  31.996  21.413  -8.722
   45   2H5*    C 164          2H5*        C 164  32.147  23.139  -8.394
   46    H4*    C 164           H4*        C 164  33.318  22.746 -10.398
   47    H3*    C 164           H3*        C 164  30.645  24.041 -10.866
   48    H2*    C 164           H2*        C 164  31.141  24.216 -13.184
   49   2HO*    C 164          2HO*        C 164  33.402  23.438 -13.738
   50    H1*    C 164           H1*        C 164  32.028  21.540 -13.338
   51   1H4     C 164          1H4         C 164  26.004  21.293 -15.423
   52   2H4     C 164          2H4         C 164  25.430  21.390 -13.772
   53    H5     C 164           H5         C 164  26.842  21.710 -11.905
   54    H6     C 164           H6         C 164  29.174  22.017 -11.156
   55   1H5*    C 165          1H5*        C 165  33.614  26.679 -12.592
   56   2H5*    C 165          2H5*        C 165  33.125  28.366 -12.446
   57    H4*    C 165           H4*        C 165  33.463  27.727 -14.773
   58    H3*    C 165           H3*        C 165  30.684  28.501 -13.921
   59    H2*    C 165           H2*        C 165  29.953  28.341 -16.173
   60   2HO*    C 165          2HO*        C 165  31.663  28.045 -17.789
   61    H1*    C 165           H1*        C 165  31.272  25.865 -16.569
   62   1H4     C 165          1H4         C 165  25.160  24.353 -15.468
   63   2H4     C 165          2H4         C 165  25.468  24.449 -13.749
   64    H5     C 165           H5         C 165  27.513  25.175 -12.816
   65    H6     C 165           H6         C 165  29.789  25.998 -13.310
   66   1H5*    U 166          1H5*        U 166  31.792  30.816 -17.234
   67   2H5*    U 166          2H5*        U 166  31.475  32.537 -17.007
   68    H4*    U 166           H4*        U 166  30.525  31.910 -19.087
   69    H3*    U 166           H3*        U 166  28.499  32.384 -16.920
   70    H2*    U 166           H2*        U 166  26.739  32.041 -18.482
   71   2HO*    U 166          2HO*        U 166  27.617  31.598 -20.767
   72    H1*    U 166           H1*        U 166  27.862  29.672 -19.477
   73    H3     U 166           H3         U 166  24.099  28.525 -17.125
   74    H5     U 166           H5         U 166  27.130  28.845 -14.254
   75    H6     U 166           H6         U 166  28.558  29.789 -16.009
   76   1H5*    C 167          1H5*        C 167  27.359  34.816 -20.038
   77   2H5*    C 167          2H5*        C 167  26.734  36.397 -19.569
   78    H4*    C 167           H4*        C 167  25.041  35.170 -20.765
   79    H3*    C 167           H3*        C 167  24.502  35.598 -17.830
   80    H2*    C 167           H2*        C 167  22.341  34.678 -18.118
   81   2HO*    C 167          2HO*        C 167  22.101  35.796 -20.150
   82    H1*    C 167           H1*        C 167  23.362  32.574 -19.778
   83   1H4     C 167          1H4         C 167  22.102  29.808 -14.158
   84   2H4     C 167          2H4         C 167  23.616  30.424 -13.535
   85    H5     C 167           H5         C 167  25.034  31.888 -14.730
   86    H6     C 167           H6         C 167  25.349  33.134 -16.839
   87   1H5*    A 168          1H5*        A 168  21.300  40.455 -18.729
   88   2H5*    A 168          2H5*        A 168  22.105  39.925 -17.252
   89    H4*    A 168           H4*        A 168  19.783  39.841 -16.831
   90    H3*    A 168           H3*        A 168  20.915  37.082 -17.320
   91    H2*    A 168           H2*        A 168  18.841  36.174 -16.708
   92   2HO*    A 168          2HO*        A 168  18.162  38.834 -15.848
   93    H1*    A 168           H1*        A 168  17.440  38.410 -17.953
   94    H8     A 168           H8         A 168  19.844  36.025 -19.713
   95   1H6     A 168          1H6         A 168  14.719  33.233 -21.925
   96   2H6     A 168          2H6         A 168  16.467  33.247 -21.994
   97    H2     A 168           H2         A 168  13.457  36.406 -19.083
   98   1H5*    U 169          1H5*        U 169  24.088  37.541 -14.520
   99   2H5*    U 169          2H5*        U 169  23.756  35.946 -13.844
  100    H4*    U 169           H4*        U 169  23.618  37.511 -11.608
  101    H3*    U 169           H3*        U 169  25.539  38.854 -13.501
  102    H2*    U 169           H2*        U 169  27.002  39.281 -11.710
  103   2HO*    U 169          2HO*        U 169  26.094  39.033  -9.542
  104    H1*    U 169           H1*        U 169  26.390  36.687 -10.542
  105    H3     U 169           H3         U 169  30.873  36.308 -10.751
  106    H5     U 169           H5         U 169  29.754  36.654 -14.772
  107    H6     U 169           H6         U 169  27.464  37.058 -13.997
  108   1H5*    C 170          1H5*        C 170  23.283  40.775 -15.221
  109   2H5*    C 170          2H5*        C 170  23.044  42.519 -15.326
  110    H4*    C 170           H4*        C 170  20.994  41.550 -15.944
  111    H3*    C 170           H3*        C 170  20.952  42.662 -13.156
  112    H2*    C 170           H2*        C 170  18.662  42.080 -12.931
  113   2HO*    C 170          2HO*        C 170  18.045  42.619 -15.033
  114    H1*    C 170           H1*        C 170  19.106  39.487 -14.021
  115   1H4     C 170          1H4         C 170  18.734  38.570  -7.712
  116   2H4     C 170          2H4         C 170  20.393  39.098  -7.550
  117    H5     C 170           H5         C 170  21.683  39.950  -9.335
  118    H6     C 170           H6         C 170  21.698  40.509 -11.741
  119   1H5*    C 171          1H5*        C 171  19.271  45.288 -16.444
  120   2H5*    C 171          2H5*        C 171  19.297  47.048 -16.344
  121    H4*    C 171           H4*        C 171  17.104  46.367 -15.792
  122    H3*    C 171           H3*        C 171  18.692  47.185 -13.364
  123    H2*    C 171           H2*        C 171  16.736  46.967 -12.047
  124   2HO*    C 171          2HO*        C 171  14.978  46.175 -13.976
  125    H1*    C 171           H1*        C 171  16.036  44.510 -13.342
  126   1H4     C 171          1H4         C 171  18.270  42.843  -7.588
  127   2H4     C 171          2H4         C 171  19.899  42.942  -8.219
  128    H5     C 171           H5         C 171  20.425  43.722 -10.385
  129    H6     C 171           H6         C 171  19.509  44.607 -12.500
  130   1H5*    G 172          1H5*        G 172  15.414  50.991 -13.366
  131   2H5*    G 172          2H5*        G 172  16.708  52.015 -12.745
  132    H4*    G 172           H4*        G 172  14.630  52.000 -11.367
  133    H3*    G 172           H3*        G 172  17.294  51.268 -10.183
  134    H2*    G 172           H2*        G 172  16.289  51.112  -8.029
  135   2HO*    G 172          2HO*        G 172  13.906  51.679  -8.042
  136    H1*    G 172           H1*        G 172  14.214  49.475  -8.926
  137    H8     G 172           H8         G 172  17.245  48.466 -10.788
  138    H1     G 172           H1         G 172  17.106  46.108  -4.762
  139   1H2     G 172          1H2         G 172  15.605  47.034  -3.695
  140   2H2     G 172          2H2         G 172  14.542  48.268  -4.336
  141   1H5*    U 173          1H5*        U 173  15.846  54.402  -7.649
  142   2H5*    U 173          2H5*        U 173  17.092  55.646  -7.542
  143    H4*    U 173           H4*        U 173  16.489  55.126  -5.326
  144    H3*    U 173           H3*        U 173  19.129  53.947  -6.131
  145    H2*    U 173           H2*        U 173  19.432  53.072  -3.943
  146   2HO*    U 173          2HO*        U 173  18.352  54.116  -2.345
  147    H1*    U 173           H1*        U 173  16.840  51.982  -3.849
  148    H3     U 173           H3         U 173  19.667  48.406  -4.028
  149    H5     U 173           H5         U 173  19.398  49.740  -7.989
  150    H6     U 173           H6         U 173  18.171  51.688  -7.145
  151   1H5*    C 174          1H5*        C 174  19.618  55.874  -2.597
  152   2H5*    C 174          2H5*        C 174  21.019  56.935  -2.448
  153    H4*    C 174           H4*        C 174  21.134  55.413  -0.650
  154    H3*    C 174           H3*        C 174  23.097  54.789  -2.839
  155    H2*    C 174           H2*        C 174  23.995  53.019  -1.542
  156   2HO*    C 174          2HO*        C 174  22.851  52.908   0.702
  157    H1*    C 174           H1*        C 174  21.408  52.066  -0.833
  158   1H4     C 174          1H4         C 174  23.375  48.120  -5.450
  159   2H4     C 174          2H4         C 174  22.952  49.323  -6.647
  160    H5     C 174           H5         C 174  22.204  51.501  -6.116
  161    H6     C 174           H6         C 174  21.672  53.073  -4.288
  162   1H5*    U 175          1H5*        U 175  26.111  58.731  -2.918
  163   2H5*    U 175          2H5*        U 175  25.894  57.404  -4.060
  164    H4*    U 175           H4*        U 175  27.853  56.265  -2.889
  165    H3*    U 175           H3*        U 175  27.991  58.946  -1.533
  166    H2*    U 175           H2*        U 175  30.304  58.983  -1.732
  167   2HO*    U 175          2HO*        U 175  30.643  56.353  -2.546
  168    H1*    U 175           H1*        U 175  30.115  57.370  -4.210
  169    H3     U 175           H3         U 175  33.150  60.324  -5.726
  170    H5     U 175           H5         U 175  29.913  62.757  -4.655
  171    H6     U 175           H6         U 175  28.827  60.748  -3.762
  172   1H5*    C 176          1H5*        C 176  26.765  55.485   0.227
  173   2H5*    C 176          2H5*        C 176  25.840  55.749   1.706
  174    H4*    C 176           H4*        C 176  27.319  54.197   2.911
  175    H3*    C 176           H3*        C 176  28.829  54.124   0.327
  176    H2*    C 176           H2*        C 176  29.291  51.811   0.603
  177   2HO*    C 176          2HO*        C 176  28.675  50.881   2.690
  178    H1*    C 176           H1*        C 176  26.604  51.215   1.255
  179   1H4     C 176          1H4         C 176  27.307  49.730  -4.933
  180   2H4     C 176          2H4         C 176  26.849  51.369  -5.339
  181    H5     C 176           H5         C 176  26.517  53.074  -3.740
  182    H6     C 176           H6         C 176  26.541  53.634  -1.335
  183   1H5*    G 177          1H5*        G 177  32.191  52.472   3.390
  184   2H5*    G 177          2H5*        G 177  33.470  53.455   2.678
  185    H4*    G 177           H4*        G 177  34.034  51.054   2.823
  186    H3*    G 177           H3*        G 177  33.987  52.427   0.151
  187    H2*    G 177           H2*        G 177  34.809  50.443  -0.879
  188   2HO*    G 177          2HO*        G 177  35.857  49.021   0.438
  189    H1*    G 177           H1*        G 177  32.894  48.815   0.331
  190    H8     G 177           H8         G 177  31.226  52.019  -0.467
  191    H1     G 177           H1         G 177  31.855  48.162  -5.625
  192   1H2     G 177          1H2         G 177  33.125  46.603  -5.170
  193   2H2     G 177          2H2         G 177  33.904  46.375  -3.620
  194   1H5*    C 178          1H5*        C 178  37.766  50.628   0.327
  195   2H5*    C 178          2H5*        C 178  39.031  51.791  -0.072
  196    H4*    C 178           H4*        C 178  39.317  49.904  -1.486
  197    H3*    C 178           H3*        C 178  38.250  52.344  -2.867
  198    H2*    C 178           H2*        C 178  38.261  51.213  -4.952
  199   2HO*    C 178          2HO*        C 178  39.286  49.056  -4.934
  200    H1*    C 178           H1*        C 178  37.047  48.898  -3.837
  201   1H4     C 178          1H4         C 178  32.247  51.942  -6.736
  202   2H4     C 178          2H4         C 178  32.177  53.086  -5.413
  203    H5     C 178           H5         C 178  33.709  53.113  -3.615
  204    H6     C 178           H6         C 178  35.703  52.038  -2.633
  205   1H5*    U 179          1H5*        U 179  41.814  51.136  -4.963
  206   2H5*    U 179          2H5*        U 179  42.704  52.507  -5.626
  207    H4*    U 179           H4*        U 179  42.021  50.941  -7.368
  208    H3*    U 179           H3*        U 179  40.860  53.716  -7.438
  209    H2*    U 179           H2*        U 179  39.818  53.222  -9.508
  210   2HO*    U 179          2HO*        U 179  40.584  51.420 -10.659
  211    H1*    U 179           H1*        U 179  38.909  50.690  -8.592
  212    H3     U 179           H3         U 179  35.272  53.368  -9.513
  213    H5     U 179           H5         U 179  36.389  54.272  -5.580
  214    H6     U 179           H6         U 179  38.416  52.944  -5.955
  215   1H5*    U 180          1H5*        U 180  42.542  52.892 -10.955
  216   2H5*    U 180          2H5*        U 180  43.505  54.114 -11.787
  217    H4*    U 180           H4*        U 180  41.764  53.458 -13.258
  218    H3*    U 180           H3*        U 180  41.407  56.187 -12.065
  219    H2*    U 180           H2*        U 180  39.417  56.512 -13.307
  220   2HO*    U 180          2HO*        U 180  39.215  55.331 -15.161
  221    H1*    U 180           H1*        U 180  38.456  53.906 -12.677
  222    H3     U 180           H3         U 180  35.395  56.591 -10.689
  223    H5     U 180           H5         U 180  38.798  56.992  -8.280
  224    H6     U 180           H6         U 180  40.016  55.678  -9.954
  225   1H5*    A 181          1H5*        A 181  43.663  57.714 -16.125
  226   2H5*    A 181          2H5*        A 181  44.166  59.261 -15.443
  227    H4*    A 181           H4*        A 181  42.441  59.349 -17.284
  228    H3*    A 181           H3*        A 181  42.049  60.704 -14.626
  229    H2*    A 181           H2*        A 181  40.035  61.673 -15.430
  230   2HO*    A 181          2HO*        A 181  39.613  61.420 -17.733
  231    H1*    A 181           H1*        A 181  39.070  59.257 -16.466
  232    H8     A 181           H8         A 181  40.879  58.780 -13.212
  233   1H6     A 181          1H6         A 181  35.401  59.839 -10.413
  234   2H6     A 181          2H6         A 181  37.053  59.328 -10.148
  235    H2     A 181           H2         A 181  34.942  60.717 -14.744
  236   1H5*    U 182          1H5*        U 182  40.253  63.688 -16.226
  237   2H5*    U 182          2H5*        U 182  40.358  64.215 -17.905
  238    H4*    U 182           H4*        U 182  41.253  65.920 -15.575
  239    H3*    U 182           H3*        U 182  38.512  65.648 -16.788
  240    H2*    U 182           H2*        U 182  38.210  67.939 -16.734
  241   2HO*    U 182          2HO*        U 182  40.374  68.416 -15.003
  242    H1*    U 182           H1*        U 182  41.163  68.319 -16.868
  243    H3     U 182           H3         U 182  39.493  71.744 -19.412
  244    H5     U 182           H5         U 182  38.960  68.298 -21.732
  245    H6     U 182           H6         U 182  39.621  66.992 -19.764
  246   1H5*    U 183          1H5*        U 183  34.864  66.122 -13.959
  247   2H5*    U 183          2H5*        U 183  34.961  67.877 -14.114
  248    H4*    U 183           H4*        U 183  35.243  66.151 -11.710
  249    H3*    U 183           H3*        U 183  33.890  68.751 -12.384
  250    H2*    U 183           H2*        U 183  34.070  69.470 -10.187
  251   2HO*    U 183          2HO*        U 183  34.718  67.397  -8.738
  252    H1*    U 183           H1*        U 183  36.525  67.835  -9.858
  253    H3     U 183           H3         U 183  36.433  72.982 -11.258
  254    H5     U 183           H5         U 183  38.676  71.473  -8.060
  255    H6     U 183           H6         U 183  37.750  69.263  -8.582
  256   1H5*    C 184          1H5*        C 184  29.131  68.082  -9.719
  257   2H5*    C 184          2H5*        C 184  30.523  69.027  -9.191
  258    H4*    C 184           H4*        C 184  29.182  66.706  -7.888
  259    H3*    C 184           H3*        C 184  30.238  69.385  -6.996
  260    H2*    C 184           H2*        C 184  30.592  68.555  -4.868
  261   2HO*    C 184          2HO*        C 184  29.177  66.784  -4.196
  262    H1*    C 184           H1*        C 184  30.845  65.807  -5.995
  263   1H4     C 184          1H4         C 184  36.138  66.396  -2.489
  264   2H4     C 184          2H4         C 184  36.714  67.650  -3.565
  265    H5     C 184           H5         C 184  35.454  68.527  -5.358
  266    H6     C 184           H6         C 184  33.308  68.415  -6.575
  267   1H5*    G 185          1H5*        G 185  25.591  70.783  -3.786
  268   2H5*    G 185          2H5*        G 185  26.720  71.906  -4.543
  269    H4*    G 185           H4*        G 185  28.202  69.644  -3.624
  270    H3*    G 185           H3*        G 185  26.119  70.572  -1.683
  271    H2*    G 185           H2*        G 185  27.693  70.492   0.104
  272   2HO*    G 185          2HO*        G 185  29.772  69.767  -1.674
  273    H1*    G 185           H1*        G 185  29.603  71.978  -1.284
  274    H8     G 185           H8         G 185  29.144  73.454   0.818
  275    H1     G 185           H1         G 185  23.405  75.218  -1.598
  276   1H2     G 185          1H2         G 185  22.952  74.038  -3.228
  277   2H2     G 185          2H2         G 185  23.974  72.761  -3.847
  278   1H5*    G 186          1H5*        G 186  26.425  66.152  -3.919
  279   2H5*    G 186          2H5*        G 186  26.297  66.922  -5.500
  280    H4*    G 186           H4*        G 186  24.183  65.539  -3.882
  281    H3*    G 186           H3*        G 186  25.342  65.230  -6.626
  282    H2*    G 186           H2*        G 186  23.262  64.417  -7.456
  283   2HO*    G 186          2HO*        G 186  21.616  64.613  -5.404
  284    H1*    G 186           H1*        G 186  21.807  66.544  -6.382
  285    H8     G 186           H8         G 186  24.892  65.841  -8.477
  286    H1     G 186           H1         G 186  21.135  70.616 -10.708
  287   1H2     G 186          1H2         G 186  19.652  71.023  -9.335
  288   2H2     G 186          2H2         G 186  19.455  70.195  -7.807
  289   1H5*    G 187          1H5*        G 187  24.830  60.687  -8.337
  290   2H5*    G 187          2H5*        G 187  26.520  60.921  -7.894
  291    H4*    G 187           H4*        G 187  25.042  62.308 -10.140
  292    H3*    G 187           H3*        G 187  26.859  59.944 -10.075
  293    H2*    G 187           H2*        G 187  27.989  60.649 -12.052
  294   2HO*    G 187          2HO*        G 187  26.983  62.946 -12.707
  295    H1*    G 187           H1*        G 187  28.449  63.222 -11.077
  296    H8     G 187           H8         G 187  28.823  61.021  -8.158
  297    H1     G 187           H1         G 187  33.952  60.778 -12.098
  298   1H2     G 187          1H2         G 187  33.491  61.696 -13.885
  299   2H2     G 187          2H2         G 187  31.946  62.424 -14.261
  300   1H5*    G 188          1H5*        G 188  26.277  60.427 -14.191
  301   2H5*    G 188          2H5*        G 188  25.249  59.060 -14.621
  302    H4*    G 188           H4*        G 188  26.889  59.019 -16.252
  303    H3*    G 188           H3*        G 188  27.594  57.070 -14.075
  304    H2*    G 188           H2*        G 188  29.493  56.366 -15.332
  305   2HO*    G 188          2HO*        G 188  29.531  57.879 -17.461
  306    H1*    G 188           H1*        G 188  30.376  58.982 -15.770
  307    H8     G 188           H8         G 188  29.053  58.982 -12.342
  308    H1     G 188           H1         G 188  34.857  56.145 -12.738
  309   1H2     G 188          1H2         G 188  35.328  55.812 -14.718
  310   2H2     G 188          2H2         G 188  34.303  56.240 -16.070
  311   1H5*    A 189          1H5*        A 189  28.026  54.190 -17.749
  312   2H5*    A 189          2H5*        A 189  27.299  52.811 -16.925
  313    H4*    A 189           H4*        A 189  29.659  52.506 -17.771
  314    H3*    A 189           H3*        A 189  28.877  51.935 -14.920
  315    H2*    A 189           H2*        A 189  31.051  51.065 -14.521
  316   2HO*    A 189          2HO*        A 189  32.437  50.912 -16.493
  317    H1*    A 189           H1*        A 189  32.332  53.242 -15.754
  318    H8     A 189           H8         A 189  29.405  54.403 -13.752
  319   1H6     A 189          1H6         A 189  33.231  54.560  -8.823
  320   2H6     A 189          2H6         A 189  31.637  55.002  -9.396
  321    H2     A 189           H2         A 189  35.357  52.556 -12.170
  322   1H5*    G 190          1H5*        G 190  30.600  48.334 -16.772
  323   2H5*    G 190          2H5*        G 190  29.671  46.921 -16.270
  324    H4*    G 190           H4*        G 190  32.002  46.502 -15.899
  325    H3*    G 190           H3*        G 190  30.332  46.836 -13.426
  326    H2*    G 190           H2*        G 190  32.220  46.301 -12.075
  327   2HO*    G 190          2HO*        G 190  33.338  44.814 -13.226
  328    H1*    G 190           H1*        G 190  33.881  48.130 -13.371
  329    H8     G 190           H8         G 190  30.524  49.674 -13.181
  330    H1     G 190           H1         G 190  33.777  50.046  -7.599
  331   1H2     G 190          1H2         G 190  35.443  48.833  -7.691
  332   2H2     G 190          2H2         G 190  35.890  47.860  -9.074
  333   1H5*    C 191          1H5*        C 191  32.132  42.865 -12.948
  334   2H5*    C 191          2H5*        C 191  30.924  41.818 -12.203
  335    H4*    C 191           H4*        C 191  32.966  41.942 -10.871
  336    H3*    C 191           H3*        C 191  30.422  43.007  -9.675
  337    H2*    C 191           H2*        C 191  31.548  43.409  -7.624
  338   2HO*    C 191          2HO*        C 191  33.666  42.481  -7.394
  339    H1*    C 191           H1*        C 191  33.746  44.641  -8.897
  340   1H4     C 191          1H4         C 191  30.029  49.452  -6.920
  341   2H4     C 191          2H4         C 191  29.092  49.300  -8.390
  342    H5     C 191           H5         C 191  29.412  47.586  -9.983
  343    H6     C 191           H6         C 191  30.722  45.576 -10.564
  344   1H5*    G 192          1H5*        G 192  32.001  40.426  -6.655
  345   2H5*    G 192          2H5*        G 192  30.782  39.170  -6.426
  346    H4*    G 192           H4*        G 192  31.292  39.851  -4.265
  347    H3*    G 192           H3*        G 192  28.768  41.171  -5.213
  348    H2*    G 192           H2*        G 192  28.502  42.207  -3.083
  349   2HO*    G 192          2HO*        G 192  30.948  40.948  -2.296
  350    H1*    G 192           H1*        G 192  31.116  43.182  -3.040
  351    H8     G 192           H8         G 192  29.765  43.315  -6.519
  352    H1     G 192           H1         G 192  27.975  48.341  -2.855
  353   1H2     G 192          1H2         G 192  28.487  47.978  -0.891
  354   2H2     G 192          2H2         G 192  29.283  46.528  -0.322
  355   1H5*    G 193          1H5*        G 193  28.377  39.409  -1.582
  356   2H5*    G 193          2H5*        G 193  26.905  38.537  -1.158
  357    H4*    G 193           H4*        G 193  27.314  40.197   0.509
  358    H3*    G 193           H3*        G 193  24.970  40.735  -1.286
  359    H2*    G 193           H2*        G 193  24.429  42.678  -0.017
  360   2HO*    G 193          2HO*        G 193  25.983  43.016   1.874
  361    H1*    G 193           H1*        G 193  27.029  43.685  -0.133
  362    H8     G 193           H8         G 193  26.381  42.081  -3.397
  363    H1     G 193           H1         G 193  23.621  47.914  -2.885
  364   1H2     G 193          1H2         G 193  23.700  48.542  -0.922
  365   2H2     G 193          2H2         G 193  24.408  47.625   0.389
  366   1H5*    A 194          1H5*        A 194  23.672  41.338   2.608
  367   2H5*    A 194          2H5*        A 194  22.357  40.228   2.996
  368    H4*    A 194           H4*        A 194  21.582  42.278   3.754
  369    H3*    A 194           H3*        A 194  20.430  41.667   1.049
  370    H2*    A 194           H2*        A 194  19.161  43.677   1.118
  371   2HO*    A 194          2HO*        A 194  19.694  44.889   3.313
  372    H1*    A 194           H1*        A 194  21.346  45.253   1.849
  373    H8     A 194           H8         A 194  22.377  42.565  -0.546
  374   1H6     A 194          1H6         A 194  20.832  46.514  -5.125
  375   2H6     A 194          2H6         A 194  21.599  44.982  -4.774
  376    H2     A 194           H2         A 194  19.464  48.250  -1.271
  377   1H5*    C 195          1H5*        C 195  17.148  42.499   3.490
  378   2H5*    C 195          2H5*        C 195  15.764  41.443   3.213
  379    H4*    C 195           H4*        C 195  15.093  43.706   2.831
  380    H3*    C 195           H3*        C 195  15.289  42.005   0.358
  381    H2*    C 195           H2*        C 195  14.413  43.794  -0.936
  382   2HO*    C 195          2HO*        C 195  13.376  45.470   0.174
  383    H1*    C 195           H1*        C 195  16.152  45.677   0.281
  384   1H4     C 195          1H4         C 195  18.864  44.298  -5.338
  385   2H4     C 195          2H4         C 195  19.566  42.862  -4.625
  386    H5     C 195           H5         C 195  19.099  42.117  -2.434
  387    H6     C 195           H6         C 195  17.830  42.570  -0.365
  388   1H5*    G 196          1H5*        G 196  10.867  43.233   0.095
  389   2H5*    G 196          2H5*        G 196  10.175  41.614  -0.024
  390    H4*    G 196           H4*        G 196   9.298  42.896  -1.817
  391    H3*    G 196           H3*        G 196  11.346  40.864  -2.655
  392    H2*    G 196           H2*        G 196  10.970  41.424  -4.941
  393   2HO*    G 196          2HO*        G 196   9.240  43.213  -5.152
  394    H1*    G 196           H1*        G 196  11.250  44.165  -4.492
  395    H8     G 196           H8         G 196  13.587  42.114  -2.375
  396    H1     G 196           H1         G 196  15.864  43.444  -8.285
  397   1H2     G 196          1H2         G 196  14.371  44.297  -9.422
  398   2H2     G 196          2H2         G 196  12.744  44.606  -8.859
  399   1H5*    A 197          1H5*        A 197  10.516  37.072  -4.531
  400   2H5*    A 197          2H5*        A 197  10.813  37.902  -6.059
  401    H4*    A 197           H4*        A 197   8.383  36.512  -5.078
  402    H3*    A 197           H3*        A 197   9.899  36.714  -7.658
  403    H2*    A 197           H2*        A 197   7.943  36.171  -8.888
  404   2HO*    A 197          2HO*        A 197   6.163  36.002  -6.823
  405    H1*    A 197           H1*        A 197   6.354  38.008  -7.439
  406    H8     A 197           H8         A 197   9.435  37.706  -9.616
  407   1H6     A 197          1H6         A 197   7.450  42.906 -12.440
  408   2H6     A 197          2H6         A 197   8.644  41.629 -12.498
  409    H2     A 197           H2         A 197   4.832  42.144  -8.931
  410   1H5*    U 198          1H5*        U 198  11.850  34.761  -3.124
  411   2H5*    U 198          2H5*        U 198  12.807  34.772  -4.605
  412    H4*    U 198           H4*        U 198  12.654  32.320  -4.722
  413    H3*    U 198           H3*        U 198  10.995  32.602  -2.214
  414    H2*    U 198           H2*        U 198  11.950  30.680  -1.383
  415   2HO*    U 198          2HO*        U 198  12.929  29.537  -3.649
  416    H1*    U 198           H1*        U 198  14.271  31.044  -3.238
  417    H3     U 198           H3         U 198  16.738  29.459   0.166
  418    H5     U 198           H5         U 198  14.701  32.676   1.907
  419    H6     U 198           H6         U 198  13.481  32.919  -0.205
  420   1H5*    G 199          1H5*        G 199   8.240  33.633  -4.831
  421   2H5*    G 199          2H5*        G 199   8.482  34.929  -3.659
  422    H4*    G 199           H4*        G 199   6.179  34.880  -3.994
  423    H3*    G 199           H3*        G 199   6.914  33.436  -1.463
  424    H2*    G 199           H2*        G 199   4.604  33.100  -0.989
  425   2HO*    G 199          2HO*        G 199   3.613  34.907  -1.725
  426    H1*    G 199           H1*        G 199   4.048  32.099  -3.535
  427    H8     G 199           H8         G 199   6.480  31.654  -0.656
  428    H1     G 199           H1         G 199   4.249  26.134  -3.193
  429   1H2     G 199          1H2         G 199   3.142  26.550  -4.883
  430   2H2     G 199          2H2         G 199   2.861  28.156  -5.517
  431   1H5*    A 200          1H5*        A 200   9.152  34.278  -0.391
  432   2H5*    A 200          2H5*        A 200   7.745  33.520   0.355
  433    H4*    A 200           H4*        A 200   9.026  35.145   2.324
  434    H3*    A 200           H3*        A 200  10.950  33.659   0.600
  435    H2*    A 200           H2*        A 200  12.096  32.760   2.477
  436   2HO*    A 200          2HO*        A 200  10.564  33.703   4.498
  437    H1*    A 200           H1*        A 200   9.831  31.795   3.713
  438    H8     A 200           H8         A 200   9.120  31.538   0.094
  439   1H6     A 200          1H6         A 200  12.352  26.199   0.084
  440   2H6     A 200          2H6         A 200  11.283  27.210  -0.862
  441    H2     A 200           H2         A 200  13.013  28.217   3.988
  442   1H5*    C 201          1H5*        C 201  14.731  36.280   2.400
  443   2H5*    C 201          2H5*        C 201  15.526  34.711   2.518
  444    H4*    C 201           H4*        C 201  13.162  35.767   4.024
  445    H3*    C 201           H3*        C 201  15.807  34.536   4.743
  446    H2*    C 201           H2*        C 201  14.897  33.670   6.735
  447   2HO*    C 201          2HO*        C 201  12.581  34.486   7.137
  448    H1*    C 201           H1*        C 201  12.432  32.988   5.366
  449   1H4     C 201          1H4         C 201  15.041  27.314   6.623
  450   2H4     C 201          2H4         C 201  16.334  27.644   5.491
  451    H5     C 201           H5         C 201  16.592  29.698   4.354
  452    H6     C 201           H6         C 201  15.666  31.962   4.019
  453   1H5*    C 202          1H5*        C 202  14.877  37.251   8.090
  454   2H5*    C 202          2H5*        C 202  16.360  37.676   8.943
  455    H4*    C 202           H4*        C 202  14.758  36.344  10.292
  456    H3*    C 202           H3*        C 202  17.520  35.226   9.782
  457    H2*    C 202           H2*        C 202  17.054  33.522  11.342
  458   2HO*    C 202          2HO*        C 202  14.571  34.276  12.160
  459    H1*    C 202           H1*        C 202  14.347  33.268  10.378
  460   1H4     C 202          1H4         C 202  17.433  28.017   8.409
  461   2H4     C 202          2H4         C 202  17.994  28.912   7.015
  462    H5     C 202           H5         C 202  17.642  31.228   6.709
  463    H6     C 202           H6         C 202  16.652  33.273   7.674
  464   1H5*    C 203          1H5*        C 203  17.763  36.301  14.283
  465   2H5*    C 203          2H5*        C 203  19.500  36.461  14.538
  466    H4*    C 203           H4*        C 203  18.422  34.682  15.898
  467    H3*    C 203           H3*        C 203  20.654  33.978  13.999
  468    H2*    C 203           H2*        C 203  20.677  31.781  14.902
  469   2HO*    C 203          2HO*        C 203  19.710  31.482  16.907
  470    H1*    C 203           H1*        C 203  17.851  31.574  14.771
  471   1H4     C 203          1H4         C 203  20.012  28.428   9.643
  472   2H4     C 203          2H4         C 203  20.115  29.947   8.782
  473    H5     C 203           H5         C 203  19.721  32.052   9.776
  474    H6     C 203           H6         C 203  19.125  33.231  11.864
  475   1H5*    U 204          1H5*        U 204  21.159  33.208  17.926
  476   2H5*    U 204          2H5*        U 204  22.679  33.222  18.821
  477    H4*    U 204           H4*        U 204  21.582  31.091  19.086
  478    H3*    U 204           H3*        U 204  24.147  31.090  17.520
  479    H2*    U 204           H2*        U 204  24.062  28.715  17.386
  480   2HO*    U 204          2HO*        U 204  22.525  27.647  18.726
  481    H1*    U 204           H1*        U 204  21.413  28.679  16.512
  482    H3     U 204           H3         U 204  24.278  27.557  13.060
  483    H5     U 204           H5         U 204  23.783  31.711  12.864
  484    H6     U 204           H6         U 204  22.661  31.581  15.039
  485   1H5*    A 205          1H5*        A 205  26.028  30.030  21.777
  486   2H5*    A 205          2H5*        A 205  27.721  30.396  21.447
  487    H4*    A 205           H4*        A 205  27.038  27.942  21.601
  488    H3*    A 205           H3*        A 205  28.686  29.094  19.363
  489    H2*    A 205           H2*        A 205  28.969  26.915  18.463
  490   2HO*    A 205          2HO*        A 205  27.718  25.260  19.983
  491    H1*    A 205           H1*        A 205  26.252  26.276  18.653
  492    H8     A 205           H8         A 205  26.370  29.813  17.644
  493   1H6     A 205          1H6         A 205  27.322  27.894  11.783
  494   2H6     A 205          2H6         A 205  26.943  29.284  12.776
  495    H2     A 205           H2         A 205  27.781  24.395  14.482
  496   1H5*    G 206          1H5*        G 206  30.793  26.961  17.646
  497   2H5*    G 206          2H5*        G 206  32.391  27.167  18.362
  498    H4*    G 206           H4*        G 206  31.019  28.988  16.378
  499    H3*    G 206           H3*        G 206  33.208  26.976  16.156
  500    H2*    G 206           H2*        G 206  34.455  28.365  14.675
  501   2HO*    G 206          2HO*        G 206  32.976  30.607  14.661
  502    H1*    G 206           H1*        G 206  34.306  30.588  16.353
  503    H8     G 206           H8         G 206  34.636  27.557  18.477
  504    H1     G 206           H1         G 206  40.274  29.563  16.015
  505   1H2     G 206          1H2         G 206  39.926  31.000  14.576
  506   2H2     G 206          2H2         G 206  38.342  31.575  14.107
  507   1H5*    U 207          1H5*        U 207  30.227  26.355  11.864
  508   2H5*    U 207          2H5*        U 207  31.480  25.951  10.691
  509    H4*    U 207           H4*        U 207  29.729  27.667  10.004
  510    H3*    U 207           H3*        U 207  32.692  28.090   9.700
  511    H2*    U 207           H2*        U 207  32.275  30.140   8.576
  512   2HO*    U 207          2HO*        U 207  29.580  30.257   8.691
  513    H1*    U 207           H1*        U 207  30.440  31.035  10.489
  514    H3     U 207           H3         U 207  33.860  33.749  11.547
  515    H5     U 207           H5         U 207  35.330  29.959  12.552
  516    H6     U 207           H6         U 207  33.274  29.019  11.602
  517   1H5*    A 208          1H5*        A 208  32.884  27.452   4.375
  518   2H5*    A 208          2H5*        A 208  31.282  26.982   3.812
  519    H4*    A 208           H4*        A 208  32.843  25.339   3.075
  520    H3*    A 208           H3*        A 208  30.941  24.474   5.208
  521    H2*    A 208           H2*        A 208  31.901  22.299   5.294
  522   2HO*    A 208          2HO*        A 208  33.743  23.174   3.282
  523    H1*    A 208           H1*        A 208  34.515  23.269   5.513
  524    H8     A 208           H8         A 208  31.513  24.891   7.257
  525   1H6     A 208          1H6         A 208  33.563  21.996  12.391
  526   2H6     A 208          2H6         A 208  32.353  23.097  11.773
  527    H2     A 208           H2         A 208  36.170  20.813   8.993
  528   1H5*    G 209          1H5*        G 209  29.610  22.009   2.738
  529   2H5*    G 209          2H5*        G 209  27.885  21.649   2.814
  530    H4*    G 209           H4*        G 209  29.278  20.361   4.422
  531    H3*    G 209           H3*        G 209  27.013  22.089   5.377
  532    H2*    G 209           H2*        G 209  27.356  21.309   7.602
  533   2HO*    G 209          2HO*        G 209  29.357  19.710   7.592
  534    H1*    G 209           H1*        G 209  30.102  21.820   7.535
  535    H8     G 209           H8         G 209  28.384  24.528   5.666
  536    H1     G 209           H1         G 209  28.162  25.339  12.084
  537   1H2     G 209          1H2         G 209  28.802  23.616  13.017
  538   2H2     G 209          2H2         G 209  29.322  22.166  12.186
  539   1H5*    A 210          1H5*        A 210  26.878  18.577   7.842
  540   2H5*    A 210          2H5*        A 210  25.251  17.958   7.560
  541    H4*    A 210           H4*        A 210  25.579  18.112   9.910
  542    H3*    A 210           H3*        A 210  23.732  20.214   8.798
  543    H2*    A 210           H2*        A 210  23.256  20.939  11.010
  544   2HO*    A 210          2HO*        A 210  24.573  19.479  12.647
  545    H1*    A 210           H1*        A 210  25.960  20.988  11.762
  546    H8     A 210           H8         A 210  25.400  22.212   8.254
  547   1H6     A 210          1H6         A 210  24.606  27.882  10.737
  548   2H6     A 210          2H6         A 210  24.777  27.005   9.234
  549    H2     A 210           H2         A 210  24.823  24.931  14.053
  550   1H5*    G 211          1H5*        G 211  21.775  17.812  11.744
  551   2H5*    G 211          2H5*        G 211  20.032  17.628  11.548
  552    H4*    G 211           H4*        G 211  20.665  18.606  13.719
  553    H3*    G 211           H3*        G 211  18.931  20.178  11.835
  554    H2*    G 211           H2*        G 211  18.666  21.867  13.496
  555   2HO*    G 211          2HO*        G 211  18.833  21.105  15.523
  556    H1*    G 211           H1*        G 211  21.409  22.048  13.987
  557    H8     G 211           H8         G 211  21.130  21.506  10.364
  558    H1     G 211           H1         G 211  19.639  27.570  12.062
  559   1H2     G 211          1H2         G 211  19.413  27.676  14.110
  560   2H2     G 211          2H2         G 211  19.598  26.323  15.202
  561   1H5*    G 212          1H5*        G 212  16.213  19.904  15.541
  562   2H5*    G 212          2H5*        G 212  14.742  19.322  14.762
  563    H4*    G 212           H4*        G 212  14.252  21.259  16.111
  564    H3*    G 212           H3*        G 212  13.992  21.596  13.137
  565    H2*    G 212           H2*        G 212  13.137  23.796  13.463
  566   2HO*    G 212          2HO*        G 212  12.140  24.081  15.376
  567    H1*    G 212           H1*        G 212  15.215  24.531  15.177
  568    H8     G 212           H8         G 212  16.481  22.303  12.451
  569    H1     G 212           H1         G 212  16.037  28.525  10.725
  570   1H2     G 212          1H2         G 212  15.022  29.573  12.182
  571   2H2     G 212          2H2         G 212  14.386  28.871  13.653
  572   1H5*    G 213          1H5*        G 213   9.893  22.400  14.929
  573   2H5*    G 213          2H5*        G 213   8.713  21.907  13.716
  574    H4*    G 213           H4*        G 213   8.439  24.246  14.424
  575    H3*    G 213           H3*        G 213   9.032  23.622  11.550
  576    H2*    G 213           H2*        G 213   8.825  25.929  10.991
  577   2HO*    G 213          2HO*        G 213   8.313  27.281  13.051
  578    H1*    G 213           H1*        G 213  10.545  26.751  13.033
  579    H8     G 213           H8         G 213  11.987  23.609  11.789
  580    H1     G 213           H1         G 213  13.100  28.574   7.791
  581   1H2     G 213          1H2         G 213  11.919  30.176   8.336
  582   2H2     G 213          2H2         G 213  10.795  30.173   9.676
  583   1H5*    G 214          1H5*        G 214   7.173  26.511   9.680
  584   2H5*    G 214          2H5*        G 214   6.059  25.531   8.727
  585    H4*    G 214           H4*        G 214   7.865  26.683   7.428
  586    H3*    G 214           H3*        G 214   7.432  23.714   7.262
  587    H2*    G 214           H2*        G 214   9.102  23.567   5.568
  588   2HO*    G 214          2HO*        G 214   9.688  25.468   4.541
  589    H1*    G 214           H1*        G 214  10.972  25.019   7.042
  590    H8     G 214           H8         G 214   9.169  22.992   9.525
  591    H1     G 214           H1         G 214  13.442  19.509   6.134
  592   1H2     G 214          1H2         G 214  14.092  20.605   4.513
  593   2H2     G 214          2H2         G 214  13.558  22.226   4.128
  594   1H5*    G 215          1H5*        G 215   6.977  24.985   3.003
  595   2H5*    G 215          2H5*        G 215   5.620  24.030   2.407
  596    H4*    G 215           H4*        G 215   7.729  23.770   1.106
  597    H3*    G 215           H3*        G 215   6.383  21.380   2.346
  598    H2*    G 215           H2*        G 215   7.942  19.958   1.241
  599   2HO*    G 215          2HO*        G 215   9.561  21.719   0.039
  600    H1*    G 215           H1*        G 215  10.147  21.483   2.079
  601    H8     G 215           H8         G 215   7.869  21.397   4.955
  602    H1     G 215           H1         G 215  11.055  15.817   4.188
  603   1H2     G 215          1H2         G 215  11.971  15.795   2.341
  604   2H2     G 215          2H2         G 215  11.889  17.095   1.173
  605   1H5*    C 216          1H5*        C 216   4.463  21.109  -1.942
  606   2H5*    C 216          2H5*        C 216   3.071  20.062  -1.660
  607    H4*    C 216           H4*        C 216   5.092  19.054  -2.842
  608    H3*    C 216           H3*        C 216   3.753  17.760  -0.467
  609    H2*    C 216           H2*        C 216   5.126  15.852  -0.787
  610   2HO*    C 216          2HO*        C 216   6.483  16.922  -2.986
  611    H1*    C 216           H1*        C 216   7.460  17.408  -1.143
  612   1H4     C 216          1H4         C 216   7.506  15.372   4.936
  613   2H4     C 216          2H4         C 216   6.711  16.864   5.386
  614    H5     C 216           H5         C 216   5.915  18.452   3.831
  615    H6     C 216           H6         C 216   5.684  19.006   1.435
  616   1H5*    U 217          1H5*        U 217   2.992  14.915  -3.763
  617   2H5*    U 217          2H5*        U 217   1.669  13.848  -3.292
  618    H4*    U 217           H4*        U 217   3.905  12.747  -3.493
  619    H3*    U 217           H3*        U 217   2.317  12.596  -0.941
  620    H2*    U 217           H2*        U 217   3.922  11.069  -0.064
  621   2HO*    U 217          2HO*        U 217   5.465  10.209  -1.547
  622    H1*    U 217           H1*        U 217   6.088  12.695  -0.796
  623    H3     U 217           H3         U 217   5.799  12.790   3.775
  624    H5     U 217           H5         U 217   3.057  15.664   2.447
  625    H6     U 217           H6         U 217   3.432  14.827   0.173
  626   1H5*    G 218          1H5*        G 218  -0.417   8.281  -1.492
  627   2H5*    G 218          2H5*        G 218   0.756   9.378  -0.761
  628    H4*    G 218           H4*        G 218   1.326   6.881  -1.627
  629    H3*    G 218           H3*        G 218   3.144   9.293  -1.422
  630    H2*    G 218           H2*        G 218   4.934   7.909  -2.058
  631   2HO*    G 218          2HO*        G 218   3.389   5.562  -2.038
  632    H1*    G 218           H1*        G 218   3.256   6.450  -3.914
  633    H8     G 218           H8         G 218   3.281  10.168  -4.327
  634    H1     G 218           H1         G 218   8.074   7.173  -7.479
  635   1H2     G 218          1H2         G 218   8.148   5.195  -6.901
  636   2H2     G 218          2H2         G 218   7.070   4.458  -5.737
  637   1H5*    C 219          1H5*        C 219   4.339   6.951   1.583
  638   2H5*    C 219          2H5*        C 219   4.077   5.477   2.515
  639    H4*    C 219           H4*        C 219   4.730   6.708   4.261
  640    H3*    C 219           H3*        C 219   1.870   7.490   3.926
  641    H2*    C 219           H2*        C 219   2.052   9.237   5.503
  642   2HO*    C 219          2HO*        C 219   4.771   8.510   5.961
  643    H1*    C 219           H1*        C 219   4.451  10.247   4.477
  644   1H4     C 219          1H4         C 219  -0.475  13.469   1.838
  645   2H4     C 219          2H4         C 219  -0.064  12.650   0.348
  646    H5     C 219           H5         C 219   1.526  10.911   0.199
  647    H6     C 219           H6         C 219   3.130   9.516   1.455
  648   1H5*    G 220          1H5*        G 220   4.659   3.635   6.128
  649   2H5*    G 220          2H5*        G 220   4.971   5.334   5.769
  650    H4*    G 220           H4*        G 220   6.406   3.012   4.919
  651    H3*    G 220           H3*        G 220   6.805   5.992   4.565
  652    H2*    G 220           H2*        G 220   8.660   5.507   3.207
  653   2HO*    G 220          2HO*        G 220   8.734   2.788   3.481
  654    H1*    G 220           H1*        G 220   7.308   3.201   2.073
  655    H8     G 220           H8         G 220   7.100   3.771  -0.367
  656    H1     G 220           H1         G 220   6.793  10.128   0.805
  657   1H2     G 220          1H2         G 220   6.779  10.453   2.842
  658   2H2     G 220          2H2         G 220   6.841   9.192   4.051
  659   1H5*    G 221          1H5*        G 221  10.089   4.891   5.447
  660   2H5*    G 221          2H5*        G 221  11.188   5.664   6.591
  661    H4*    G 221           H4*        G 221  11.813   5.686   4.111
  662    H3*    G 221           H3*        G 221  11.932   8.048   5.950
  663    H2*    G 221           H2*        G 221  12.760   9.425   4.196
  664   2HO*    G 221          2HO*        G 221  12.598   7.489   2.213
  665    H1*    G 221           H1*        G 221  10.776   8.737   2.406
  666    H8     G 221           H8         G 221  10.158   8.973   6.186
  667    H1     G 221           H1         G 221   8.127  14.035   2.703
  668   1H2     G 221          1H2         G 221   8.641  13.761   0.725
  669   2H2     G 221          2H2         G 221   9.494  12.366   0.102
  670   1H5*    C 222          1H5*        C 222  15.841   7.995   3.639
  671   2H5*    C 222          2H5*        C 222  16.941   8.906   4.672
  672    H4*    C 222           H4*        C 222  16.425   9.872   2.379
  673    H3*    C 222           H3*        C 222  16.205  11.464   4.927
  674    H2*    C 222           H2*        C 222  15.769  13.413   3.645
  675   2HO*    C 222          2HO*        C 222  15.797  12.355   1.143
  676    H1*    C 222           H1*        C 222  13.873  12.127   2.016
  677   1H4     C 222          1H4         C 222  10.473  15.045   6.578
  678   2H4     C 222          2H4         C 222  10.691  13.642   7.601
  679    H5     C 222           H5         C 222  12.061  11.804   7.038
  680    H6     C 222           H6         C 222  13.576  10.848   5.339
  681   1H5*    U 223          1H5*        U 223  19.386  13.701   2.924
  682   2H5*    U 223          2H5*        U 223  20.173  14.675   4.164
  683    H4*    U 223           H4*        U 223  18.538  15.739   2.390
  684    H3*    U 223           H3*        U 223  18.815  16.494   5.300
  685    H2*    U 223           H2*        U 223  17.306  18.275   4.936
  686   2HO*    U 223          2HO*        U 223  18.149  18.950   2.964
  687    H1*    U 223           H1*        U 223  15.538  16.718   3.380
  688    H3     U 223           H3         U 223  13.507  17.957   7.342
  689    H5     U 223           H5         U 223  15.498  14.358   8.133
  690    H6     U 223           H6         U 223  16.575  14.586   5.943
  691   1H5*    U 224          1H5*        U 224  19.347  15.780   0.000
  692   2H5*    U 224          2H5*        U 224  19.496  17.421  -0.626
  693    H4*    U 224           H4*        U 224  17.303  15.737  -0.860
  694    H3*    U 224           H3*        U 224  17.615  18.713  -1.310
  695    H2*    U 224           H2*        U 224  15.358  18.773  -1.963
  696   2HO*    U 224          2HO*        U 224  14.377  16.704  -2.522
  697    H1*    U 224           H1*        U 224  14.647  16.800   0.037
  698    H3     U 224           H3         U 224  11.851  20.283   0.913
  699    H5     U 224           H5         U 224  15.597  21.595   2.248
  700    H6     U 224           H6         U 224  16.557  19.583   1.227
  701   1H5*    A 225          1H5*        A 225  18.481  17.597  -5.978
  702   2H5*    A 225          2H5*        A 225  18.878  19.242  -6.472
  703    H4*    A 225           H4*        A 225  16.657  18.223  -7.259
  704    H3*    A 225           H3*        A 225  16.940  20.979  -6.076
  705    H2*    A 225           H2*        A 225  14.656  21.393  -6.568
  706   2HO*    A 225          2HO*        A 225  13.624  19.966  -8.028
  707    H1*    A 225           H1*        A 225  13.806  18.922  -5.525
  708    H8     A 225           H8         A 225  16.526  20.769  -3.633
  709   1H6     A 225          1H6         A 225  11.908  23.190  -0.204
  710   2H6     A 225          2H6         A 225  13.646  23.074  -0.360
  711    H2     A 225           H2         A 225  10.098  20.867  -3.531
  712   1H5*    G 226          1H5*        G 226  15.464  20.613  -9.865
  713   2H5*    G 226          2H5*        G 226  15.608  21.802 -11.160
  714    H4*    G 226           H4*        G 226  13.290  21.292 -10.807
  715    H3*    G 226           H3*        G 226  14.162  24.048  -9.993
  716    H2*    G 226           H2*        G 226  11.906  24.613  -9.474
  717   2HO*    G 226          2HO*        G 226  10.386  22.666  -9.902
  718    H1*    G 226           H1*        G 226  11.515  22.325  -7.921
  719    H8     G 226           H8         G 226  14.966  23.366  -7.219
  720    H1     G 226           H1         G 226  10.617  27.100  -4.216
  721   1H2     G 226          1H2         G 226   8.740  26.726  -4.983
  722   2H2     G 226          2H2         G 226   8.396  25.571  -6.252
  723   1H5*    G 227          1H5*        G 227  12.015  25.523 -13.828
  724   2H5*    G 227          2H5*        G 227  12.766  24.165 -14.667
  725    H4*    G 227           H4*        G 227  12.305  26.110 -16.127
  726    H3*    G 227           H3*        G 227  15.109  25.080 -15.812
  727    H2*    G 227           H2*        G 227  15.866  26.634 -17.452
  728   2HO*    G 227          2HO*        G 227  13.646  28.026 -17.988
  729    H1*    G 227           H1*        G 227  14.610  28.803 -16.226
  730    H8     G 227           H8         G 227  15.817  26.697 -13.462
  731    H1     G 227           H1         G 227  20.574  30.101 -16.229
  732   1H2     G 227          1H2         G 227  19.898  30.916 -17.999
  733   2H2     G 227          2H2         G 227  18.284  30.706 -18.639
  734   1H5*    A 228          1H5*        A 228  14.273  24.980 -19.999
  735   2H5*    A 228          2H5*        A 228  14.923  23.529 -20.762
  736    H4*    A 228           H4*        A 228  15.803  25.480 -21.856
  737    H3*    A 228           H3*        A 228  17.767  23.856 -20.265
  738    H2*    A 228           H2*        A 228  19.537  25.262 -20.995
  739   2HO*    A 228          2HO*        A 228  19.120  25.922 -23.021
  740    H1*    A 228           H1*        A 228  18.067  27.616 -20.427
  741    H8     A 228           H8         A 228  17.633  25.185 -17.662
  742   1H6     A 228          1H6         A 228  22.986  27.333 -15.278
  743   2H6     A 228          2H6         A 228  21.593  26.326 -14.954
  744    H2     A 228           H2         A 228  22.523  28.992 -19.376
  745   1H5*    G 229          1H5*        G 229  19.213  24.127 -24.497
  746   2H5*    G 229          2H5*        G 229  19.826  22.532 -24.934
  747    H4*    G 229           H4*        G 229  21.461  24.221 -25.471
  748    H3*    G 229           H3*        G 229  22.166  22.306 -23.273
  749    H2*    G 229           H2*        G 229  24.328  23.291 -23.086
  750   2HO*    G 229          2HO*        G 229  23.656  25.206 -25.069
  751    H1*    G 229           H1*        G 229  23.320  25.888 -22.928
  752    H8     G 229           H8         G 229  20.925  23.795 -21.075
  753    H1     G 229           H1         G 229  26.324  24.957 -17.699
  754   1H2     G 229          1H2         G 229  27.753  25.768 -18.944
  755   2H2     G 229          2H2         G 229  27.524  26.085 -20.649
  756   1H5*    G 230          1H5*        G 230  25.489  21.859 -26.337
  757   2H5*    G 230          2H5*        G 230  25.864  20.135 -26.322
  758    H4*    G 230           H4*        G 230  27.835  21.546 -25.914
  759    H3*    G 230           H3*        G 230  26.956  19.601 -23.800
  760    H2*    G 230           H2*        G 230  28.881  20.141 -22.505
  761   2HO*    G 230          2HO*        G 230  29.627  22.038 -24.499
  762    H1*    G 230           H1*        G 230  28.447  22.891 -22.697
  763    H8     G 230           H8         G 230  25.093  21.413 -22.412
  764    H1     G 230           H1         G 230  28.214  21.550 -16.743
  765   1H2     G 230          1H2         G 230  30.203  21.994 -17.063
  766   2H2     G 230          2H2         G 230  30.917  22.286 -18.633
  767   1H5*    G 231          1H5*        G 231  31.065  18.935 -24.483
  768   2H5*    G 231          2H5*        G 231  31.310  17.266 -25.000
  769    H4*    G 231           H4*        G 231  32.938  17.601 -23.373
  770    H3*    G 231           H3*        G 231  30.587  16.111 -22.278
  771    H2*    G 231           H2*        G 231  31.608  15.976 -20.130
  772   2HO*    G 231          2HO*        G 231  33.829  17.472 -20.569
  773    H1*    G 231           H1*        G 231  32.161  18.710 -20.031
  774    H8     G 231           H8         G 231  28.884  18.254 -21.720
  775    H1     G 231           H1         G 231  28.488  17.906 -15.270
  776   1H2     G 231          1H2         G 231  30.384  17.797 -14.469
  777   2H2     G 231          2H2         G 231  31.862  17.800 -15.405
  778   1H5*    C 232          1H5*        C 232  34.021  14.213 -21.117
  779   2H5*    C 232          2H5*        C 232  34.077  12.468 -21.365
  780    H4*    C 232           H4*        C 232  34.616  12.815 -19.105
  781    H3*    C 232           H3*        C 232  31.812  11.822 -19.487
  782    H2*    C 232           H2*        C 232  31.481  11.764 -17.135
  783   2HO*    C 232          2HO*        C 232  33.300  11.660 -15.879
  784    H1*    C 232           H1*        C 232  32.540  14.351 -16.772
  785   1H4     C 232          1H4         C 232  26.219  15.226 -16.944
  786   2H4     C 232          2H4         C 232  26.267  15.161 -18.692
  787    H5     C 232           H5         C 232  28.212  14.661 -19.936
  788    H6     C 232           H6         C 232  30.612  14.097 -19.808
  789   1H5*    A 233          1H5*        A 233  33.779   9.149 -16.697
  790   2H5*    A 233          2H5*        A 233  33.309   7.478 -17.000
  791    H4*    A 233           H4*        A 233  32.857   8.026 -14.708
  792    H3*    A 233           H3*        A 233  30.465   7.587 -16.462
  793    H2*    A 233           H2*        A 233  29.009   7.891 -14.606
  794   2HO*    A 233          2HO*        A 233  31.332   8.334 -12.995
  795    H1*    A 233           H1*        A 233  30.302  10.254 -13.792
  796    H8     A 233           H8         A 233  29.991  10.043 -17.518
  797   1H6     A 233          1H6         A 233  24.390  12.718 -16.869
  798   2H6     A 233          2H6         A 233  25.597  12.223 -18.034
  799    H2     A 233           H2         A 233  25.901  11.662 -12.827
  800   1H5*    G 234          1H5*        G 234  30.100   5.267 -12.891
  801   2H5*    G 234          2H5*        G 234  29.745   3.584 -13.280
  802    H4*    G 234           H4*        G 234  28.222   4.232 -11.595
  803    H3*    G 234           H3*        G 234  26.994   3.992 -14.316
  804    H2*    G 234           H2*        G 234  24.848   4.533 -13.436
  805   2HO*    G 234          2HO*        G 234  24.650   3.899 -11.371
  806    H1*    G 234           H1*        G 234  25.774   6.805 -12.108
  807    H8     G 234           H8         G 234  27.637   6.611 -15.295
  808    H1     G 234           H1         G 234  21.638   8.924 -16.037
  809   1H2     G 234          1H2         G 234  20.564   8.624 -14.301
  810   2H2     G 234          2H2         G 234  21.196   7.860 -12.860
  811   1H    GLY  15          1H        GLY  15  10.995  -3.119  -1.028
  812   1HA   GLY  15          1HA       GLY  15   8.152  -2.541  -1.532
  813   2HA   GLY  15          2HA       GLY  15   8.837  -3.005   0.019
  814    H    ARG  16           H        ARG  16   9.319  -0.433  -2.407
  815    HA   ARG  16           HA       ARG  16   8.575   1.647  -0.647
  816   1HB   ARG  16          2HB       ARG  16  10.837   2.696  -0.409
  817   2HB   ARG  16          3HB       ARG  16  10.622   1.217   0.518
  818   1HG   ARG  16          2HG       ARG  16  11.647   0.365  -1.918
  819   2HG   ARG  16          3HG       ARG  16  12.541   1.841  -1.544
  820   1HD   ARG  16          2HD       ARG  16  12.201  -0.536   0.281
  821   2HD   ARG  16          3HD       ARG  16  13.654  -0.139  -0.635
  822    HE   ARG  16           HE       ARG  16  12.815   1.013   1.841
  823   1HH1  ARG  16          2HH1      ARG  16  14.558   1.635  -1.108
  824   2HH1  ARG  16          1HH1      ARG  16  15.556   2.868  -0.411
  825   1HH2  ARG  16          2HH2      ARG  16  14.124   2.635   2.769
  826   2HH2  ARG  16          1HH2      ARG  16  15.309   3.435   1.795
  827    H    ALA  17           H        ALA  17  10.485   0.681  -3.447
  828    HA   ALA  17           HA       ALA  17  10.632   1.520  -5.558
  829   1HB   ALA  17          1HB       ALA  17   8.201   3.154  -4.848
  830   2HB   ALA  17          2HB       ALA  17   8.768   2.728  -6.463
  831   3HB   ALA  17          3HB       ALA  17   8.153   1.475  -5.386
  832    H    ARG  18           H        ARG  18  11.622   3.018  -3.035
  833    HA   ARG  18           HA       ARG  18  11.662   5.758  -3.477
  834   1HB   ARG  18          2HB       ARG  18  12.543   4.417  -1.471
  835   2HB   ARG  18          3HB       ARG  18  14.031   4.250  -2.394
  836   1HG   ARG  18          2HG       ARG  18  12.820   6.937  -1.850
  837   2HG   ARG  18          3HG       ARG  18  13.883   6.142  -0.688
  838   1HD   ARG  18          2HD       ARG  18  15.151   5.947  -3.190
  839   2HD   ARG  18          3HD       ARG  18  14.554   7.601  -3.064
  840    HE   ARG  18           HE       ARG  18  15.910   6.731  -0.700
  841   1HH1  ARG  18          2HH1      ARG  18  16.349   8.030  -3.900
  842   2HH1  ARG  18          1HH1      ARG  18  17.874   8.766  -3.534
  843   1HH2  ARG  18          2HH2      ARG  18  17.917   7.695  -0.206
  844   2HH2  ARG  18          1HH2      ARG  18  18.765   8.574  -1.432
  845    H    GLY  19           H        GLY  19  12.673   7.072  -4.872
  846   1HA   GLY  19          1HA       GLY  19  14.480   7.748  -6.250
  847   2HA   GLY  19          2HA       GLY  19  14.985   6.068  -6.368
  848    H    LEU  20           H        LEU  20  12.081   5.352  -6.907
  849    HA   LEU  20           HA       LEU  20  12.186   5.937  -9.779
  850   1HB   LEU  20          2HB       LEU  20  11.261   3.668  -8.145
  851   2HB   LEU  20          3HB       LEU  20  10.255   4.059  -9.539
  852    HG   LEU  20           HG       LEU  20  13.086   3.913 -10.204
  853   1HD1  LEU  20          1HD1      LEU  20  12.780   2.212  -8.300
  854   2HD1  LEU  20          2HD1      LEU  20  13.513   1.663  -9.807
  855   3HD1  LEU  20          3HD1      LEU  20  11.822   1.300  -9.467
  856   1HD2  LEU  20          1HD2      LEU  20  10.510   2.751 -11.211
  857   2HD2  LEU  20          2HD2      LEU  20  12.069   2.257 -11.871
  858   3HD2  LEU  20          3HD2      LEU  20  11.562   3.943 -11.975
  859    H    CYS  21           H        CYS  21  10.842   7.502 -10.592
  860    HA   CYS  21           HA       CYS  21   8.853   8.632  -8.972
  861   1HB   CYS  21          2HB       CYS  21  10.092   9.826 -10.787
  862   2HB   CYS  21          3HB       CYS  21   9.195   8.902 -11.976
  863    H    TYR  22           H        TYR  22   6.581   8.536  -9.296
  864    HA   TYR  22           HA       TYR  22   5.630   6.064 -10.587
  865   1HB   TYR  22          2HB       TYR  22   5.139   5.662  -8.375
  866   2HB   TYR  22          3HB       TYR  22   4.926   7.368  -7.999
  867    HD1  TYR  22           HD1      TYR  22   3.316   4.703 -10.071
  868    HD2  TYR  22           HD2      TYR  22   2.783   8.112  -7.580
  869    HE1  TYR  22           HE1      TYR  22   0.877   4.427 -10.223
  870    HE2  TYR  22           HE2      TYR  22   0.342   7.843  -7.725
  871    HH   TYR  22           HH       TYR  22  -1.141   5.070  -8.816
  872    H    THR  23           H        THR  23   5.281   9.485 -10.312
  873    HA   THR  23           HA       THR  23   2.680   9.768 -11.378
  874    HB   THR  23           HB       THR  23   5.001  11.705 -11.496
  875    HG1  THR  23           HG1      THR  23   4.567  11.598  -9.395
  876   1HG2  THR  23          1HG2      THR  23   3.464  12.485 -13.086
  877   2HG2  THR  23          2HG2      THR  23   3.048  13.373 -11.621
  878   3HG2  THR  23          3HG2      THR  23   2.076  11.990 -12.119
  879    H    CYS  24           H        CYS  24   5.953   9.731 -12.935
  880    HA   CYS  24           HA       CYS  24   4.533   9.634 -15.494
  881   1HB   CYS  24          2HB       CYS  24   6.554  10.490 -16.540
  882   2HB   CYS  24          3HB       CYS  24   6.032  11.573 -15.265
  883    H    GLY  25           H        GLY  25   7.000   8.263 -13.395
  884   1HA   GLY  25          1HA       GLY  25   7.342   5.898 -13.231
  885   2HA   GLY  25          2HA       GLY  25   6.866   5.749 -14.916
  886    H    SER  26           H        SER  26   9.143   8.116 -13.653
  887    HA   SER  26           HA       SER  26  11.197   6.956 -15.394
  888   1HB   SER  26          2HB       SER  26  10.480   9.434 -15.503
  889   2HB   SER  26          3HB       SER  26  11.397   9.624 -14.009
  890    HG   SER  26           HG       SER  26  13.245   9.045 -15.072
  891    HA   PRO  27           HA       PRO  27  13.096   5.330 -11.698
  892   1HB   PRO  27          2HB       PRO  27  15.196   4.171 -12.970
  893   2HB   PRO  27          3HB       PRO  27  13.576   3.463 -12.947
  894   1HG   PRO  27          2HG       PRO  27  14.909   5.078 -15.088
  895   2HG   PRO  27          3HG       PRO  27  13.921   3.613 -15.242
  896   1HD   PRO  27          2HD       PRO  27  12.939   6.090 -15.722
  897   2HD   PRO  27          3HD       PRO  27  11.941   4.778 -15.063
  898    H    GLY  28           H        GLY  28  13.686   7.371 -10.807
  899   1HA   GLY  28          1HA       GLY  28  16.371   7.831 -10.419
  900   2HA   GLY  28          2HA       GLY  28  15.932   8.848 -11.783
  901    H    HIS  29           H        HIS  29  13.770  10.092 -11.338
  902    HA   HIS  29           HA       HIS  29  14.186  11.501  -8.809
  903   1HB   HIS  29          2HB       HIS  29  12.957  13.330  -9.789
  904   2HB   HIS  29          3HB       HIS  29  14.156  12.780 -10.956
  905    HD1  HIS  29           HD1      HIS  29  13.305  12.302 -13.237
  906    HD2  HIS  29           HD2      HIS  29  10.267  12.274 -10.403
  907    HE1  HIS  29           HE1      HIS  29  11.173  12.024 -14.541
  908    H    TYR  30           H        TYR  30  11.843  12.621  -8.233
  909    HA   TYR  30           HA       TYR  30   9.912  10.413  -7.995
  910   1HB   TYR  30          2HB       TYR  30  11.451  11.473  -5.893
  911   2HB   TYR  30          3HB       TYR  30   9.833  12.133  -5.679
  912    HD1  TYR  30           HD1      TYR  30  11.509   8.871  -6.401
  913    HD2  TYR  30           HD2      TYR  30   8.300  10.895  -4.475
  914    HE1  TYR  30           HE1      TYR  30  10.783   6.748  -5.395
  915    HE2  TYR  30           HE2      TYR  30   7.565   8.777  -3.463
  916    HH   TYR  30           HH       TYR  30   9.488   5.912  -3.593
  917    H    GLN  31           H        GLN  31   7.775  11.357  -7.012
  918    HA   GLN  31           HA       GLN  31   6.603  13.010  -8.882
  919   1HB   GLN  31          2HB       GLN  31   5.224  11.680  -7.453
  920   2HB   GLN  31          3HB       GLN  31   5.844  12.474  -6.012
  921   1HG   GLN  31          2HG       GLN  31   4.444  14.214  -6.205
  922   2HG   GLN  31          3HG       GLN  31   4.576  14.261  -7.962
  923   1HE2  GLN  31          1HE2      GLN  31   2.575  14.174  -8.710
  924   2HE2  GLN  31          2HE2      GLN  31   1.377  13.015  -8.255
  925    H    ALA  32           H        ALA  32   8.007  13.891  -5.751
  926    HA   ALA  32           HA       ALA  32   7.306  16.591  -5.726
  927   1HB   ALA  32          1HB       ALA  32   8.163  15.603  -3.742
  928   2HB   ALA  32          2HB       ALA  32   9.676  15.165  -4.536
  929   3HB   ALA  32          3HB       ALA  32   9.301  16.860  -4.226
  930    H    GLN  33           H        GLN  33   9.639  14.906  -7.622
  931    HA   GLN  33           HA       GLN  33  10.589  17.477  -8.699
  932   1HB   GLN  33          2HB       GLN  33  12.181  15.761  -7.322
  933   2HB   GLN  33          3HB       GLN  33  12.403  15.165  -8.961
  934   1HG   GLN  33          2HG       GLN  33  12.600  17.970  -9.084
  935   2HG   GLN  33          3HG       GLN  33  13.558  17.445  -7.700
  936   1HE2  GLN  33          1HE2      GLN  33  14.241  18.500 -10.430
  937   2HE2  GLN  33          2HE2      GLN  33  15.382  17.364 -11.057
  938    H    CYS  34           H        CYS  34   8.321  15.701  -9.587
  939    HA   CYS  34           HA       CYS  34   9.326  14.398 -11.923
  940   1HB   CYS  34          2HB       CYS  34   7.357  13.565 -10.627
  941   2HB   CYS  34          3HB       CYS  34   6.451  14.977 -11.139
  942    HA   PRO  35           HA       PRO  35   9.352  18.218 -14.249
  943   1HB   PRO  35          2HB       PRO  35  10.035  17.083 -16.618
  944   2HB   PRO  35          3HB       PRO  35  11.195  17.353 -15.312
  945   1HG   PRO  35          2HG       PRO  35   9.743  14.846 -16.069
  946   2HG   PRO  35          3HG       PRO  35  11.442  15.059 -15.608
  947   1HD   PRO  35          2HD       PRO  35   9.568  14.142 -13.883
  948   2HD   PRO  35          3HD       PRO  35  10.954  15.118 -13.357
  949    H    LYS  36           H        LYS  36   7.305  15.505 -14.687
  950    HA   LYS  36           HA       LYS  36   5.763  16.815 -16.802
  951   1HB   LYS  36          2HB       LYS  36   5.959  14.041 -15.744
  952   2HB   LYS  36          3HB       LYS  36   4.408  14.544 -16.405
  953   1HG   LYS  36          2HG       LYS  36   5.970  15.374 -18.391
  954   2HG   LYS  36          3HG       LYS  36   6.993  14.078 -17.767
  955   1HD   LYS  36          2HD       LYS  36   5.565  12.452 -18.433
  956   2HD   LYS  36          3HD       LYS  36   4.133  13.427 -18.096
  957   1HE   LYS  36          2HE       LYS  36   5.741  14.471 -20.291
  958   2HE   LYS  36          3HE       LYS  36   5.144  12.839 -20.588
  959   1HZ   LYS  36          1HZ       LYS  36   2.901  13.645 -20.041
  960   2HZ   LYS  36          2HZ       LYS  36   3.559  14.431 -21.385
  961   3HZ   LYS  36          3HZ       LYS  36   3.509  15.216 -19.887
  962    H    LYS  37           H        LYS  37   5.917  16.974 -13.554
  963    HA   LYS  37           HA       LYS  37   3.141  16.787 -12.864
  964   1HB   LYS  37          2HB       LYS  37   5.543  16.904 -11.457
  965   2HB   LYS  37          3HB       LYS  37   4.739  18.419 -11.066
  966   1HG   LYS  37          2HG       LYS  37   3.009  16.058 -10.934
  967   2HG   LYS  37          3HG       LYS  37   4.340  16.067  -9.774
  968   1HD   LYS  37          2HD       LYS  37   3.578  18.503  -9.304
  969   2HD   LYS  37          3HD       LYS  37   2.069  17.998 -10.069
  970   1HE   LYS  37          2HE       LYS  37   1.918  16.134  -8.456
  971   2HE   LYS  37          3HE       LYS  37   3.379  16.725  -7.667
  972   1HZ   LYS  37          1HZ       LYS  37   2.272  18.384  -6.670
  973   2HZ   LYS  37          2HZ       LYS  37   0.912  17.414  -6.933
  974   3HZ   LYS  37          3HZ       LYS  37   1.265  18.681  -7.997
  975    H    ARG  38           H        ARG  38   1.816  18.164 -13.911
  976    HA   ARG  38           HA       ARG  38   0.817  20.103 -14.556
  977   1HB   ARG  38          2HB       ARG  38   0.920  20.561 -12.131
  978   2HB   ARG  38          3HB       ARG  38   2.497  21.310 -12.351
  979   1HG   ARG  38          2HG       ARG  38   0.919  22.659 -14.150
  980   2HG   ARG  38          3HG       ARG  38  -0.165  22.394 -12.783
  981   1HD   ARG  38          2HD       ARG  38   2.575  23.650 -12.662
  982   2HD   ARG  38          3HD       ARG  38   1.037  24.508 -12.566
  983    HE   ARG  38           HE       ARG  38   2.334  23.034 -10.467
  984   1HH1  ARG  38          2HH1      ARG  38  -0.704  24.238 -11.667
  985   2HH1  ARG  38          1HH1      ARG  38  -1.462  24.254 -10.109
  986   1HH2  ARG  38          2HH2      ARG  38   1.348  23.051  -8.411
  987   2HH2  ARG  38          1HH2      ARG  38  -0.294  23.580  -8.257
  988    H    LYS  39           H        LYS  39   1.934  19.992 -16.584
  989    HA   LYS  39           HA       LYS  39   3.201  22.380 -17.319
  990   1HB   LYS  39          2HB       LYS  39   4.972  20.428 -16.209
  991   2HB   LYS  39          3HB       LYS  39   5.323  20.590 -17.925
  992   1HG   LYS  39          2HG       LYS  39   4.968  23.168 -16.667
  993   2HG   LYS  39          3HG       LYS  39   6.231  22.220 -15.878
  994   1HD   LYS  39          2HD       LYS  39   7.590  22.271 -17.695
  995   2HD   LYS  39          3HD       LYS  39   6.244  22.235 -18.836
  996   1HE   LYS  39          2HE       LYS  39   5.835  24.555 -18.561
  997   2HE   LYS  39          3HE       LYS  39   6.903  24.647 -17.160
  998   1HZ   LYS  39          1HZ       LYS  39   8.449  23.673 -19.222
  999   2HZ   LYS  39          2HZ       LYS  39   8.503  25.227 -18.557
 1000   3HZ   LYS  39          3HZ       LYS  39   7.536  24.920 -19.911
 1001    H    SER  40           H        SER  40   2.378  22.596 -19.284
 1002    HA   SER  40           HA       SER  40   2.644  20.380 -21.185
 1003   1HB   SER  40          2HB       SER  40   0.214  20.997 -20.001
 1004   2HB   SER  40          3HB       SER  40   0.143  21.842 -21.548
 1005    HG   SER  40           HG       SER  40  -0.566  19.545 -21.460
 1006    H    GLY  41           H        GLY  41   1.370  23.712 -20.979
 1007   1HA   GLY  41          1HA       GLY  41   2.497  25.557 -22.037
 1008   2HA   GLY  41          2HA       GLY  41   3.155  24.426 -23.211
 1009    H    ASN  42           H        ASN  42   0.945  26.822 -22.791
 1010    HA   ASN  42           HA       ASN  42  -0.438  26.083 -25.244
 1011   1HB   ASN  42          2HB       ASN  42  -2.022  25.216 -23.724
 1012   2HB   ASN  42          3HB       ASN  42  -1.812  26.562 -22.607
 1013   1HD2  ASN  42          1HD2      ASN  42  -3.056  25.663 -25.769
 1014   2HD2  ASN  42          2HD2      ASN  42  -4.237  26.921 -25.864
 1015    H    SER  43           H        SER  43   0.001  28.491 -22.685
 1016    HA   SER  43           HA       SER  43  -0.346  30.604 -24.710
 1017   1HB   SER  43          2HB       SER  43  -1.874  30.423 -22.569
 1018   2HB   SER  43          3HB       SER  43  -0.493  31.180 -21.775
 1019    HG   SER  43           HG       SER  43  -1.804  32.197 -24.080
 1020    H    ARG  44           H        ARG  44   0.849  32.706 -23.879
 1021    HA   ARG  44           HA       ARG  44   3.590  31.911 -23.145
 1022   1HB   ARG  44          2HB       ARG  44   2.630  33.936 -25.159
 1023   2HB   ARG  44          3HB       ARG  44   4.268  33.957 -24.519
 1024   1HG   ARG  44          2HG       ARG  44   3.577  31.318 -25.430
 1025   2HG   ARG  44          3HG       ARG  44   3.316  32.512 -26.703
 1026   1HD   ARG  44          2HD       ARG  44   5.518  32.121 -27.077
 1027   2HD   ARG  44          3HD       ARG  44   5.692  33.352 -25.826
 1028    HE   ARG  44           HE       ARG  44   6.626  31.766 -24.486
 1029   1HH1  ARG  44          2HH1      ARG  44   4.737  30.169 -26.937
 1030   2HH1  ARG  44          1HH1      ARG  44   5.219  28.576 -26.455
 1031   1HH2  ARG  44          2HH2      ARG  44   7.267  29.673 -23.841
 1032   2HH2  ARG  44          1HH2      ARG  44   6.657  28.295 -24.693
 1033    H    GLU  45           H        GLU  45   1.665  32.623 -21.233
 1034    HA   GLU  45           HA       GLU  45   2.610  35.283 -20.385
 1035   1HB   GLU  45          2HB       GLU  45  -0.026  33.895 -19.943
 1036   2HB   GLU  45          3HB       GLU  45   0.493  35.239 -18.935
 1037   1HG   GLU  45          2HG       GLU  45   0.454  36.745 -20.736
 1038   2HG   GLU  45          3HG       GLU  45   0.360  35.446 -21.923
 1039    H    ARG  46           H        ARG  46   3.844  32.624 -19.955
 1040    HA   ARG  46           HA       ARG  46   3.582  32.358 -17.043
 1041   1HB   ARG  46          2HB       ARG  46   3.449  30.380 -18.770
 1042   2HB   ARG  46          3HB       ARG  46   5.204  30.485 -18.719
 1043   1HG   ARG  46          2HG       ARG  46   5.302  29.865 -16.482
 1044   2HG   ARG  46          3HG       ARG  46   3.610  30.273 -16.197
 1045   1HD   ARG  46          2HD       ARG  46   3.931  28.244 -18.250
 1046   2HD   ARG  46          3HD       ARG  46   4.635  27.755 -16.710
 1047    HE   ARG  46           HE       ARG  46   2.085  28.812 -16.232
 1048   1HH1  ARG  46          2HH1      ARG  46   3.586  26.057 -17.742
 1049   2HH1  ARG  46          1HH1      ARG  46   2.243  25.002 -17.453
 1050   1HH2  ARG  46          2HH2      ARG  46   0.310  27.432 -15.845
 1051   2HH2  ARG  46          1HH2      ARG  46   0.379  25.786 -16.374
 1052    H    CYS  47           H        CYS  47   5.809  31.667 -15.922
 1053    HA   CYS  47           HA       CYS  47   7.858  33.448 -17.027
 1054   1HB   CYS  47          2HB       CYS  47   6.778  34.468 -15.049
 1055   2HB   CYS  47          3HB       CYS  47   7.189  33.060 -14.091
 1056    H    GLN  48           H        GLN  48   9.558  32.268 -17.584
 1057    HA   GLN  48           HA       GLN  48   9.954  29.602 -16.458
 1058   1HB   GLN  48          2HB       GLN  48  10.191  30.618 -19.033
 1059   2HB   GLN  48          3HB       GLN  48  11.857  30.422 -18.503
 1060   1HG   GLN  48          2HG       GLN  48  11.754  28.243 -18.845
 1061   2HG   GLN  48          3HG       GLN  48  10.359  28.103 -17.776
 1062   1HE2  GLN  48          1HE2      GLN  48  11.076  26.807 -20.365
 1063   2HE2  GLN  48          2HE2      GLN  48   9.705  27.068 -21.385
 1064    H    LEU  49           H        LEU  49  10.571  32.062 -14.957
 1065    HA   LEU  49           HA       LEU  49  13.439  31.560 -14.512
 1066   1HB   LEU  49          2HB       LEU  49  12.168  33.987 -15.236
 1067   2HB   LEU  49          3HB       LEU  49  12.708  34.148 -13.566
 1068    HG   LEU  49           HG       LEU  49  14.695  33.079 -15.472
 1069   1HD1  LEU  49          1HD1      LEU  49  15.068  35.752 -15.827
 1070   2HD1  LEU  49          2HD1      LEU  49  13.311  35.623 -15.907
 1071   3HD1  LEU  49          3HD1      LEU  49  14.315  34.671 -17.000
 1072   1HD2  LEU  49          1HD2      LEU  49  15.278  33.461 -13.162
 1073   2HD2  LEU  49          2HD2      LEU  49  14.740  35.137 -13.267
 1074   3HD2  LEU  49          3HD2      LEU  49  16.150  34.604 -14.184
 1075    H    CYS  50           H        CYS  50  10.251  32.385 -13.068
 1076    HA   CYS  50           HA       CYS  50  11.370  31.438 -10.535
 1077   1HB   CYS  50          2HB       CYS  50  10.305  33.116  -9.282
 1078   2HB   CYS  50          3HB       CYS  50  11.031  33.970 -10.627
 1079    H    ASN  51           H        ASN  51   9.705  30.498 -12.959
 1080    HA   ASN  51           HA       ASN  51   7.978  29.083 -13.385
 1081   1HB   ASN  51          2HB       ASN  51   8.853  28.488 -10.686
 1082   2HB   ASN  51          3HB       ASN  51   7.135  28.156 -10.883
 1083   1HD2  ASN  51          1HD2      ASN  51   6.620  26.240 -11.642
 1084   2HD2  ASN  51          2HD2      ASN  51   7.654  25.192 -12.548
 1085    H    GLY  52           H        GLY  52   7.522  31.953 -12.501
 1086   1HA   GLY  52          1HA       GLY  52   5.061  32.085 -11.108
 1087   2HA   GLY  52          2HA       GLY  52   5.747  33.358 -12.107
 1088    H    MET  53           H        MET  53   2.986  32.731 -11.932
 1089    HA   MET  53           HA       MET  53   2.494  31.820 -14.690
 1090   1HB   MET  53          2HB       MET  53   1.367  30.867 -12.190
 1091   2HB   MET  53          3HB       MET  53   0.114  31.426 -13.290
 1092   1HG   MET  53          2HG       MET  53   0.577  29.817 -14.859
 1093   2HG   MET  53          3HG       MET  53   2.239  29.609 -14.310
 1094   1HE   MET  53          1HE       MET  53  -1.446  27.831 -13.873
 1095   2HE   MET  53          2HE       MET  53  -1.504  28.187 -12.146
 1096   3HE   MET  53          3HE       MET  53  -1.340  29.500 -13.313
 1097    H    GLY  54           H        GLY  54   2.298  33.771 -15.686
 1098   1HA   GLY  54          1HA       GLY  54   0.090  35.157 -16.033
 1099   2HA   GLY  54          2HA       GLY  54   0.583  35.813 -14.479
 1100    H    HIS  55           H        HIS  55   3.159  36.275 -14.595
 1101    HA   HIS  55           HA       HIS  55   3.376  38.329 -16.638
 1102   1HB   HIS  55          2HB       HIS  55   5.376  39.048 -15.374
 1103   2HB   HIS  55          3HB       HIS  55   3.947  38.935 -14.350
 1104    HD1  HIS  55           HD1      HIS  55   3.820  36.673 -12.858
 1105    HD2  HIS  55           HD2      HIS  55   7.524  37.643 -14.474
 1106    HE1  HIS  55           HE1      HIS  55   5.498  35.339 -11.543
 1107    H    ASN  56           H        ASN  56   5.983  38.580 -17.165
 1108    HA   ASN  56           HA       ASN  56   6.719  36.019 -18.424
 1109   1HB   ASN  56          2HB       ASN  56   5.951  38.041 -19.890
 1110   2HB   ASN  56          3HB       ASN  56   7.561  38.670 -19.550
 1111   1HD2  ASN  56          1HD2      ASN  56   5.724  36.685 -21.524
 1112   2HD2  ASN  56          2HD2      ASN  56   7.011  35.881 -22.352
 1113    H    ALA  57           H        ALA  57   8.952  35.539 -18.615
 1114    HA   ALA  57           HA       ALA  57  10.495  36.097 -16.357
 1115   1HB   ALA  57          1HB       ALA  57  11.146  34.934 -19.041
 1116   2HB   ALA  57          2HB       ALA  57  12.404  35.195 -17.831
 1117   3HB   ALA  57          3HB       ALA  57  11.044  34.131 -17.473
 1118    H    LYS  58           H        LYS  58  10.381  37.655 -19.505
 1119    HA   LYS  58           HA       LYS  58  12.721  39.196 -19.287
 1120   1HB   LYS  58          2HB       LYS  58  10.243  39.302 -20.924
 1121   2HB   LYS  58          3HB       LYS  58  11.201  40.774 -20.834
 1122   1HG   LYS  58          2HG       LYS  58  12.250  38.083 -21.687
 1123   2HG   LYS  58          3HG       LYS  58  11.759  39.379 -22.781
 1124   1HD   LYS  58          2HD       LYS  58  13.667  40.517 -22.467
 1125   2HD   LYS  58          3HD       LYS  58  13.658  40.230 -20.725
 1126   1HE   LYS  58          2HE       LYS  58  15.454  38.951 -21.195
 1127   2HE   LYS  58          3HE       LYS  58  14.234  37.752 -21.618
 1128   1HZ   LYS  58          1HZ       LYS  58  14.730  37.894 -23.784
 1129   2HZ   LYS  58          2HZ       LYS  58  16.195  38.552 -23.254
 1130   3HZ   LYS  58          3HZ       LYS  58  14.941  39.572 -23.750
 1131    H    GLN  59           H        GLN  59   9.652  39.481 -17.765
 1132    HA   GLN  59           HA       GLN  59  10.387  42.152 -16.761
 1133   1HB   GLN  59          2HB       GLN  59   8.178  41.700 -18.145
 1134   2HB   GLN  59          3HB       GLN  59   7.582  41.143 -16.587
 1135   1HG   GLN  59          2HG       GLN  59   8.793  43.553 -16.000
 1136   2HG   GLN  59          3HG       GLN  59   8.017  43.836 -17.557
 1137   1HE2  GLN  59          1HE2      GLN  59   7.419  44.804 -14.811
 1138   2HE2  GLN  59          2HE2      GLN  59   5.759  44.407 -14.548
 1139    H    CYS  60           H        CYS  60  10.919  39.178 -15.800
 1140    HA   CYS  60           HA       CYS  60   9.581  39.324 -13.239
 1141   1HB   CYS  60          2HB       CYS  60   9.697  37.163 -14.453
 1142   2HB   CYS  60          3HB       CYS  60  11.445  37.199 -14.346
 1143    H    ARG  61           H        ARG  61  10.659  39.761 -11.364
 1144    HA   ARG  61           HA       ARG  61  12.201  40.714  -9.985
 1145   1HB   ARG  61          2HB       ARG  61  14.024  39.042 -11.719
 1146   2HB   ARG  61          3HB       ARG  61  14.559  39.880 -10.268
 1147   1HG   ARG  61          2HG       ARG  61  12.555  38.556  -9.180
 1148   2HG   ARG  61          3HG       ARG  61  12.839  37.478 -10.548
 1149   1HD   ARG  61          2HD       ARG  61  14.343  36.531  -9.165
 1150   2HD   ARG  61          3HD       ARG  61  15.371  37.862  -9.694
 1151    HE   ARG  61           HE       ARG  61  13.869  38.701  -7.478
 1152   1HH1  ARG  61          2HH1      ARG  61  16.453  36.512  -8.284
 1153   2HH1  ARG  61          1HH1      ARG  61  17.187  36.595  -6.717
 1154   1HH2  ARG  61          2HH2      ARG  61  14.827  38.819  -5.412
 1155   2HH2  ARG  61          1HH2      ARG  61  16.261  37.907  -5.084
 1156    H    LYS  62           H        LYS  62  11.413  42.199 -12.336
 1157    HA   LYS  62           HA       LYS  62  13.705  44.019 -12.463
 1158   1HB   LYS  62          2HB       LYS  62  12.150  43.018 -14.854
 1159   2HB   LYS  62          3HB       LYS  62  13.257  44.385 -14.899
 1160   1HG   LYS  62          2HG       LYS  62  15.127  43.044 -14.593
 1161   2HG   LYS  62          3HG       LYS  62  14.179  41.703 -13.944
 1162   1HD   LYS  62          2HD       LYS  62  13.303  41.175 -16.091
 1163   2HD   LYS  62          3HD       LYS  62  13.932  42.671 -16.786
 1164   1HE   LYS  62          2HE       LYS  62  16.150  41.380 -15.687
 1165   2HE   LYS  62          3HE       LYS  62  15.215  40.105 -16.467
 1166   1HZ   LYS  62          1HZ       LYS  62  16.387  42.529 -17.682
 1167   2HZ   LYS  62          2HZ       LYS  62  15.135  41.685 -18.445
 1168   3HZ   LYS  62          3HZ       LYS  62  16.606  40.912 -18.129
 1169    H    ARG  63           H        ARG  63  10.277  43.527 -13.247
 1170    HA   ARG  63           HA       ARG  63   8.465  44.892 -13.082
 1171   1HB   ARG  63          2HB       ARG  63   9.548  45.167 -10.749
 1172   2HB   ARG  63          3HB       ARG  63  10.072  46.738 -11.338
 1173   1HG   ARG  63          2HG       ARG  63   7.974  47.606 -11.314
 1174   2HG   ARG  63          3HG       ARG  63   7.207  46.051 -11.648
 1175   1HD   ARG  63          2HD       ARG  63   7.683  45.330  -9.356
 1176   2HD   ARG  63          3HD       ARG  63   8.448  46.884  -9.027
 1177    HE   ARG  63           HE       ARG  63   5.723  47.076  -9.944
 1178   1HH1  ARG  63          2HH1      ARG  63   7.819  46.736  -7.185
 1179   2HH1  ARG  63          1HH1      ARG  63   6.661  47.370  -6.064
 1180   1HH2  ARG  63          2HH2      ARG  63   4.190  47.913  -8.478
 1181   2HH2  ARG  63          1HH2      ARG  63   4.596  48.039  -6.800
 1182    H    ASP  64           H        ASP  64  10.535  45.353 -15.124
 1183    HA   ASP  64           HA       ASP  64   9.471  47.702 -16.273
 1184   1HB   ASP  64          2HB       ASP  64  11.265  49.236 -16.138
 1185   2HB   ASP  64          3HB       ASP  64  11.049  48.639 -14.496