*HEADER    VIRUS/VIRAL PROTEIN/RNA                 05-JAN-05   1WWF              
*TITLE     NMR STRUCTURE DETERMINED FOR MLV NC COMPLEX WITH RNA                  
*TITLE    2 SEQUENCE CCUCCGU                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NUCLEOPROTEIN P10;                                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: NUCLEOCAPSID PROTEIN;                                       
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: 5'-R(P*CP*CP*UP*CP*CP*GP*U)-3';                            
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MOLONEY MURINE LEUKEMIA VIRUS;                  
*SOURCE   3 ORGANISM_COMMON: VIRUSES;                                            
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PGEX-6P-1;                                
*SOURCE   8 MOL_ID: 2;                                                           
*SOURCE   9 SYNTHETIC: YES                                                       
*KEYWDS    HYDROPHOBIC GUANOSINE BINDING POCKET                                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.DEY, D.YORK, A.SMALLS-MANTEY, M.F.SUMMERS                           
*REVDAT   1   05-APR-05 1WWF    0                                                

###############################################################
######## Begin NC-linker
###############################################################
#
# CONTAINS PSEUDOATOM CORRECTIONS!!!!!
#
# Upper limit restraints of MMLV Nucleocapsid Protein
# April 2003, MFS, VDS
#-----------------------------------------------------------
#Begin NC restraints
#-----------------------------------------------------------------
#		        ZN Ligands
#-----------------------------------------------------------------
 39 CYSZ ZN     26 CYS- CB      3.5  10.00E+00
 39 CYSZ ZN     29 CYS- CB      3.5  10.00E+00
#39 CYSZ ZN     39 CYSZ CB      3.5  1.00E+00 #Defined in lib
 39 CYSZ ZN     26 CYS- SG      2.30  10.00E+00
 39 CYSZ ZN     29 CYS- SG      2.30  10.00E+00
 39 CYSZ ZN     39 CYSZ SG      2.30  10.00E+00 
 39 CYSZ ZN     34 HIS  NE2     1.95  10.00E+00
#-----------------------------------------------------------------
#                       ZN Geometry
#-----------------------------------------------------------------
 39 CYSZ SG     26 CYS- SG      3.85  10.00E+00
 39 CYSZ SG     29 CYS- SG      3.85  10.00E+00
 26 CYS- SG     29 CYS- SG      3.85  10.00E+00

 39 CYSZ SG     34 HIS  NE2     3.85  10.00E+00
 26 CYS- SG     34 HIS  NE2     3.85  10.00E+00
 29 CYS- SG     34 HIS  NE2     3.85  10.00E+00
#-----------------------------------------------------------------
#      NC Protein Hydrogen Bonds
#-----------------------------------------------------------------
#N-Terminal Tail
 21 LEU  N      18 ARG  O       3.00  1.00E+00
 21 LEU  HN     18 ARG  O       2.00  1.00E+00
 25 GLN  N      22 ASP- O       3.00  1.00E+00
 25 GLN  HN     22 ASP- O       2.00  1.00E+00
 33 GLY  N      24 ASP- O       3.10  1.00E+00
 33 GLY  HN     24 ASP- O       2.10  1.00E+00

#Zinc Finger
 26 CYS- N      31 GLU- O       3.00  1.00E+00
 26 CYS- HN     31 GLU- O       2.00  1.00E+00
#30 LYS  N      26 CYS- O       3.00  1.00E+00
#30 LYS  HN     26 CYS- O       2.00  1.00E+00
 28 TYR  HN     26 CYS- SG      2.65  1.00E+00
 28 TYR  N      26 CYS- SG      3.65  1.00E+00
 31 GLU- HN     29 CYS- SG      2.55  1.00E+00
 31 GLU- N      29 CYS- SG      3.65  1.00E+00
 29 CYS- HN     26 CYS- SG      2.65  1.00E+00
 29 CYS- N      26 CYS- SG      3.65  1.00E+00
 38 ASP- N      35 TRP  O       3.00  1.00E+00
 38 ASP- HN     35 TRP  O       2.00  1.00E+00
 39 CYSZ N      36 ALA  O       3.00  1.00E+00
 39 CYSZ HN     36 ALA  O       2.00  1.00E+00
 41 LYS  HN     39 CYSZ SG      2.65  1.00E+00
 41 LYS  N      39 CYSZ SG      3.65  1.00E+00
 42 LYS  HN     39 CYSZ O       2.20  1.00E+00 # Longer due to Proline turn
 42 LYS  N      39 CYSZ O       3.20  1.00E+00 # Longer due to Proline turn

# Unusual H-bonds

 23 ARG  O     35 TRP HE1       2.00  1.00E+00
 23 ARG  O     35 TRP NE1       3.00  1.00E+00

#31 GLU- OE2   41 LYS NZ        3.40  1.00E+00

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

# ARG 18
 18 ARG  QD     21 LEU  QD1     4.6   1.00E+00
 18 ARG  QB     21 LEU  QD1     4.6   1.00E+00

# SER 19
 19 SER  QB     30 LYS  QE      6.3   1.00E+00

# GLN 20
 20 GLN  HA     21 LEU  HN      3.30  1.00E+00

# LEU 21
 21 LEU  HA     22 ASP- HN      2.70  1.00E+00
 21 LEU  HA     21 LEU  QD2     3.30  1.00E+00
 21 LEU  QD2    22 ASP- HN      3.80  1.00E+00  #LEU 21 QD2 upfield
 21 LEU  QD2    23 ARG  HA      5.50  1.00E+00
 21 LEU  QD2    25 GLN  QB      4.60  1.00E+00
#21 LEU  QD1    27 ALA  HA      3.80  1.00E+00  #SD via QB
#21 LEU  QD2    27 ALA  HA      5.50  1.00E+00  #SD via QB
 21 LEU  QD1    27 ALA  QB      4.30  1.00E+00
 21 LEU  QD2    27 ALA  QB      4.30  1.00E+00
 21 LEU  QD2    30 LYS  QE      6.30  1.00E+00

# ASP-22
 22 ASP- HA     23 ARG  HN      2.70  1.00E+00
 22 ASP- HN     25 GLN  QB      3.50  1.00E+00

# ARG 23
 23 ARG  HN     24 ASP- HN      2.70  1.00E+00
 23 ARG  HA     25 GLN  HN      5.00  1.00E+00
 23 ARG  HA     35 TRP  HE1     5.00  1.00E+00
 23 ARG  HA     35 TRP  HZ2     5.00  1.00E+00
 23 ARG  QG     35 TRP  HZ2     5.80  1.00E+00
 23 ARG  QD     35 TRP  HZ2     5.80  1.00E+00

# ASP-24
 24 ASP- HN     25 GLN  HN      2.70  1.00E+00
 24 ASP- HA     35 TRP  HE1     5.00  1.00E+00
 24 ASP- HA     35 TRP  HD1     5.00  1.00E+00
 24 ASP- QB     33 GLY  HN      5.50  1.00E+00

# GLN 25
 25 GLN  HA     26 CYS- HN      2.70  1.00E+00
 25 GLN  HA     32 LYS  HA      5.00  1.00E+00
 25 GLN  HA     33 GLY  HN      5.00  1.00E+00
 25 GLN  HN     35 TRP  HE1     5.00  1.00E+00

# CYS 26
 27 ALA  HN     26 CYS- HA      2.70  1.00E+00
 26 CYS- HA     26 CYS- HB2     2.70  1.00E+00
 26 CYS- HN     26 CYS- HB3     2.70  1.00E+00
 26 CYS- HA     28 TYR  HN      5.00  1.00E+00
 26 CYS- HA     35 TRP  HA      3.30  1.00E+00
 26 CYS- HN     32 LYS  HA      5.00  1.00E+00
 26 CYS- HB3    30 LYS  HN      5.00  1.00E+00
 26 CYS- HB3    31 GLU- HN      2.70  1.00E+00
 26 CYS- HB3    29 CYS- HN      3.30  1.00E+00
 26 CYS- HB2    34 HIS  HD2     3.30  1.00E+00
 26 CYS- HA     36 ALA  HN      5.00  1.00E+00

# ALA 27
 27 ALA  HN     28 TYR  HN      2.90  1.00E+00
 27 ALA  QB     28 TYR  HN      5.50  1.00E+00
 27 ALA  QB     36 ALA  QB      4.30  1.00E+00
 27 ALA  HN     36 ALA  QB      5.50  1.00E+00
 27 ALA  HA     30 LYS  HN      5.00  1.00E+00
 27 ALA  HA     30 LYS  QE      5.80  1.00E+00

# TYR 28
 28 TYR  HN     29 CYS- HN      2.90  1.00E+00
 28 TYR  HN     28 TYR  HB2     2.70  1.00E+00
 28 TYR  HN     36 ALA  HA      5.00  1.00E+00
 28 TYR  HN     36 ALA  QB      5.50  1.00E+00
 28 TYR  HB2    36 ALA  QB      5.50  1.00E+00
#28 TYR  HD1    36 ALA  QB      5.50  1.00E+00
 28 TYR  QD     41 LYS  QB      5.90  1.00E+00
 28 TYR  QE     41 LYS  QD      5.90  1.00E+00
 28 TYR  QE     41 LYS  QE      5.90  1.00E+00
 28 TYR  QE     42 LYS  HA      5.10  1.00E+00
 28 TYR  QE     43 PRO  HD2     5.10  1.00E+00
 28 TYR  QE     43 PRO  HD3     5.10  1.00E+00
 
 28 TYR  HD1    42 LYS  QG      5.80  1.00E+00
 28 TYR  HD1    42 LYS  QE      5.80  1.00E+00
 28 TYR  HE1    42 LYS  QG      5.80  1.00E+00  # SD via Ha
 28 TYR  HE1    42 LYS  QE      5.80  1.00E+00

# CYS 29
 29 CYS- HN     30 LYS  HN      2.90  1.00E+00
 29 CYS- HN     28 TYR  HB3     2.70  1.00E+00
 29 CYS- HN     29 CYS- HB3     3.30  1.00E+00
 29 CYS- HB2    31 GLU- HN      5.00  1.00E+00
 29 CYS- HA     29 CYS- HB2     2.70  1.00E+00
 29 CYS- HA     29 CYS- HB3     2.70  1.00E+00

 29 CYS- HB2    41 LYS  QD      4.10  1.00E+00
 29 CYS- HB3    41 LYS  QD      4.10  1.00E+00

 
# LYS 30
 30 LYS  HN     31 GLU- HN      2.90  1.00E+00

# GLU-31
 32 LYS  HN     31 GLU- HA      2.70  1.00E+00
 31 GLU- HN     31 GLU- HB2     2.70  1.00E+00
#31 GLU- HA     31 GLU- HG2     3.30  1.00E+00
#31 GLU- HA     31 GLU- HG3     3.30  1.00e+00
 31 GLU- HB2    34 HIS  HE1     2.70  1.00E+00
 31 GLU- HB3    34 HIS  HE1     2.70  1.00E+00

# LYS 32
 33 GLY  HN     32 LYS  HA      2.70  1.00E+00

# GLY 33
 33 GLY  HN     34 HIS  HN      2.90  1.00E+00

# HIS 34
 34 HIS  HA     35 TRP  HN      2.70  1.00E+00
 34 HIS  HA     34 HIS  HB2     2.70  1.00E+00
 34 HIS  HA     34 HIS  HB3     2.70  1.00E+00
 34 HIS  HD2    34 HIS  HB2     3.30  1.00E+00
 34 HIS  HB2    35 TRP  HN      2.70  1.00E+00
 34 HIS  HD2    36 ALA  HA      5.00  1.00e+00
 34 HIS  HD2    39 CYSZ HA      3.30  1.00E+00
 34 HIS  HD2    39 CYSZ HB2     3.30  1.00E+00
 34 HIS  HD2    39 CYSZ HN      5.00  1.00E+00
 34 HIS  HB2    39 CYSZ HA      5.00  1.00E+00
#34 HIS  HD2    38 ASP- HB2     5.00  1.00E+00 #SD via CYS39 HN
#34 HIS  HD2    38 ASP- HB3     5.00  1.00E+00 #SD via CYS39 HN
 34 HIS  HB2    38 ASP- HB3     3.30  1.00E+00
 34 HIS  HE1    40 PRO  HD2     3.30  1.00E+00
 34 HIS  HE1    40 PRO  HD3     3.30  1.00E+00
#34 HIS  HE1    41 LYS  QE      5.50  1.00E+00 # SD via GLU31

# TRP 35
 35 TRP  HN     35 TRP  HD1     3.30  1.00E+00
 35 TRP  HA     35 TRP  HD1     3.30  1.00E+00
 35 TRP  HB2    35 TRP  HD1     3.30  1.00E+00
 35 TRP  HA     36 ALA  HN      2.70  1.00E+00
 35 TRP  HN     38 ASP- HB2     5.00  1.00E+00
 35 TRP  HN     38 ASP- HB3     5.00  1.00E+00
 35 TRP  HE3    37 LYS  QE      5.80  1.00E+00
#35 TRP  HZ3    37 LYS  QE      5.80  1.00E+00  #SD via HE3
#35 TRP  HE3    37 LYS  QD      5.80  1.00E+00  #SD via QE
#35 TRP  HZ3    37 LYS  QD      5.80  1.00E+00  #SD via QE

# ALA 36
 36 ALA  HN     37 LYS  HN      3.30  1.00E+00
 36 ALA  HA     39 CYSZ HB2     2.70  1.00E+00
 36 ALA  HA     39 CYSZ HN      3.30  1.00E+00
 36 ALA  QB     37 LYS  HN      3.80  1.00E+00
#36 ALA  QB     37 LYS  QD      4.00  1.00E+00
#36 ALA  QB     37 LYS  QE      4.00  1.00E+00  #SD via QG,QD

# LYS 37
 37 LYS  HN     38 ASP- HN      2.90  1.00E+00
#37 LYS  HB2    38 ASP- HN      3.30  1.00E+00
 37 LYS  HB2    37 LYS  HN      3.30  1.00E+00
 37 LYS  HB3    37 LYS  HA      2.70  1.00E+00

 37 LYS  HA     42 LYS  QE      5.80  1.00E+00

# ASP-38
 38 ASP- HN     39 CYSZ HN      2.90  1.00E+00
 38 ASP- HN     38 ASP- HB2     2.70  1.00E+00

# CYSZ 39
 40 PRO  HD2    39 CYSZ HA      2.70  1.00E+00
 40 PRO  HD3    39 CYSZ HA      2.70  1.00E+00
 39 CYSZ HN     39 CYSZ HB2     2.70  1.00E+00
#39 CYSZ HN     39 CYSZ HB3     2.70  1.00E+00 #SD
 39 CYSZ HA     39 CYSZ HB2     2.70  1.00E+00
 39 CYSZ HA     40 PRO  HD2     2.70  1.00E+00
 39 CYSZ HA     40 PRO  HD3     2.70  1.00E+00
 39 CYSZ QB     42 LYS  QG      4.30  1.00E+00

# PRO 40
 40 PRO  HD2    41 LYS  HN      2.70  1.00E+00

# LYS 41
 41 LYS  HN     42 LYS  HN      2.90  1.00E+00

# LYS 42
 42 LYS  HA     43 PRO  HD2     2.70  1.00E+00
 42 LYS  HA     43 PRO  HD3     2.70  1.00E+00

# ARG 44
44 ARG  HA     45 GLY  HN      2.70  1.00E+00

# GLY 45
45 GLY  HA1    46 PRO HA       2.70  1.00E+00   # cis-Pro
45 GLY  HA2    46 PRO HA       2.70  1.00E+00   # cis-Pro

# ARG 47
47 ARG  HA     48 GLY HN       2.70  1.00E+00

#GLY 48
48 GLY  QA     49 PRO HD2      3.20  1.00E+00
48 GLY  QA     49 PRO HD3      3.20  1.00E+00

# PRO 49
49 PRO  HA     50 ARG HN       2.70  1.00E+00

# ARG 50
50 ARG  HA     51 PRO HD2      2.70  1.00E+00
50 ARG  HA     51 PRO HD3      2.70  1.00E+00
####################################################################
####### End NC
####################################################################

####################################################################
#### Begin RNA Restraints
####################################################################

#----------------------Begin C4'-O4' BOND----------------------------
#### C4' to O4'
505 RCYT C4'    505 RCYT O4'     1.46  10.00E+00
506 URA  C4'    506 URA  O4'     1.46  10.00E+00
507 RCYT C4'    507 RCYT O4'     1.46  10.00E+00
508 RCYT C4'    508 RCYT O4'     1.46  10.00E+00
509 RGUA C4'    509 RGUA O4'     1.46  10.00E+00
510 URA  C4'    510 URA  O4'     1.46  10.00E+00

### C5' to O4'
505 RCYT C5'    505 RCYT O4'    2.42  10.00E+00
506 URA  C5'    506 URA  O4'    2.42  10.00E+00
507 RCYT C5'    507 RCYT O4'    2.42  10.00E+00
508 RCYT C5'    508 RCYT O4'    2.42  10.00E+00
509 RGUA C5'    509 RGUA O4'    2.42  10.00E+00
510 URA  C5'    510 URA  O4'    2.42  10.00E+00

#----------------------END C4'-O4' BOND------------------------------

#--------------------- Begin AACAGU NOEs-----------------------------
#---------Intramolecular RNA NOEs--------------
# RCYT 504
 504 RCYT H6     504 RCYT H2'     4.00  1.00E+00
 504 RCYT H6     504 RCYT H3'     3.00  1.00E+00
 504 RCYT H3'    504 RCYT H5"     3.30  1.00E+00
 504 RCYT H4'    504 RCYT H5'     2.70  1.00E+00
 504 RCYT H4'    504 RCYT H5"     2.70  1.00E+00

 504 RCYT H6     505 RCYT  H6      5.0   1.00E+00
 504 RCYT H6     505 RCYT  H5      5.0   1.00E+00
 504 RCYT H2'    505 RCYT  H6      2.7   1.00E+00
 504 RCYT H3'    505 RCYT  H6      3.0   1.00E+00

# RCYT 505
 505 RCYT H6     505 RCYT H2'     4.00  1.00E+00
 505 RCYT H6     505 RCYT H3'     3.00  1.00E+00
 505 RCYT H3'    505 RCYT H5"     3.30  1.00E+00
 505 RCYT H4'    505 RCYT H5'     2.70  1.00E+00
 505 RCYT H4'    505 RCYT H5"     2.70  1.00E+00

 505 RCYT H6     506 URA  H6      5.0   1.00E+00
 505 RCYT H6     506 URA  H5      5.0   1.00E+00
 505 RCYT H2'    506 URA  H6      2.7   1.00E+00
 505 RCYT H3'    506 URA  H6      3.0   1.00E+00

# URA 506
 506 URA  H6     506 URA  H2'     4.00  1.00E+00
 506 URA  H6     506 URA  H3'     3.00  1.00E+00
 506 URA  H3'    506 URA  H5"     3.30  1.00E+00
 506 URA  H4'    506 URA  H5'     2.70  1.00E+00
 506 URA  H4'    506 URA  H5"     2.70  1.00E+00

# RCYT 507
 507 RCYT H6     507 RCYT H2'     4.00  1.00E+00
 507 RCYT H6     507 RCYT H3'     3.00  1.00E+00
 507 RCYT H3'    507 RCYT H5"     3.30  1.00E+00
 507 RCYT H4'    507 RCYT H5'     2.70  1.00E+00
 507 RCYT H4'    507 RCYT H5"     2.70  1.00E+00
#507 RCYT H4'    495 URA  H5      5.00  1.00E+00
#507 RCYT Q5'    495 URA  H5      5.80  1.00E+00

# RCYT 508
 508 RCYT H6     508 RCYT H2'     4.00  1.00E+00
 508 RCYT H6     508 RCYT H3'     3.00  1.00E+00
 508 RCYT H3'    508 RCYT H5"     3.30  1.00E+00
 508 RCYT H4'    508 RCYT H5'     2.70  1.00E+00
 508 RCYT H4'    508 RCYT H5"     2.70  1.00E+00

# RGUA 509
 509 RGUA H8     509 RGUA H2'     4.00  1.00E+00
 509 RGUA H8     509 RGUA H3'     3.00  1.00E+00
 509 RGUA H3'    509 RGUA H5"     3.30  1.00E+00
 509 RGUA H4'    509 RGUA H5'     2.70  1.00E+00
 509 RGUA H4'    509 RGUA H5"     2.70  1.00E+00

## URA 510
 510 URA  H6     510 URA  H2'     4.00  1.00E+00
 510 URA  H6     510 URA  H3'     3.00  1.00E+00
 510 URA  H3'    510 URA  H5"     3.30  1.00E+00
 510 URA  H4'    510 URA  H5'     2.70  1.00E+00
 510 URA  H4'    510 URA  H5"     2.70  1.00E+00

#####################################################################
## Begin Intermolecular Interactions
#####################################################################
##-------------------------------------------------------
# Intermolecular Hydrogen Bonds (H-bonds)
##-------------------------------------------------------
## RCYT 507
 507 RCYT O2    42 LYS  HZ1       2.00  1.00E+00
 507 RCYT O2    42 LYS  NZ        3.00  1.00E+00
 507 RCYT N3    42 LYS  HZ3       2.00  1.00E+00
 507 RCYT N3    42 LYS  NZ        3.00  1.00E+00
##507 RCYT OP2   28 TYR  HH        2.00  1.00E+00  #Possible

# RGUA 497 H-bonds
 509 RGUA O6    27 ALA  HN        2.00  1.00E+00
 509 RGUA O6    27 ALA  N         3.00  1.00E+00
 509 RGUA O6    36 ALA  HN        2.00  1.00E+00
 509 RGUA O6    36 ALA  N         3.00  1.00E+00

 509 RGUA H1    25 GLN  O         2.00  1.00E+00
 509 RGUA N1    25 GLN  O         3.00  1.00E+00
 509 RGUA H21   25 GLN  O         2.00  1.00E+00
 509 RGUA N2    25 GLN  O         3.00  1.00E+00

#509 RGUA H21   22 ASP- O         2.00  1.00E+00
 509 RGUA H22   22 ASP- O         2.00  1.00E+00
#509 RGUA N2    22 ASP- O         3.00  1.00E+00

 509 RGUA O2'   23 ARG  HH21      2.00  1.00E+00  #Likely
 509 RGUA O2'   23 ARG  NH2       3.00  1.00E+00  #Likely

#509 RGUA OP2   37 LYS  NZ        3.80  1.00E+00  #Questionable
#509 RGUA N7    37 LYS  HZ2       2.00  1.00E+00  #Likely
#509 RGUA N7    37 LYS  NZ        3.00  1.00E+00  #Likely

###---------------------------------------------------------
###  Intermolecular NOEs
###---------------------------------------------------------
# RADE 493

# URA 506

 506 URA  H6      28 TYR  QE      5.1   1.00E+00
 506 URA  H5      28 TYR  QE      5.1   1.00E+00
 506 URA  H5      29 CYS- HA      5.0   1.00E+00
 506 URA  H5      41 LYS  QE      5.8   1.00E+00
 506 URA  H1'     30 LYS  QE      5.8   1.00E+00 #Check
 506 URA  H2'     28 TYR  QD      5.1   1.00E+00 #Check
 506 URA  H2'     28 TYR  QE      6.8   1.00E+00 #Check
 506 URA  H2'     28 TYR  HA      3.3   1.00E+00 #Check
#506 URA  H1'     28 TYR  QD      5.1   1.00E+00 #SD via H2'
#506 URA  H1'     28 TYR  QE      6.8   1.00E+00 #SD via H2'
#506 URA  H1'     28 TYR  HA      5.0   1.00E+00 #SD via H2'
 
# RCYT 507
 507 RCYT H1'     27 ALA  QB      5.50  1.00E+00
 507 RCYT H4'     27 ALA  QB      3.80  1.00E+00
 507 RCYT H1'     36 ALA  QB      3.80  1.00E+00
 507 RCYT H1'     28 TYR  QB      5.50  1.00E+00
 507 RCYT H1'     28 TYR  HA      5.00  1.00E+00
 507 RCYT H1'     28 TYR  QD      5.10  1.00E+00
 507 RCYT H6      28 TYR  HD1     2.70  1.00E+00
 507 RCYT H5      28 TYR  HE1     2.70  1.00E+00
 507 RCYT H1'     42 LYS  QE      5.80  1.00E+00

# RCYT 508
 508 RCYT H6      27 ALA  QB      5.5   1.00E+00
 508 RCYT H6      21 LEU  QD1     5.5   1.00E+00
 508 RCYT H5      27 ALA  QB      3.8   1.00E+00
 508 RCYT H5      21 LEU  QD1     3.8   1.00E+00
 508 RCYT H5      18 ARG  HA      5.0   1.00E+00
 508 RCYT H5      18 ARG  QB      5.8   1.00E+00
 508 RCYT H5      18 ARG  QD      5.8   1.00E+00

## RGUA 509
 509 RGUA H8      35 TRP  HZ3     5.00  1.00E+00
#509 RGUA H8      35 TRP  HH2     5.00  1.00E+00  #SD via HZ3
#509 RGUA H8      35 TRP  HE3     5.00  1.00E+00  #SD via HZ3
 509 RGUA H8      27 ALA  QB      6.50  1.00E+00
 509 RGUA H8      36 ALA  QB      6.50  1.00E+00
 509 RGUA H8      21 LEU  QD1     6.50  1.00E+00
 509 RGUA H1'     21 LEU  QD1     4.80  1.00E+00
 509 RGUA H8      37 LYS  QE      5.80  1.00E+00
#509 RGUA H8      37 LYS  QD      5.80  1.00E+00  #SD via QE
#509 RGUA H8      35 TRP  HZ2     5.00  1.00E+00  #SD via H2
#509 RGUA H1'     35 TRP  HZ2     5.00  1.00E+00  #SD via HZ3
 509 RGUA H2'     35 TRP  HZ3     5.00  1.00E+00
 509 RGUA H1'     35 TRP  HH2     5.00  1.00E+00
 509 RGUA H2'     35 TRP  HH2     5.00  1.00E+00
 509 RGUA H1'     23 ARG  QD      4.10  1.00E+00
#509 RGUA Q2      35 TRP  HE1     4.10  1.00E+00
#509 RGUA Q2      21 LEU  QD2     3.80  1.00E+00
#509 RGUA Q2      21 LEU  QB      6.30  1.00E+00
#509 RGUA Q2      23 ARG  HA      5.80  1.00E+00
#509 RGUA Q2      25 GLN  HN      4.10  1.00E+00

## URA 510
 510 URA  H5      35 TRP  HZ3     5.0   1.00E+00
 510 URA  H5      35 TRP  HH2     5.0   1.00E+00
 510 URA  H5      35 TRP  HE3     5.0   1.00E+00

#######################################################################
######## End NC-AACAGU
#######################################################################

#################################################################
##### Begin NC-AACAGU Restraints
#################################################################

#---------------------------------------------------------------
# Begin NC Protein Restraints
#		        ZN Ligands
#-----------------------------------------------------------------
 39 CYSZ ZN     26 CYS- CB      3.10  10.00E+00
 39 CYSZ ZN     29 CYS- CB      3.10  10.00E+00
 39 CYSZ ZN     39 CYSZ CB      3.10  10.00E+00
 39 CYSZ ZN     26 CYS- SG      2.25  10.00E+00
 39 CYSZ ZN     29 CYS- SG      2.25  10.00E+00
 39 CYSZ ZN     39 CYSZ SG      2.25  10.00E+00 
 39 CYSZ ZN     34 HIS  NE2     1.90  10.00E+00
 39 CYSZ ZN     34 HIS  ND1     4.13  5.00E+00 
 39 CYSZ ZN     34 HIS  CG      4.13  5.00E+00 

#-----------------------------------------------------------------
#                       ZN Geometry
#-----------------------------------------------------------------
 39 CYSZ SG     26 CYS- SG      3.70  10.00E+00
 39 CYSZ SG     29 CYS- SG      3.70  10.00E+00
 26 CYS- SG     29 CYS- SG      3.70  10.00E+00

 39 CYSZ SG     34 HIS  NE2     3.50  10.00E+00
 26 CYS- SG     34 HIS  NE2     3.50  10.00E+00
 29 CYS- SG     34 HIS  NE2     3.50  10.00E+00

#-----------------------------------------------------------------
#			Hydrogen Bonds
#-----------------------------------------------------------------
#Tail
 21 LEU  N      18 ARG  O       2.70  1.00E+00
 21 LEU  HN     18 ARG  O       1.80  1.00E+00
 25 GLN  N      22 ASP- O       2.70  1.00E+00
 25 GLN  HN     22 ASP- O       1.80  1.00E+00
 33 GLY  N      24 ASP- O       2.70  1.00E+00
 33 GLY  HN     24 ASP- O       1.80  1.00E+00

 26 CYS- N      31 GLU- O       2.70  1.00E+00
 26 CYS- HN     31 GLU- O       1.80  1.00E+00
#30 LYS  N      26 CYS- O       2.70  1.00E+00
#30 LYS  HN     26 CYS- O       1.80  1.00E+00
 28 TYR  HN     26 CYS- SG      2.25  1.00E+00 
 28 TYR  N      26 CYS- SG      3.25  1.00E+00
 31 GLU- HN     29 CYS- SG      2.25  1.00E+00
 31 GLU- N      29 CYS- SG      3.25  1.00E+00
 29 CYS- HN     26 CYS- SG      2.25  1.00E+00
 29 CYS- N      26 CYS- SG      3.25  1.00E+00
 38 ASP- N      35 TRP  O       2.70  1.00E+00
 38 ASP- HN     35 TRP  O       1.80  1.00E+00
 39 CYSZ N      36 ALA  O       2.70  1.00E+00
 39 CYSZ HN     36 ALA  O       1.80  1.00E+00
 41 LYS  HN     39 CYSZ SG      2.25  1.00E+00
 41 LYS  N      39 CYSZ SG      3.25  1.00E+00
 42 LYS  HN     39 CYSZ O       1.80  1.00E+00
 42 LYS  N      39 CYSZ O       2.70  1.00E+00

#--------------------------------------------
# Unusual H-bonds

 23 ARG  O      35 TRP  HE1     1.90  1.00E+00
 23 ARG  O      35 TRP  NE1     2.90  1.00E+00

#----------- End NC Protein HBond Restraints

################# Begin RNA restraints ##############
#-----------------Begin C4'-O4' BOND-----------------
#### C4' to O4'
504 RCYT C4'    504 RCYT O4'     1.44  10.00E+00
505 RCYT C4'    505 RCYT O4'     1.44  10.00E+00
506 URA  C4'    506 URA  O4'     1.44  10.00E+00
507 RCYT C4'    507 RCYT O4'     1.44  10.00E+00
508 RCYT C4'    508 RCYT O4'     1.44  10.00E+00
509 RGUA C4'    509 RGUA O4'     1.44  10.00E+00
510 URA  C4'    510 URA  O4'     1.44  10.00E+00

### C5' to O4'
504 RCYT C5'    504 RCYT O4'     2.32  10.00E+00
505 RCYT C5'    505 RCYT O4'     2.32  10.00E+00
506 URA  C5'    506 URA  O4'     2.32  10.00E+00
507 RCYT C5'    507 RCYT O4'     2.32  10.00E+00
508 RCYT C5'    508 RCYT O4'     2.32  10.00E+00
509 RGUA C5'    509 RGUA O4'     2.32  10.00E+00
510 URA  C5'    510 URA  O4'     2.32  10.00E+00

#-----------------End C4'-O4' BOND--------------------
#-------------------------------------------------------
# Begin Intermolecular NC-Linker RNA H-bond Restraints
#-------------------------------------------------------

# RGUA 497 
 509 RGUA O6    27 ALA  HN        1.80  1.00E+00
 509 RGUA O6    27 ALA  N         2.70  1.00E+00
 509 RGUA O6    36 ALA  HN        1.80  1.00E+00
 509 RGUA O6    36 ALA  N         2.70  1.00E+00

 509 RGUA H1    25 GLN  O         1.80  1.00E+00
 509 RGUA N1    25 GLN  O         2.70  1.00E+00
 509 RGUA H21   25 GLN  O         1.80  1.00E+00
 509 RGUA N2    25 GLN  O         2.70  1.00E+00

 509 RGUA H21   22 ASP- O         1.80  1.00E+00
 509 RGUA H22   22 ASP- O         1.80  1.00E+00
 509 RGUA N2    22 ASP- O         2.00  1.00E+00

 509 RGUA O2'   23 ARG  HE        1.80  1.00E+00
 509 RGUA O2'   23 ARG  NE        2.70  1.00E+00

#509 RGUA OP2   37 LYS  HZ2       1.80  1.00E+00 #Questionable
#509 RGUA OP2   37 LYS  NZ        2.70  1.00E+00 #Questionable

 509 RGUA N7    37 LYS  HZ2       1.80  1.00E+00 #Questionable
 509 RGUA N7    37 LYS  NZ        2.70  1.00E+00 #Questionable


### URA 308
##308 URA  O4    30 LYS  HZ2       1.80  1.00E+00  #Questionable
##308 URA  O4    30 LYS  NZ        2.70  1.00E+00  #Questionable
#
# 308 URA  O2'   18 ARG  HE        1.80  1.00E+00
# 308 URA  O2'   18 ARG  NE        2.70  1.00E+00
#
## URA 307
# 307 RCYT O2    42 LYS  HZ1       1.80  1.00E+00
# 307 RCYT O2    42 LYS  NZ        2.70  1.00E+00
# 307 RCYT N3    42 LYS  HZ3       1.80  1.00E+00
# 307 RCYT N3    42 LYS  NZ        2.70  1.00E+00
#
## URA 306
##306 URA  O4    41 LYS  HZ1       1.80  1.00E+00  #Questionable
##306 URA  O4    41 LYS  NZ        2.70  1.00E+00  #Questionable
#
##306 URA  O2'   30 LYS  HZ3       1.80  1.00E+00  #Questionable
##306 URA  O2'   30 LYS  NZ        2.70  1.00E+00  #Questionable
#
##################################################################
#######  End NC-AACAGU Restraints
##################################################################

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    C 504          1H5*        C 504  29.669  -9.062  -3.148
    2   2H5*    C 504          2H5*        C 504  30.364  -7.612  -3.872
    3    H4*    C 504           H4*        C 504  31.977  -9.465  -3.657
    4    H3*    C 504           H3*        C 504  31.336  -8.375  -6.387
    5    H2*    C 504           H2*        C 504  32.888  -9.826  -7.363
    6   2HO*    C 504          2HO*        C 504  34.396  -9.214  -5.647
    7    H1*    C 504           H1*        C 504  32.130 -11.747  -5.188
    8   1H4     C 504          1H4         C 504  31.240 -15.522 -10.219
    9   2H4     C 504          2H4         C 504  30.511 -14.214 -11.124
   10    H5     C 504           H5         C 504  30.254 -12.020 -10.289
   11    H6     C 504           H6         C 504  30.637 -10.526  -8.360
   12   1H5*    C 505          1H5*        C 505  35.127  -7.455  -5.006
   13   2H5*    C 505          2H5*        C 505  36.252  -6.239  -5.611
   14    H4*    C 505           H4*        C 505  36.894  -8.337  -6.523
   15    H3*    C 505           H3*        C 505  35.606  -6.483  -8.507
   16    H2*    C 505           H2*        C 505  35.847  -8.056 -10.208
   17   2HO*    C 505          2HO*        C 505  37.671  -9.261  -8.331
   18    H1*    C 505           H1*        C 505  35.509 -10.237  -8.249
   19   1H4     C 505          1H4         C 505  30.733 -11.209 -12.357
   20   2H4     C 505          2H4         C 505  29.980  -9.716 -11.844
   21    H5     C 505           H5         C 505  30.954  -8.211 -10.307
   22    H6     C 505           H6         C 505  32.910  -7.764  -8.869
   23   1H5*    U 506          1H5*        U 506  39.385  -2.878  -9.854
   24   2H5*    U 506          2H5*        U 506  38.258  -2.675  -8.513
   25    H4*    U 506           H4*        U 506  37.263  -1.686 -10.422
   26    H3*    U 506           H3*        U 506  36.018  -4.354  -9.748
   27    H2*    U 506           H2*        U 506  34.343  -3.911 -11.361
   28   2HO*    U 506          2HO*        U 506  35.563  -1.344 -11.735
   29    H1*    U 506           H1*        U 506  36.293  -2.887 -13.205
   30    H3     U 506           H3         U 506  36.613  -6.614 -15.730
   31    H5     U 506           H5         U 506  34.661  -7.946 -12.272
   32    H6     U 506           H6         U 506  35.041  -5.719 -11.319
   33   1H5*    C 507          1H5*        C 507  34.652  -0.079 -10.117
   34   2H5*    C 507          2H5*        C 507  34.004   0.073  -8.484
   35    H4*    C 507           H4*        C 507  33.278   1.585 -10.657
   36    H3*    C 507           H3*        C 507  32.076   1.133  -7.961
   37    H2*    C 507           H2*        C 507  30.092   2.294  -8.564
   38   2HO*    C 507          2HO*        C 507  30.628   3.883  -9.946
   39    H1*    C 507           H1*        C 507  29.723   0.867 -10.921
   40   1H4     C 507          1H4         C 507  26.432  -2.403  -6.526
   41   2H4     C 507          2H4         C 507  27.891  -3.274  -6.112
   42    H5     C 507           H5         C 507  30.018  -2.780  -7.010
   43    H6     C 507           H6         C 507  31.282  -1.314  -8.543
   44   1H5*    C 508          1H5*        C 508  34.195   5.837  -5.527
   45   2H5*    C 508          2H5*        C 508  33.147   6.330  -6.857
   46    H4*    C 508           H4*        C 508  35.704   7.147  -6.537
   47    H3*    C 508           H3*        C 508  34.077   6.867  -9.069
   48    H2*    C 508           H2*        C 508  35.888   7.770 -10.268
   49   2HO*    C 508          2HO*        C 508  37.367   8.274  -7.915
   50    H1*    C 508           H1*        C 508  37.773   6.339  -8.577
   51   1H4     C 508          1H4         C 508  38.397   2.792 -13.817
   52   2H4     C 508          2H4         C 508  36.799   3.253 -14.359
   53    H5     C 508           H5         C 508  35.338   4.635 -13.121
   54    H6     C 508           H6         C 508  35.047   5.927 -11.037
   55   1H5*    G 509          1H5*        G 509  34.274   9.726 -11.656
   56   2H5*    G 509          2H5*        G 509  33.567  10.859 -10.505
   57    H4*    G 509           H4*        G 509  32.245  11.215 -12.338
   58    H3*    G 509           H3*        G 509  30.898   9.129 -10.647
   59    H2*    G 509           H2*        G 509  29.106   9.009 -12.182
   60   2HO*    G 509          2HO*        G 509  28.847  11.155 -12.671
   61    H1*    G 509           H1*        G 509  30.915   9.082 -14.418
   62    H8     G 509           H8         G 509  30.295   6.914 -11.311
   63    H1     G 509           H1         G 509  30.073   3.802 -16.982
   64   1H2     G 509          1H2         G 509  30.521   5.116 -18.506
   65   2H2     G 509          2H2         G 509  30.900   6.809 -18.282
   66   1H5*    U 510          1H5*        U 510  29.580   9.531  -7.472
   67   2H5*    U 510          2H5*        U 510  29.185   7.923  -8.078
   68    H4*    U 510           H4*        U 510  27.502   8.986  -6.525
   69    H3*    U 510           H3*        U 510  26.729   7.910  -9.232
   70    H2*    U 510           H2*        U 510  24.447   8.289  -8.692
   71   2HO*    U 510          2HO*        U 510  23.930   8.524  -6.521
   72    H1*    U 510           H1*        U 510  25.011  10.882  -7.671
   73    H3     U 510           H3         U 510  22.948  12.600 -11.230
   74    H5     U 510           H5         U 510  25.504   9.781 -12.979
   75    H6     U 510           H6         U 510  26.246   9.196 -10.716
   76   1H    ALA   1           HN       ALA   1   1.884   0.000   0.829
   77    HA   ALA   1           HA       ALA   1   2.234  -1.038  -1.536
   78   1HB   ALA   1          1HB       ALA   1   0.228   0.826  -1.989
   79   2HB   ALA   1          2HB       ALA   1   1.690   1.670  -2.551
   80   3HB   ALA   1          3HB       ALA   1   1.258   0.086  -3.238
   81    H    THR   2           HN       THR   2   4.070   0.107  -2.894
   82    HA   THR   2           HA       THR   2   5.835   1.358  -0.913
   83    HB   THR   2           HB       THR   2   7.617   0.550  -2.494
   84    HG1  THR   2           HG1      THR   2   5.927   0.757  -4.313
   85   1HG2  THR   2          1HG2      THR   2   6.112  -1.943  -2.516
   86   2HG2  THR   2          2HG2      THR   2   7.520  -1.512  -1.517
   87   3HG2  THR   2          3HG2      THR   2   5.876  -1.125  -0.954
   88    H    VAL   3           HN       VAL   3   6.065   3.495  -0.926
   89    HA   VAL   3           HA       VAL   3   5.999   4.810  -3.544
   90    HB   VAL   3           HB       VAL   3   4.539   5.622  -1.026
   91   1HG1  VAL   3          1HG1      VAL   3   4.124   7.327  -3.363
   92   2HG1  VAL   3          2HG1      VAL   3   4.479   7.765  -1.675
   93   3HG1  VAL   3          3HG1      VAL   3   5.808   7.360  -2.787
   94   1HG2  VAL   3          1HG2      VAL   3   2.893   5.752  -3.325
   95   2HG2  VAL   3          2HG2      VAL   3   3.770   4.206  -3.416
   96   3HG2  VAL   3          3HG2      VAL   3   2.801   4.596  -1.974
   97    H    VAL   4           HN       VAL   4   6.563   5.490  -0.011
   98    HA   VAL   4           HA       VAL   4   8.898   7.045  -0.800
   99    HB   VAL   4           HB       VAL   4   7.136   7.955   0.717
  100   1HG1  VAL   4          1HG1      VAL   4   6.460   6.124   2.040
  101   2HG1  VAL   4          2HG1      VAL   4   8.133   5.724   2.499
  102   3HG1  VAL   4          3HG1      VAL   4   7.355   7.184   3.156
  103   1HG2  VAL   4          1HG2      VAL   4   8.666   9.281   1.733
  104   2HG2  VAL   4          2HG2      VAL   4   9.559   7.906   2.425
  105   3HG2  VAL   4          3HG2      VAL   4   9.819   8.372   0.727
  106    H    SER   5           HN       SER   5  11.005   6.496  -0.235
  107    HA   SER   5           HA       SER   5  11.495   4.415   1.603
  108   1HB   SER   5          2HB       SER   5  11.511   3.818  -1.343
  109   2HB   SER   5          3HB       SER   5  12.802   3.127  -0.381
  110    HG   SER   5           HG       SER   5  10.041   2.881   0.418
  111    H    GLY   6           HN       GLY   6  13.498   4.835   2.500
  112   1HA   GLY   6          1HA       GLY   6  15.021   7.038   1.603
  113   2HA   GLY   6          2HA       GLY   6  15.456   5.887   2.851
  114    H    GLN   7           HN       GLN   7  17.564   6.692   1.430
  115    HA   GLN   7           HA       GLN   7  18.063   4.399  -0.284
  116   1HB   GLN   7          2HB       GLN   7  18.057   7.230  -1.072
  117   2HB   GLN   7          3HB       GLN   7  19.605   6.474  -1.396
  118   1HG   GLN   7          2HG       GLN   7  18.119   4.507  -2.397
  119   2HG   GLN   7          3HG       GLN   7  16.876   5.739  -2.485
  120   1HE2  GLN   7          1HE2      GLN   7  18.993   4.221  -4.294
  121   2HE2  GLN   7          2HE2      GLN   7  19.493   5.440  -5.419
  122    H    LYS   8           HN       LYS   8  19.972   3.359   0.202
  123    HA   LYS   8           HA       LYS   8  21.796   4.815   1.987
  124   1HB   LYS   8          2HB       LYS   8  20.680   2.057   2.073
  125   2HB   LYS   8          3HB       LYS   8  22.367   2.233   2.514
  126   1HG   LYS   8          2HG       LYS   8  21.204   2.547   4.564
  127   2HG   LYS   8          3HG       LYS   8  21.609   4.175   4.056
  128   1HD   LYS   8          2HD       LYS   8  19.373   4.605   3.268
  129   2HD   LYS   8          3HD       LYS   8  18.944   2.906   3.312
  130   1HE   LYS   8          2HE       LYS   8  19.861   3.927   5.937
  131   2HE   LYS   8          3HE       LYS   8  18.444   4.766   5.339
  132   1HZ   LYS   8          1HZ       LYS   8  18.525   2.285   6.483
  133   2HZ   LYS   8          2HZ       LYS   8  17.232   3.001   5.789
  134   3HZ   LYS   8          3HZ       LYS   8  18.185   2.007   4.911
  135    H    GLN   9           HN       GLN   9  23.437   5.571   0.737
  136    HA   GLN   9           HA       GLN   9  24.505   3.675  -1.207
  137   1HB   GLN   9          2HB       GLN   9  23.500   6.123  -1.800
  138   2HB   GLN   9          3HB       GLN   9  25.146   6.597  -1.430
  139   1HG   GLN   9          2HG       GLN   9  25.239   6.119  -3.745
  140   2HG   GLN   9          3HG       GLN   9  25.873   4.657  -3.017
  141   1HE2  GLN   9          1HE2      GLN   9  25.253   3.032  -4.228
  142   2HE2  GLN   9          2HE2      GLN   9  23.644   2.691  -4.773
  143    H    ASP  10           HN       ASP  10  26.271   2.682  -0.317
  144    HA   ASP  10           HA       ASP  10  27.901   4.252   1.480
  145   1HB   ASP  10          2HB       ASP  10  27.271   1.401   1.092
  146   2HB   ASP  10          3HB       ASP  10  28.998   1.659   1.244
  147    H    ARG  11           HN       ARG  11  29.397   5.477   0.276
  148    HA   ARG  11           HA       ARG  11  30.362   4.539  -2.193
  149   1HB   ARG  11          2HB       ARG  11  31.892   6.582  -1.999
  150   2HB   ARG  11          3HB       ARG  11  30.179   6.930  -1.877
  151   1HG   ARG  11          2HG       ARG  11  31.367   6.292   0.747
  152   2HG   ARG  11          3HG       ARG  11  32.158   7.657  -0.017
  153   1HD   ARG  11          2HD       ARG  11  29.980   8.800  -0.318
  154   2HD   ARG  11          3HD       ARG  11  29.130   7.410   0.329
  155    HE   ARG  11           HE       ARG  11  29.778   8.031   2.505
  156   1HH1  ARG  11          2HH2      ARG  11  31.603   9.891   0.141
  157   2HH1  ARG  11          1HH2      ARG  11  32.268  10.975   1.317
  158   1HH2  ARG  11          2HH1      ARG  11  30.654   9.460   4.058
  159   2HH2  ARG  11          1HH1      ARG  11  31.724  10.728   3.560
  160    H    GLN  12           HN       GLN  12  32.517   3.807  -2.723
  161    HA   GLN  12           HA       GLN  12  34.596   3.730  -0.925
  162   1HB   GLN  12          2HB       GLN  12  32.884   2.037   0.132
  163   2HB   GLN  12          3HB       GLN  12  33.388   0.958  -1.154
  164   1HG   GLN  12          2HG       GLN  12  35.048   0.356   0.303
  165   2HG   GLN  12          3HG       GLN  12  35.840   1.814  -0.261
  166   1HE2  GLN  12          1HE2      GLN  12  33.694   0.478   2.196
  167   2HE2  GLN  12          2HE2      GLN  12  34.046   1.611   3.458
  168    H    GLY  13           HN       GLY  13  36.512   2.762  -1.883
  169   1HA   GLY  13          1HA       GLY  13  37.480   1.375  -3.570
  170   2HA   GLY  13          2HA       GLY  13  36.109   1.705  -4.611
  171    H    GLY  14           HN       GLY  14  38.863   2.106  -5.373
  172   1HA   GLY  14          1HA       GLY  14  38.883   4.389  -6.759
  173   2HA   GLY  14          2HA       GLY  14  39.384   4.958  -5.179
  174    H    GLU  15           HN       GLU  15  40.126   2.465  -7.697
  175    HA   GLU  15           HA       GLU  15  42.895   3.033  -7.370
  176   1HB   GLU  15          2HB       GLU  15  41.962   1.071  -5.690
  177   2HB   GLU  15          3HB       GLU  15  42.384   0.108  -7.092
  178   1HG   GLU  15          2HG       GLU  15  44.592   0.281  -6.606
  179   2HG   GLU  15          3HG       GLU  15  44.502   2.031  -6.641
  180    H    ARG  16           HN       ARG  16  42.099   3.735  -9.602
  181    HA   ARG  16           HA       ARG  16  42.945   1.827 -11.447
  182   1HB   ARG  16          2HB       ARG  16  40.320   1.374 -10.819
  183   2HB   ARG  16          3HB       ARG  16  40.103   2.569 -12.083
  184   1HG   ARG  16          2HG       ARG  16  41.302   1.219 -13.700
  185   2HG   ARG  16          3HG       ARG  16  41.897   0.134 -12.459
  186   1HD   ARG  16          2HD       ARG  16  39.332  -0.314 -11.972
  187   2HD   ARG  16          3HD       ARG  16  39.080   0.366 -13.567
  188    HE   ARG  16           HE       ARG  16  41.158  -1.710 -13.478
  189   1HH1  ARG  16          2HH2      ARG  16  37.729  -1.048 -13.914
  190   2HH1  ARG  16          1HH2      ARG  16  37.426  -2.515 -14.783
  191   1HH2  ARG  16          2HH1      ARG  16  40.758  -3.646 -14.625
  192   2HH2  ARG  16          1HH1      ARG  16  39.160  -4.003 -15.191
  193    H    ARG  17           HN       ARG  17  42.490   2.758 -13.827
  194    HA   ARG  17           HA       ARG  17  42.847   5.624 -13.568
  195   1HB   ARG  17          2HB       ARG  17  44.465   3.821 -14.815
  196   2HB   ARG  17          3HB       ARG  17  43.409   4.200 -16.161
  197   1HG   ARG  17          2HG       ARG  17  44.144   6.669 -14.817
  198   2HG   ARG  17          3HG       ARG  17  45.599   5.752 -15.153
  199   1HD   ARG  17          2HD       ARG  17  44.732   5.459 -17.558
  200   2HD   ARG  17          3HD       ARG  17  43.467   6.606 -17.165
  201    HE   ARG  17           HE       ARG  17  46.288   7.214 -17.618
  202   1HH1  ARG  17          2HH2      ARG  17  43.348   8.313 -16.028
  203   2HH1  ARG  17          1HH2      ARG  17  43.843   9.972 -15.977
  204   1HH2  ARG  17          2HH1      ARG  17  46.942   9.403 -17.551
  205   2HH2  ARG  17          1HH1      ARG  17  45.901  10.596 -16.849
  206    H    ARG  18           HN       ARG  18  41.388   7.050 -14.537
  207    HA   ARG  18           HA       ARG  18  39.053   5.844 -15.648
  208   1HB   ARG  18          2HB       ARG  18  39.787   8.769 -15.127
  209   2HB   ARG  18          3HB       ARG  18  38.211   8.241 -15.683
  210   1HG   ARG  18          2HG       ARG  18  37.647   7.270 -13.636
  211   2HG   ARG  18          3HG       ARG  18  39.309   6.891 -13.229
  212   1HD   ARG  18          2HD       ARG  18  38.422   9.790 -13.392
  213   2HD   ARG  18          3HD       ARG  18  38.073   8.852 -11.954
  214    HE   ARG  18           HE       ARG  18  40.736   8.337 -12.285
  215   1HH1  ARG  18          2HH2      ARG  18  38.921  11.352 -12.336
  216   2HH1  ARG  18          1HH2      ARG  18  40.245  12.307 -11.756
  217   1HH2  ARG  18          2HH1      ARG  18  42.482   9.597 -11.520
  218   2HH2  ARG  18          1HH1      ARG  18  42.284  11.302 -11.289
  219    H    SER  19           HN       SER  19  41.105   5.241 -17.369
  220    HA   SER  19           HA       SER  19  41.981   6.943 -19.202
  221   1HB   SER  19          2HB       SER  19  42.067   4.284 -18.992
  222   2HB   SER  19          3HB       SER  19  40.796   4.349 -20.196
  223    HG   SER  19           HG       SER  19  42.264   5.699 -21.514
  224    H    GLN  20           HN       GLN  20  40.687   8.690 -19.853
  225    HA   GLN  20           HA       GLN  20  38.915   9.759 -20.616
  226   1HB   GLN  20          2HB       GLN  20  40.232   8.326 -22.625
  227   2HB   GLN  20          3HB       GLN  20  38.542   8.000 -22.954
  228   1HG   GLN  20          2HG       GLN  20  39.095  10.841 -22.288
  229   2HG   GLN  20          3HG       GLN  20  39.914  10.289 -23.735
  230   1HE2  GLN  20          1HE2      GLN  20  38.481   8.834 -25.166
  231   2HE2  GLN  20          2HE2      GLN  20  36.892   9.428 -25.515
  232    H    LEU  21           HN       LEU  21  37.867   8.301 -18.629
  233    HA   LEU  21           HA       LEU  21  36.102   6.299 -19.108
  234   1HB   LEU  21          2HB       LEU  21  36.756   7.978 -17.011
  235   2HB   LEU  21          3HB       LEU  21  35.057   8.316 -17.272
  236    HG   LEU  21           HG       LEU  21  36.321   5.644 -16.627
  237   1HD1  LEU  21          1HD1      LEU  21  34.102   6.512 -14.969
  238   2HD1  LEU  21          2HD1      LEU  21  35.751   6.023 -14.513
  239   3HD1  LEU  21          3HD1      LEU  21  35.421   7.707 -14.983
  240   1HD2  LEU  21          1HD2      LEU  21  33.899   6.171 -18.102
  241   2HD2  LEU  21          2HD2      LEU  21  34.663   4.618 -17.685
  242   3HD2  LEU  21          3HD2      LEU  21  33.523   5.383 -16.551
  243    H    ASP  22           HN       ASP  22  34.811   6.200 -20.895
  244    HA   ASP  22           HA       ASP  22  33.692   8.414 -22.093
  245   1HB   ASP  22          2HB       ASP  22  33.817   5.644 -22.556
  246   2HB   ASP  22          3HB       ASP  22  32.100   5.939 -22.367
  247    H    ARG  23           HN       ARG  23  31.700   9.499 -21.752
  248    HA   ARG  23           HA       ARG  23  30.477   9.163 -19.286
  249   1HB   ARG  23          2HB       ARG  23  30.565  11.225 -20.944
  250   2HB   ARG  23          3HB       ARG  23  29.121  10.523 -21.645
  251   1HG   ARG  23          2HG       ARG  23  28.626  12.233 -19.863
  252   2HG   ARG  23          3HG       ARG  23  27.923  10.664 -19.526
  253   1HD   ARG  23          2HD       ARG  23  29.334  10.253 -17.728
  254   2HD   ARG  23          3HD       ARG  23  30.686  11.103 -18.449
  255    HE   ARG  23           HE       ARG  23  28.760  13.083 -17.913
  256   1HH1  ARG  23          2HH2      ARG  23  30.603  10.734 -16.050
  257   2HH1  ARG  23          1HH2      ARG  23  30.619  11.697 -14.611
  258   1HH2  ARG  23          2HH1      ARG  23  28.782  14.354 -16.014
  259   2HH2  ARG  23          1HH1      ARG  23  29.576  13.771 -14.590
  260    H    ASP  24           HN       ASP  24  30.252   7.298 -22.114
  261    HA   ASP  24           HA       ASP  24  27.610   6.371 -21.302
  262   1HB   ASP  24          2HB       ASP  24  28.769   6.213 -24.119
  263   2HB   ASP  24          3HB       ASP  24  27.133   5.812 -23.636
  264    H    GLN  25           HN       GLN  25  30.341   5.543 -20.401
  265    HA   GLN  25           HA       GLN  25  30.456   2.901 -21.632
  266   1HB   GLN  25          2HB       GLN  25  32.538   4.824 -20.773
  267   2HB   GLN  25          3HB       GLN  25  32.828   3.190 -20.211
  268   1HG   GLN  25          2HG       GLN  25  32.367   2.419 -22.638
  269   2HG   GLN  25          3HG       GLN  25  32.438   4.110 -23.090
  270   1HE2  GLN  25          1HE2      GLN  25  34.216   3.360 -24.424
  271   2HE2  GLN  25          2HE2      GLN  25  35.815   3.263 -23.766
  272    H    CYS  26           HN       CYS  26  31.665   1.317 -19.856
  273    HA   CYS  26           HA       CYS  26  29.993   1.590 -17.468
  274   1HB   CYS  26          2HB       CYS  26  29.413  -0.372 -18.784
  275   2HB   CYS  26          3HB       CYS  26  31.083  -0.903 -18.812
  276    H    ALA  27           HN       ALA  27  31.047   1.793 -15.498
  277    HA   ALA  27           HA       ALA  27  33.965   1.696 -15.595
  278   1HB   ALA  27          1HB       ALA  27  32.830   3.771 -14.825
  279   2HB   ALA  27          2HB       ALA  27  32.065   2.846 -13.512
  280   3HB   ALA  27          3HB       ALA  27  33.833   3.040 -13.550
  281    H    TYR  28           HN       TYR  28  32.405  -0.781 -15.657
  282    HA   TYR  28           HA       TYR  28  33.266  -1.861 -13.062
  283   1HB   TYR  28          2HB       TYR  28  30.683  -1.507 -13.628
  284   2HB   TYR  28          3HB       TYR  28  30.904  -2.814 -14.775
  285    HD1  TYR  28           HD1      TYR  28  31.019  -1.942 -11.168
  286    HD2  TYR  28           HD2      TYR  28  30.989  -5.095 -14.060
  287    HE1  TYR  28           HE1      TYR  28  30.616  -3.642  -9.321
  288    HE2  TYR  28           HE2      TYR  28  30.585  -6.784 -12.203
  289    HH   TYR  28           HH       TYR  28  31.226  -6.374  -9.225
  290    H    CYS  29           HN       CYS  29  32.064  -2.927 -16.330
  291    HA   CYS  29           HA       CYS  29  34.103  -5.004 -16.247
  292   1HB   CYS  29          2HB       CYS  29  32.854  -6.066 -18.059
  293   2HB   CYS  29          3HB       CYS  29  31.810  -5.747 -16.687
  294    H    LYS  30           HN       LYS  30  33.298  -1.888 -17.586
  295    HA   LYS  30           HA       LYS  30  34.658  -0.534 -18.758
  296   1HB   LYS  30          2HB       LYS  30  36.300  -2.835 -19.798
  297   2HB   LYS  30          3HB       LYS  30  36.758  -1.156 -19.594
  298   1HG   LYS  30          2HG       LYS  30  35.961  -2.046 -17.007
  299   2HG   LYS  30          3HG       LYS  30  36.922  -3.351 -17.674
  300   1HD   LYS  30          2HD       LYS  30  38.470  -1.875 -16.565
  301   2HD   LYS  30          3HD       LYS  30  38.703  -1.626 -18.284
  302   1HE   LYS  30          2HE       LYS  30  38.532   0.593 -17.640
  303   2HE   LYS  30          3HE       LYS  30  36.830   0.274 -17.908
  304   1HZ   LYS  30          1HZ       LYS  30  36.924   1.182 -15.811
  305   2HZ   LYS  30          2HZ       LYS  30  36.834  -0.415 -15.482
  306   3HZ   LYS  30          3HZ       LYS  30  38.265   0.363 -15.367
  307    H    GLU  31           HN       GLU  31  32.228  -2.221 -19.509
  308    HA   GLU  31           HA       GLU  31  32.588  -2.506 -22.340
  309   1HB   GLU  31          2HB       GLU  31  31.266  -4.184 -21.121
  310   2HB   GLU  31          3HB       GLU  31  30.172  -2.948 -20.533
  311   1HG   GLU  31          2HG       GLU  31  28.946  -3.665 -22.366
  312   2HG   GLU  31          3HG       GLU  31  29.894  -2.417 -23.150
  313    H    LYS  32           HN       LYS  32  31.655  -1.187 -23.950
  314    HA   LYS  32           HA       LYS  32  30.695   1.383 -22.941
  315   1HB   LYS  32          2HB       LYS  32  31.356   2.290 -25.074
  316   2HB   LYS  32          3HB       LYS  32  32.691   1.379 -24.398
  317   1HG   LYS  32          2HG       LYS  32  32.774   0.214 -26.343
  318   2HG   LYS  32          3HG       LYS  32  31.261  -0.542 -25.882
  319   1HD   LYS  32          2HD       LYS  32  30.043   0.683 -27.387
  320   2HD   LYS  32          3HD       LYS  32  30.893   2.170 -27.015
  321   1HE   LYS  32          2HE       LYS  32  31.989   1.953 -28.991
  322   2HE   LYS  32          3HE       LYS  32  32.836   0.580 -28.308
  323   1HZ   LYS  32          1HZ       LYS  32  31.742  -0.709 -29.691
  324   2HZ   LYS  32          2HZ       LYS  32  30.299  -0.246 -29.082
  325   3HZ   LYS  32          3HZ       LYS  32  30.958   0.572 -30.332
  326    H    GLY  33           HN       GLY  33  28.586   1.945 -23.107
  327   1HA   GLY  33          1HA       GLY  33  26.746   1.936 -24.844
  328   2HA   GLY  33          2HA       GLY  33  26.870   0.190 -24.751
  329    H    HIS  34           HN       HIS  34  27.380  -0.111 -21.927
  330    HA   HIS  34           HA       HIS  34  24.833   0.884 -20.871
  331   1HB   HIS  34          2HB       HIS  34  24.542  -1.147 -19.680
  332   2HB   HIS  34          3HB       HIS  34  24.911  -1.570 -21.341
  333    HD1  HIS  34           HD1      HIS  34  26.751  -3.243 -21.676
  334    HD2  HIS  34           HD2      HIS  34  26.947  -1.392 -17.917
  335    HE1  HIS  34           HE1      HIS  34  28.617  -4.421 -20.396
  336    H    TRP  35           HN       TRP  35  24.797   1.275 -18.499
  337    HA   TRP  35           HA       TRP  35  27.351   2.409 -17.688
  338   1HB   TRP  35          2HB       TRP  35  24.498   2.899 -17.081
  339   2HB   TRP  35          3HB       TRP  35  25.606   3.105 -15.739
  340    HD1  TRP  35           HD1      TRP  35  26.048   4.181 -19.482
  341    HE1  TRP  35           HE1      TRP  35  26.676   6.739 -19.634
  342    HE3  TRP  35           HE3      TRP  35  25.793   5.078 -14.484
  343    HZ2  TRP  35           HZ2      TRP  35  26.988   8.805 -17.690
  344    HZ3  TRP  35           HZ3      TRP  35  26.274   7.393 -13.694
  345    HH2  TRP  35           HH2      TRP  35  26.855   9.223 -15.206
  346    H    ALA  36           HN       ALA  36  28.079   2.026 -15.392
  347    HA   ALA  36           HA       ALA  36  28.294  -0.699 -14.871
  348   1HB   ALA  36          1HB       ALA  36  29.950   0.923 -14.135
  349   2HB   ALA  36          2HB       ALA  36  28.746   1.748 -13.116
  350   3HB   ALA  36          3HB       ALA  36  29.279   0.100 -12.706
  351    H    LYS  37           HN       LYS  37  25.981   1.796 -13.767
  352    HA   LYS  37           HA       LYS  37  24.875   0.235 -11.693
  353   1HB   LYS  37          2HB       LYS  37  24.154   2.751 -13.143
  354   2HB   LYS  37          3HB       LYS  37  22.905   1.951 -12.210
  355   1HG   LYS  37          2HG       LYS  37  23.877   3.365 -10.602
  356   2HG   LYS  37          3HG       LYS  37  24.702   1.850 -10.294
  357   1HD   LYS  37          2HD       LYS  37  26.726   2.696 -10.920
  358   2HD   LYS  37          3HD       LYS  37  26.070   3.420 -12.375
  359   1HE   LYS  37          2HE       LYS  37  25.496   5.437 -11.282
  360   2HE   LYS  37          3HE       LYS  37  25.427   4.685  -9.701
  361   1HZ   LYS  37          1HZ       LYS  37  27.667   5.765 -11.078
  362   2HZ   LYS  37          2HZ       LYS  37  27.460   5.496  -9.480
  363   3HZ   LYS  37          3HZ       LYS  37  27.971   4.287 -10.452
  364    H    ASP  38           HN       ASP  38  24.896  -0.180 -15.061
  365    HA   ASP  38           HA       ASP  38  22.528  -1.855 -14.812
  366   1HB   ASP  38          2HB       ASP  38  22.607   0.420 -16.360
  367   2HB   ASP  38          3HB       ASP  38  23.191  -0.760 -17.516
  368    H    CYS  39           HN       CYS  39  25.563  -2.242 -14.591
  369    HA   CYS  39           HA       CYS  39  26.533  -3.389 -16.939
  370   1HB   CYS  39          2HB       CYS  39  27.952  -2.636 -15.047
  371   2HB   CYS  39          3HB       CYS  39  27.357  -3.967 -14.074
  372    HA   PRO  40           HA       PRO  40  24.165  -7.080 -16.730
  373   1HB   PRO  40          2HB       PRO  40  25.115  -8.266 -19.002
  374   2HB   PRO  40          3HB       PRO  40  23.818  -7.088 -19.006
  375   1HG   PRO  40          2HG       PRO  40  26.639  -6.742 -19.819
  376   2HG   PRO  40          3HG       PRO  40  25.255  -5.738 -20.204
  377   1HD   PRO  40          2HD       PRO  40  27.297  -5.176 -18.270
  378   2HD   PRO  40          3HD       PRO  40  25.853  -4.231 -18.574
  379    H    LYS  41           HN       LYS  41  27.301  -6.682 -16.009
  380    HA   LYS  41           HA       LYS  41  27.803  -9.544 -15.767
  381   1HB   LYS  41          2HB       LYS  41  29.483  -7.913 -16.776
  382   2HB   LYS  41          3HB       LYS  41  29.703  -7.269 -15.162
  383   1HG   LYS  41          2HG       LYS  41  30.102  -9.764 -14.446
  384   2HG   LYS  41          3HG       LYS  41  30.305 -10.077 -16.158
  385   1HD   LYS  41          2HD       LYS  41  32.228  -8.686 -16.322
  386   2HD   LYS  41          3HD       LYS  41  31.841  -7.809 -14.855
  387   1HE   LYS  41          2HE       LYS  41  33.526  -9.212 -14.056
  388   2HE   LYS  41          3HE       LYS  41  32.119 -10.192 -13.695
  389   1HZ   LYS  41          1HZ       LYS  41  33.358 -11.664 -14.839
  390   2HZ   LYS  41          2HZ       LYS  41  32.573 -11.015 -16.116
  391   3HZ   LYS  41          3HZ       LYS  41  34.100 -10.547 -15.772
  392    H    LYS  42           HN       LYS  42  26.633  -6.810 -13.990
  393    HA   LYS  42           HA       LYS  42  27.566  -7.417 -11.442
  394   1HB   LYS  42          2HB       LYS  42  25.327  -5.835 -12.609
  395   2HB   LYS  42          3HB       LYS  42  25.194  -6.262 -10.915
  396   1HG   LYS  42          2HG       LYS  42  27.576  -5.367 -10.599
  397   2HG   LYS  42          3HG       LYS  42  27.499  -4.768 -12.245
  398   1HD   LYS  42          2HD       LYS  42  25.373  -3.500 -11.590
  399   2HD   LYS  42          3HD       LYS  42  25.676  -3.972  -9.929
  400   1HE   LYS  42          2HE       LYS  42  27.850  -2.808  -9.941
  401   2HE   LYS  42          3HE       LYS  42  27.690  -2.447 -11.648
  402   1HZ   LYS  42          1HZ       LYS  42  26.885  -0.559 -10.750
  403   2HZ   LYS  42          2HZ       LYS  42  25.477  -1.385 -10.809
  404   3HZ   LYS  42          3HZ       LYS  42  26.298  -1.270  -9.402
  405    HA   PRO  43           HA       PRO  43  25.330 -10.950 -10.371
  406   1HB   PRO  43          2HB       PRO  43  25.288 -10.766  -7.644
  407   2HB   PRO  43          3HB       PRO  43  26.678 -11.340  -8.544
  408   1HG   PRO  43          2HG       PRO  43  26.279  -8.729  -7.217
  409   2HG   PRO  43          3HG       PRO  43  27.774  -9.477  -7.741
  410   1HD   PRO  43          2HD       PRO  43  26.371  -7.346  -9.051
  411   2HD   PRO  43          3HD       PRO  43  27.802  -8.172  -9.634
  412    H    ARG  44           HN       ARG  44  23.346 -11.900  -9.584
  413    HA   ARG  44           HA       ARG  44  21.264 -10.119 -10.084
  414   1HB   ARG  44          2HB       ARG  44  21.455 -12.972  -9.067
  415   2HB   ARG  44          3HB       ARG  44  19.901 -12.163  -9.041
  416   1HG   ARG  44          2HG       ARG  44  20.791 -11.550 -11.595
  417   2HG   ARG  44          3HG       ARG  44  21.485 -13.142 -11.362
  418   1HD   ARG  44          2HD       ARG  44  19.011 -13.690 -10.431
  419   2HD   ARG  44          3HD       ARG  44  18.581 -12.329 -11.449
  420    HE   ARG  44           HE       ARG  44  20.163 -13.835 -13.126
  421   1HH1  ARG  44          2HH2      ARG  44  17.378 -14.617 -11.123
  422   2HH1  ARG  44          1HH2      ARG  44  16.828 -15.890 -12.160
  423   1HH2  ARG  44          2HH1      ARG  44  19.439 -15.515 -14.495
  424   2HH2  ARG  44          1HH1      ARG  44  18.009 -16.405 -14.092
  425    H    GLY  45           HN       GLY  45  19.308  -9.930  -8.453
  426   1HA   GLY  45          1HA       GLY  45  20.105  -9.892  -5.653
  427   2HA   GLY  45          2HA       GLY  45  19.802  -8.330  -6.388
  428    HA   PRO  46           HA       PRO  46  19.094  -8.024  -4.451
  429   1HB   PRO  46          2HB       PRO  46  17.836  -8.159  -2.028
  430   2HB   PRO  46          3HB       PRO  46  17.515  -6.902  -3.206
  431   1HG   PRO  46          2HG       PRO  46  15.858  -9.246  -2.498
  432   2HG   PRO  46          3HG       PRO  46  15.385  -7.780  -3.334
  433   1HD   PRO  46          2HD       PRO  46  15.868 -10.349  -4.514
  434   2HD   PRO  46          3HD       PRO  46  15.510  -8.857  -5.361
  435    H    ARG  47           HN       ARG  47  20.966  -8.558  -3.445
  436    HA   ARG  47           HA       ARG  47  20.997 -10.721  -1.686
  437   1HB   ARG  47          2HB       ARG  47  21.042 -11.558  -4.349
  438   2HB   ARG  47          3HB       ARG  47  22.750 -11.483  -3.965
  439   1HG   ARG  47          2HG       ARG  47  22.258 -12.859  -1.869
  440   2HG   ARG  47          3HG       ARG  47  20.614 -13.050  -2.447
  441   1HD   ARG  47          2HD       ARG  47  22.642 -13.699  -4.510
  442   2HD   ARG  47          3HD       ARG  47  22.765 -14.716  -3.088
  443    HE   ARG  47           HE       ARG  47  20.016 -14.593  -3.721
  444   1HH1  ARG  47          2HH2      ARG  47  22.975 -15.737  -5.243
  445   2HH1  ARG  47          1HH2      ARG  47  22.177 -16.971  -6.161
  446   1HH2  ARG  47          2HH1      ARG  47  18.963 -16.220  -4.931
  447   2HH2  ARG  47          1HH1      ARG  47  19.880 -17.248  -5.982
  448    H    GLY  48           HN       GLY  48  22.124  -9.114  -0.428
  449   1HA   GLY  48          1HA       GLY  48  24.784  -8.353  -1.473
  450   2HA   GLY  48          2HA       GLY  48  23.825  -7.402  -0.356
  451    HA   PRO  49           HA       PRO  49  26.548 -10.477   1.872
  452   1HB   PRO  49          2HB       PRO  49  28.876  -9.096   2.249
  453   2HB   PRO  49          3HB       PRO  49  28.663 -10.288   0.982
  454   1HG   PRO  49          2HG       PRO  49  28.718  -7.340   0.764
  455   2HG   PRO  49          3HG       PRO  49  28.933  -8.539  -0.497
  456   1HD   PRO  49          2HD       PRO  49  26.583  -6.970  -0.003
  457   2HD   PRO  49          3HD       PRO  49  26.759  -8.249  -1.188
  458    H    ARG  50           HN       ARG  50  26.953 -10.591   4.132
  459    HA   ARG  50           HA       ARG  50  25.974  -8.147   5.376
  460   1HB   ARG  50          2HB       ARG  50  25.156 -10.940   5.644
  461   2HB   ARG  50          3HB       ARG  50  25.692 -10.335   7.198
  462   1HG   ARG  50          2HG       ARG  50  23.841  -9.034   7.436
  463   2HG   ARG  50          3HG       ARG  50  24.039  -8.336   5.841
  464   1HD   ARG  50          2HD       ARG  50  23.158 -11.131   5.652
  465   2HD   ARG  50          3HD       ARG  50  22.057 -10.197   6.645
  466    HE   ARG  50           HE       ARG  50  22.556  -9.841   3.768
  467   1HH1  ARG  50          2HH2      ARG  50  21.260  -8.389   6.699
  468   2HH1  ARG  50          1HH2      ARG  50  20.242  -7.274   5.850
  469   1HH2  ARG  50          2HH1      ARG  50  21.213  -8.371   2.647
  470   2HH2  ARG  50          1HH1      ARG  50  20.215  -7.264   3.529
  471    HA   PRO  51           HA       PRO  51  29.717  -8.152   7.619
  472   1HB   PRO  51          2HB       PRO  51  29.064  -6.564   9.746
  473   2HB   PRO  51          3HB       PRO  51  29.483  -5.928   8.168
  474   1HG   PRO  51          2HG       PRO  51  26.821  -6.131   9.438
  475   2HG   PRO  51          3HG       PRO  51  27.318  -5.137   8.082
  476   1HD   PRO  51          2HD       PRO  51  25.799  -7.567   7.963
  477   2HD   PRO  51          3HD       PRO  51  26.394  -6.636   6.604
  478    H    GLN  52           HN       GLN  52  26.874  -8.761   9.602
  479    HA   GLN  52           HA       GLN  52  26.607 -10.013  11.372
  480   1HB   GLN  52          2HB       GLN  52  26.769 -11.704   9.513
  481   2HB   GLN  52          3HB       GLN  52  28.465 -11.927   9.892
  482   1HG   GLN  52          2HG       GLN  52  27.776 -12.548  12.270
  483   2HG   GLN  52          3HG       GLN  52  26.104 -12.490  11.745
  484   1HE2  GLN  52          1HE2      GLN  52  25.295 -14.394  11.374
  485   2HE2  GLN  52          2HE2      GLN  52  26.088 -15.761  10.665
  486    H    THR  53           HN       THR  53  27.548  -8.887  13.100
  487    HA   THR  53           HA       THR  53  30.404  -9.203  13.554
  488    HB   THR  53           HB       THR  53  29.248  -6.977  13.766
  489    HG1  THR  53           HG1      THR  53  30.091  -6.744  16.064
  490   1HG2  THR  53          1HG2      THR  53  27.064  -7.504  14.671
  491   2HG2  THR  53          2HG2      THR  53  27.772  -8.482  15.979
  492   3HG2  THR  53          3HG2      THR  53  27.954  -6.711  15.993
  493    H    SER  54           HN       SER  54  31.342 -10.122  15.416
  494    HA   SER  54           HA       SER  54  29.710 -11.345  17.352
  495   1HB   SER  54          2HB       SER  54  29.876 -12.870  15.073
  496   2HB   SER  54          3HB       SER  54  31.274 -13.462  15.948
  497    HG   SER  54           HG       SER  54  28.563 -13.864  16.450
  498    H    LEU  55           HN       LEU  55  31.078 -10.294  18.850
  499    HA   LEU  55           HA       LEU  55  32.842  -9.996  20.140
  500   1HB   LEU  55          2HB       LEU  55  32.669 -12.482  20.272
  501   2HB   LEU  55          3HB       LEU  55  33.878 -12.597  19.009
  502    HG   LEU  55           HG       LEU  55  35.271 -11.072  20.699
  503   1HD1  LEU  55          1HD1      LEU  55  33.302 -10.977  22.281
  504   2HD1  LEU  55          2HD1      LEU  55  33.599 -12.699  22.622
  505   3HD1  LEU  55          3HD1      LEU  55  34.851 -11.489  22.993
  506   1HD2  LEU  55          1HD2      LEU  55  36.570 -12.896  21.010
  507   2HD2  LEU  55          2HD2      LEU  55  35.210 -13.921  21.528
  508   3HD2  LEU  55          3HD2      LEU  55  35.472 -13.598  19.798
  509    H    LEU  56           HN       LEU  56  35.042  -9.159  20.143
  510    HA   LEU  56           HA       LEU  56  36.700  -8.006  19.253
  511   1HB   LEU  56          2HB       LEU  56  36.766 -10.497  18.033
  512   2HB   LEU  56          3HB       LEU  56  36.904  -9.378  16.692
  513    HG   LEU  56           HG       LEU  56  38.712  -8.296  18.419
  514   1HD1  LEU  56          1HD1      LEU  56  38.190 -10.383  19.896
  515   2HD1  LEU  56          2HD1      LEU  56  39.250 -11.231  18.744
  516   3HD1  LEU  56          3HD1      LEU  56  39.873  -9.846  19.673
  517   1HD2  LEU  56          1HD2      LEU  56  38.765  -9.258  15.918
  518   2HD2  LEU  56          2HD2      LEU  56  40.232  -8.804  16.818
  519   3HD2  LEU  56          3HD2      LEU  56  39.738 -10.512  16.725
  Start of MODEL    2
    1   1H5*    C 504          1H5*        C 504  34.455 -14.937  -6.237
    2   2H5*    C 504          2H5*        C 504  35.500 -13.517  -6.202
    3    H4*    C 504           H4*        C 504  35.742 -15.000  -8.213
    4    H3*    C 504           H3*        C 504  34.857 -12.192  -8.967
    5    H2*    C 504           H2*        C 504  36.116 -12.671 -10.889
    6   2HO*    C 504          2HO*        C 504  37.420 -14.919 -10.133
    7    H1*    C 504           H1*        C 504  35.451 -15.268 -11.199
    8   1H4     C 504          1H4         C 504  30.341 -12.462 -13.761
    9   2H4     C 504          2H4         C 504  29.751 -12.042 -12.168
   10    H5     C 504           H5         C 504  30.934 -12.471 -10.170
   11    H6     C 504           H6         C 504  32.997 -13.419  -9.198
   12   1H5*    C 505          1H5*        C 505  39.353  -8.878  -7.546
   13   2H5*    C 505          2H5*        C 505  37.656  -8.439  -7.751
   14    H4*    C 505           H4*        C 505  39.706  -7.980  -9.545
   15    H3*    C 505           H3*        C 505  36.709  -7.880  -9.777
   16    H2*    C 505           H2*        C 505  36.848  -7.605 -12.078
   17   2HO*    C 505          2HO*        C 505  38.283  -5.977 -12.316
   18    H1*    C 505           H1*        C 505  39.370  -9.149 -12.132
   19   1H4     C 505          1H4         C 505  35.625 -12.459 -16.081
   20   2H4     C 505          2H4         C 505  34.525 -12.808 -14.767
   21    H5     C 505           H5         C 505  34.766 -11.941 -12.583
   22    H6     C 505           H6         C 505  36.135 -10.511 -11.107
   23   1H5*    U 506          1H5*        U 506  39.114  -4.045  -9.605
   24   2H5*    U 506          2H5*        U 506  38.604  -2.578  -8.770
   25    H4*    U 506           H4*        U 506  37.416  -2.204 -10.629
   26    H3*    U 506           H3*        U 506  35.664  -4.249  -9.253
   27    H2*    U 506           H2*        U 506  34.224  -4.187 -11.061
   28   2HO*    U 506          2HO*        U 506  33.774  -2.050 -11.210
   29    H1*    U 506           H1*        U 506  36.461  -3.321 -12.821
   30    H3     U 506           H3         U 506  36.016  -6.668 -15.760
   31    H5     U 506           H5         U 506  34.015  -8.147 -12.392
   32    H6     U 506           H6         U 506  34.713  -6.117 -11.208
   33   1H5*    C 507          1H5*        C 507  34.153  -0.216 -10.514
   34   2H5*    C 507          2H5*        C 507  34.136   0.444  -8.879
   35    H4*    C 507           H4*        C 507  32.714   1.596 -10.671
   36    H3*    C 507           H3*        C 507  31.808   0.911  -7.901
   37    H2*    C 507           H2*        C 507  29.660   1.830  -8.318
   38   2HO*    C 507          2HO*        C 507  30.909   2.585 -10.803
   39    H1*    C 507           H1*        C 507  29.406   0.500 -10.796
   40   1H4     C 507          1H4         C 507  26.200  -3.019  -6.507
   41   2H4     C 507          2H4         C 507  27.663  -3.942  -6.241
   42    H5     C 507           H5         C 507  29.756  -3.391  -7.186
   43    H6     C 507           H6         C 507  30.973  -1.803  -8.633
   44   1H5*    C 508          1H5*        C 508  31.422   5.896  -5.966
   45   2H5*    C 508          2H5*        C 508  30.994   6.949  -7.315
   46    H4*    C 508           H4*        C 508  33.186   7.336  -5.926
   47    H3*    C 508           H3*        C 508  32.851   7.644  -8.906
   48    H2*    C 508           H2*        C 508  35.070   8.475  -9.033
   49   2HO*    C 508          2HO*        C 508  35.377   9.676  -7.240
   50    H1*    C 508           H1*        C 508  36.047   6.418  -7.323
   51   1H4     C 508          1H4         C 508  37.659   3.996 -12.969
   52   2H4     C 508          2H4         C 508  36.064   4.320 -13.611
   53    H5     C 508           H5         C 508  34.330   5.338 -12.375
   54    H6     C 508           H6         C 508  33.693   6.308 -10.195
   55   1H5*    G 509          1H5*        G 509  33.067  10.790 -11.138
   56   2H5*    G 509          2H5*        G 509  31.791  11.608 -10.238
   57    H4*    G 509           H4*        G 509  31.105  11.434 -12.515
   58    H3*    G 509           H3*        G 509  29.627   9.541 -10.683
   59    H2*    G 509           H2*        G 509  28.230   8.955 -12.471
   60   2HO*    G 509          2HO*        G 509  27.902  11.139 -13.078
   61    H1*    G 509           H1*        G 509  30.461   9.194 -14.343
   62    H8     G 509           H8         G 509  29.689   6.929 -11.332
   63    H1     G 509           H1         G 509  30.001   3.961 -17.075
   64   1H2     G 509          1H2         G 509  30.402   5.349 -18.547
   65   2H2     G 509          2H2         G 509  30.621   7.062 -18.266
   66   1H5*    U 510          1H5*        U 510  27.979  10.168  -7.826
   67   2H5*    U 510          2H5*        U 510  27.750   8.477  -8.269
   68    H4*    U 510           H4*        U 510  25.859   9.647  -7.021
   69    H3*    U 510           H3*        U 510  25.414   8.081  -9.565
   70    H2*    U 510           H2*        U 510  23.085   8.309  -9.232
   71   2HO*    U 510          2HO*        U 510  22.937   7.955  -7.054
   72    H1*    U 510           H1*        U 510  23.389  11.047  -8.406
   73    H3     U 510           H3         U 510  20.929  12.000 -12.018
   74    H5     U 510           H5         U 510  24.098   9.796 -13.644
   75    H6     U 510           H6         U 510  24.915   9.471 -11.354
   76   1H    ALA   1           HN       ALA   1  64.560 -26.436 -40.080
   77    HA   ALA   1           HA       ALA   1  62.858 -27.528 -38.099
   78   1HB   ALA   1          1HB       ALA   1  65.535 -28.004 -37.082
   79   2HB   ALA   1          2HB       ALA   1  64.147 -29.115 -37.163
   80   3HB   ALA   1          3HB       ALA   1  65.250 -28.967 -38.552
   81    H    THR   2           HN       THR   2  62.466 -25.149 -38.356
   82    HA   THR   2           HA       THR   2  64.244 -23.708 -36.535
   83    HB   THR   2           HB       THR   2  63.548 -22.986 -39.412
   84    HG1  THR   2           HG1      THR   2  65.880 -22.893 -37.627
   85   1HG2  THR   2          1HG2      THR   2  65.031 -20.873 -38.254
   86   2HG2  THR   2          2HG2      THR   2  63.340 -20.788 -38.803
   87   3HG2  THR   2          3HG2      THR   2  63.706 -21.169 -37.102
   88    H    VAL   3           HN       VAL   3  62.843 -23.588 -34.847
   89    HA   VAL   3           HA       VAL   3  60.259 -22.335 -35.473
   90    HB   VAL   3           HB       VAL   3  59.387 -23.528 -33.496
   91   1HG1  VAL   3          1HG1      VAL   3  59.826 -25.937 -34.676
   92   2HG1  VAL   3          2HG1      VAL   3  58.672 -24.724 -35.279
   93   3HG1  VAL   3          3HG1      VAL   3  60.299 -24.836 -35.992
   94   1HG2  VAL   3          1HG2      VAL   3  62.158 -24.132 -33.079
   95   2HG2  VAL   3          2HG2      VAL   3  60.764 -24.488 -32.031
   96   3HG2  VAL   3          3HG2      VAL   3  61.262 -25.658 -33.277
   97    H    VAL   4           HN       VAL   4  60.190 -20.265 -34.784
   98    HA   VAL   4           HA       VAL   4  61.461 -19.673 -32.221
   99    HB   VAL   4           HB       VAL   4  61.888 -18.198 -34.822
  100   1HG1  VAL   4          1HG1      VAL   4  62.007 -17.254 -32.026
  101   2HG1  VAL   4          2HG1      VAL   4  63.455 -16.898 -32.999
  102   3HG1  VAL   4          3HG1      VAL   4  61.856 -16.338 -33.545
  103   1HG2  VAL   4          1HG2      VAL   4  63.419 -20.156 -33.326
  104   2HG2  VAL   4          2HG2      VAL   4  63.718 -19.471 -34.941
  105   3HG2  VAL   4          3HG2      VAL   4  64.321 -18.630 -33.492
  106    H    SER   5           HN       SER   5  60.398 -18.041 -31.018
  107    HA   SER   5           HA       SER   5  57.844 -17.279 -32.203
  108   1HB   SER   5          2HB       SER   5  58.602 -17.845 -29.308
  109   2HB   SER   5          3HB       SER   5  57.092 -17.077 -29.757
  110    HG   SER   5           HG       SER   5  57.639 -19.425 -31.199
  111    H    GLY   6           HN       GLY   6  56.961 -15.125 -31.369
  112   1HA   GLY   6          1HA       GLY   6  59.091 -13.287 -30.500
  113   2HA   GLY   6          2HA       GLY   6  58.187 -12.944 -31.962
  114    H    GLN   7           HN       GLN   7  55.790 -12.691 -31.810
  115    HA   GLN   7           HA       GLN   7  53.983 -11.878 -30.924
  116   1HB   GLN   7          2HB       GLN   7  55.011 -13.603 -28.815
  117   2HB   GLN   7          3HB       GLN   7  54.182 -12.231 -28.106
  118   1HG   GLN   7          2HG       GLN   7  52.561 -14.025 -28.492
  119   2HG   GLN   7          3HG       GLN   7  52.192 -12.688 -29.563
  120   1HE2  GLN   7          1HE2      GLN   7  53.941 -15.761 -29.355
  121   2HE2  GLN   7          2HE2      GLN   7  53.756 -16.242 -31.008
  122    H    LYS   8           HN       LYS   8  54.296  -9.682 -31.351
  123    HA   LYS   8           HA       LYS   8  55.942  -8.142 -29.544
  124   1HB   LYS   8          2HB       LYS   8  56.062  -7.780 -31.976
  125   2HB   LYS   8          3HB       LYS   8  54.367  -7.335 -32.007
  126   1HG   LYS   8          2HG       LYS   8  54.755  -5.251 -31.119
  127   2HG   LYS   8          3HG       LYS   8  55.961  -5.841 -29.991
  128   1HD   LYS   8          2HD       LYS   8  56.746  -5.929 -32.879
  129   2HD   LYS   8          3HD       LYS   8  56.553  -4.325 -32.199
  130   1HE   LYS   8          2HE       LYS   8  58.715  -4.609 -31.496
  131   2HE   LYS   8          3HE       LYS   8  57.990  -5.522 -30.187
  132   1HZ   LYS   8          1HZ       LYS   8  59.675  -6.452 -32.170
  133   2HZ   LYS   8          2HZ       LYS   8  58.999  -7.302 -30.950
  134   3HZ   LYS   8          3HZ       LYS   8  58.237  -7.194 -32.390
  135    H    GLN   9           HN       GLN   9  55.167  -7.364 -27.664
  136    HA   GLN   9           HA       GLN   9  52.624  -6.102 -27.656
  137   1HB   GLN   9          2HB       GLN   9  52.535  -8.806 -27.096
  138   2HB   GLN   9          3HB       GLN   9  52.728  -8.134 -25.488
  139   1HG   GLN   9          2HG       GLN   9  50.811  -6.500 -26.095
  140   2HG   GLN   9          3HG       GLN   9  50.532  -7.502 -27.505
  141   1HE2  GLN   9          1HE2      GLN   9  49.397  -9.315 -27.341
  142   2HE2  GLN   9          2HE2      GLN   9  48.809 -10.023 -25.873
  143    H    ASP  10           HN       ASP  10  53.295  -4.205 -26.736
  144    HA   ASP  10           HA       ASP  10  55.087  -4.458 -24.453
  145   1HB   ASP  10          2HB       ASP  10  55.490  -2.996 -26.702
  146   2HB   ASP  10          3HB       ASP  10  54.568  -1.814 -25.796
  147    H    ARG  11           HN       ARG  11  53.903  -4.291 -22.538
  148    HA   ARG  11           HA       ARG  11  51.714  -2.371 -22.568
  149   1HB   ARG  11          2HB       ARG  11  50.934  -4.734 -22.317
  150   2HB   ARG  11          3HB       ARG  11  51.978  -4.941 -20.925
  151   1HG   ARG  11          2HG       ARG  11  50.736  -3.079 -19.755
  152   2HG   ARG  11          3HG       ARG  11  49.657  -2.966 -21.131
  153   1HD   ARG  11          2HD       ARG  11  49.578  -5.693 -20.561
  154   2HD   ARG  11          3HD       ARG  11  49.738  -4.992 -18.963
  155    HE   ARG  11           HE       ARG  11  47.734  -3.622 -20.593
  156   1HH1  ARG  11          2HH2      ARG  11  48.301  -6.361 -18.458
  157   2HH1  ARG  11          1HH2      ARG  11  46.638  -6.510 -17.997
  158   1HH2  ARG  11          2HH1      ARG  11  45.540  -3.818 -19.985
  159   2HH2  ARG  11          1HH1      ARG  11  45.057  -5.054 -18.871
  160    H    GLN  12           HN       GLN  12  52.296  -0.568 -21.396
  161    HA   GLN  12           HA       GLN  12  53.886  -1.061 -18.999
  162   1HB   GLN  12          2HB       GLN  12  54.364   0.750 -21.270
  163   2HB   GLN  12          3HB       GLN  12  54.380   1.601 -19.739
  164   1HG   GLN  12          2HG       GLN  12  56.242   0.446 -18.946
  165   2HG   GLN  12          3HG       GLN  12  55.861  -1.012 -19.840
  166   1HE2  GLN  12          1HE2      GLN  12  56.251  -1.089 -22.104
  167   2HE2  GLN  12          2HE2      GLN  12  57.476  -0.113 -22.843
  168    H    GLY  13           HN       GLY  13  51.786  -1.255 -17.872
  169   1HA   GLY  13          1HA       GLY  13  50.311  -0.346 -16.422
  170   2HA   GLY  13          2HA       GLY  13  50.944   1.247 -16.785
  171    H    GLY  14           HN       GLY  14  49.706   2.641 -17.994
  172   1HA   GLY  14          1HA       GLY  14  48.181   3.323 -19.537
  173   2HA   GLY  14          2HA       GLY  14  47.876   1.658 -19.991
  174    H    GLU  15           HN       GLU  15  46.737   0.283 -18.159
  175    HA   GLU  15           HA       GLU  15  44.253   1.301 -17.796
  176   1HB   GLU  15          2HB       GLU  15  45.616  -1.087 -17.181
  177   2HB   GLU  15          3HB       GLU  15  44.985  -0.548 -15.637
  178   1HG   GLU  15          2HG       GLU  15  43.307  -0.782 -18.180
  179   2HG   GLU  15          3HG       GLU  15  43.391  -2.022 -16.944
  180    H    ARG  16           HN       ARG  16  43.595   3.079 -16.672
  181    HA   ARG  16           HA       ARG  16  44.982   3.570 -14.159
  182   1HB   ARG  16          2HB       ARG  16  44.572   5.966 -14.488
  183   2HB   ARG  16          3HB       ARG  16  45.348   5.331 -15.926
  184   1HG   ARG  16          2HG       ARG  16  43.021   5.049 -16.953
  185   2HG   ARG  16          3HG       ARG  16  42.370   5.898 -15.565
  186   1HD   ARG  16          2HD       ARG  16  42.719   7.490 -17.409
  187   2HD   ARG  16          3HD       ARG  16  43.810   7.876 -16.094
  188    HE   ARG  16           HE       ARG  16  45.015   6.044 -18.018
  189   1HH1  ARG  16          2HH2      ARG  16  44.333   9.432 -17.354
  190   2HH1  ARG  16          1HH2      ARG  16  45.626  10.018 -18.347
  191   1HH2  ARG  16          2HH1      ARG  16  46.721   6.818 -19.327
  192   2HH2  ARG  16          1HH1      ARG  16  46.993   8.521 -19.476
  193    H    ARG  17           HN       ARG  17  43.289   5.418 -12.963
  194    HA   ARG  17           HA       ARG  17  41.387   3.911 -11.828
  195   1HB   ARG  17          2HB       ARG  17  41.561   6.917 -12.276
  196   2HB   ARG  17          3HB       ARG  17  40.229   6.233 -11.366
  197   1HG   ARG  17          2HG       ARG  17  41.690   5.345  -9.675
  198   2HG   ARG  17          3HG       ARG  17  43.113   5.543 -10.681
  199   1HD   ARG  17          2HD       ARG  17  43.189   7.887 -10.356
  200   2HD   ARG  17          3HD       ARG  17  41.486   7.993  -9.953
  201    HE   ARG  17           HE       ARG  17  43.672   7.371  -8.119
  202   1HH1  ARG  17          2HH2      ARG  17  40.223   6.965  -8.690
  203   2HH1  ARG  17          1HH2      ARG  17  39.844   6.730  -7.017
  204   1HH2  ARG  17          2HH1      ARG  17  43.173   7.059  -5.911
  205   2HH2  ARG  17          1HH1      ARG  17  41.533   6.784  -5.425
  206    H    ARG  18           HN       ARG  18  40.544   6.624 -14.113
  207    HA   ARG  18           HA       ARG  18  38.277   4.996 -14.927
  208   1HB   ARG  18          2HB       ARG  18  37.568   7.410 -15.870
  209   2HB   ARG  18          3HB       ARG  18  37.291   6.977 -14.195
  210   1HG   ARG  18          2HG       ARG  18  39.380   8.094 -13.508
  211   2HG   ARG  18          3HG       ARG  18  39.798   8.418 -15.179
  212   1HD   ARG  18          2HD       ARG  18  37.533   9.708 -15.317
  213   2HD   ARG  18          3HD       ARG  18  37.510   9.619 -13.567
  214    HE   ARG  18           HE       ARG  18  39.286  11.272 -15.208
  215   1HH1  ARG  18          2HH2      ARG  18  38.856   9.752 -12.063
  216   2HH1  ARG  18          1HH2      ARG  18  39.923  10.846 -11.247
  217   1HH2  ARG  18          2HH1      ARG  18  40.694  12.715 -14.130
  218   2HH2  ARG  18          1HH1      ARG  18  40.975  12.543 -12.431
  219    H    SER  19           HN       SER  19  40.330   4.017 -16.225
  220    HA   SER  19           HA       SER  19  41.525   5.342 -18.246
  221   1HB   SER  19          2HB       SER  19  40.819   2.506 -17.683
  222   2HB   SER  19          3HB       SER  19  41.153   2.850 -19.368
  223    HG   SER  19           HG       SER  19  43.243   3.155 -18.934
  224    H    GLN  20           HN       GLN  20  40.610   6.594 -19.833
  225    HA   GLN  20           HA       GLN  20  39.044   7.402 -21.155
  226   1HB   GLN  20          2HB       GLN  20  40.047   4.877 -22.155
  227   2HB   GLN  20          3HB       GLN  20  38.396   5.083 -22.704
  228   1HG   GLN  20          2HG       GLN  20  39.086   7.488 -23.395
  229   2HG   GLN  20          3HG       GLN  20  40.742   6.978 -23.132
  230   1HE2  GLN  20          1HE2      GLN  20  37.761   6.225 -24.873
  231   2HE2  GLN  20          2HE2      GLN  20  38.484   5.487 -26.263
  232    H    LEU  21           HN       LEU  21  37.796   6.882 -18.755
  233    HA   LEU  21           HA       LEU  21  35.529   5.183 -19.134
  234   1HB   LEU  21          2HB       LEU  21  36.775   5.727 -16.971
  235   2HB   LEU  21          3HB       LEU  21  35.920   7.256 -16.986
  236    HG   LEU  21           HG       LEU  21  34.933   4.521 -16.393
  237   1HD1  LEU  21          1HD1      LEU  21  33.312   6.312 -15.113
  238   2HD1  LEU  21          2HD1      LEU  21  34.825   5.642 -14.455
  239   3HD1  LEU  21          3HD1      LEU  21  34.830   7.231 -15.255
  240   1HD2  LEU  21          1HD2      LEU  21  32.621   5.035 -16.997
  241   2HD2  LEU  21          2HD2      LEU  21  33.145   6.565 -17.740
  242   3HD2  LEU  21          3HD2      LEU  21  33.674   5.013 -18.432
  243    H    ASP  22           HN       ASP  22  34.690   6.049 -21.158
  244    HA   ASP  22           HA       ASP  22  34.010   8.692 -21.482
  245   1HB   ASP  22          2HB       ASP  22  32.555   6.244 -22.589
  246   2HB   ASP  22          3HB       ASP  22  32.481   7.863 -23.258
  247    H    ARG  23           HN       ARG  23  31.622   9.514 -21.651
  248    HA   ARG  23           HA       ARG  23  30.417   9.147 -19.169
  249   1HB   ARG  23          2HB       ARG  23  29.722  10.607 -21.724
  250   2HB   ARG  23          3HB       ARG  23  28.459  10.412 -20.525
  251   1HG   ARG  23          2HG       ARG  23  31.197  11.676 -20.033
  252   2HG   ARG  23          3HG       ARG  23  29.686  12.548 -20.196
  253   1HD   ARG  23          2HD       ARG  23  29.002  10.771 -18.211
  254   2HD   ARG  23          3HD       ARG  23  30.714  10.952 -17.884
  255    HE   ARG  23           HE       ARG  23  29.455  13.531 -18.330
  256   1HH1  ARG  23          2HH2      ARG  23  29.909  11.004 -15.925
  257   2HH1  ARG  23          1HH2      ARG  23  29.690  12.069 -14.577
  258   1HH2  ARG  23          2HH1      ARG  23  29.165  14.937 -16.552
  259   2HH2  ARG  23          1HH1      ARG  23  29.263  14.322 -14.936
  260    H    ASP  24           HN       ASP  24  30.449   7.156 -21.896
  261    HA   ASP  24           HA       ASP  24  27.905   5.991 -21.090
  262   1HB   ASP  24          2HB       ASP  24  28.943   6.714 -23.801
  263   2HB   ASP  24          3HB       ASP  24  28.182   5.140 -23.691
  264    H    GLN  25           HN       GLN  25  30.850   5.547 -20.368
  265    HA   GLN  25           HA       GLN  25  31.142   2.867 -21.478
  266   1HB   GLN  25          2HB       GLN  25  33.021   5.044 -21.074
  267   2HB   GLN  25          3HB       GLN  25  33.541   3.654 -20.142
  268   1HG   GLN  25          2HG       GLN  25  33.133   2.253 -22.289
  269   2HG   GLN  25          3HG       GLN  25  32.998   3.780 -23.137
  270   1HE2  GLN  25          1HE2      GLN  25  35.073   2.515 -20.528
  271   2HE2  GLN  25          2HE2      GLN  25  36.598   2.906 -21.252
  272    H    CYS  26           HN       CYS  26  30.726   1.183 -20.114
  273    HA   CYS  26           HA       CYS  26  29.878   1.557 -17.529
  274   1HB   CYS  26          2HB       CYS  26  29.335  -0.437 -18.829
  275   2HB   CYS  26          3HB       CYS  26  31.014  -0.941 -18.825
  276    H    ALA  27           HN       ALA  27  30.948   1.810 -15.573
  277    HA   ALA  27           HA       ALA  27  33.867   1.777 -15.702
  278   1HB   ALA  27          1HB       ALA  27  31.788   3.317 -14.288
  279   2HB   ALA  27          2HB       ALA  27  33.126   2.797 -13.236
  280   3HB   ALA  27          3HB       ALA  27  33.464   3.762 -14.693
  281    H    TYR  28           HN       TYR  28  32.315  -0.728 -15.702
  282    HA   TYR  28           HA       TYR  28  33.250  -1.764 -13.113
  283   1HB   TYR  28          2HB       TYR  28  30.662  -1.475 -13.603
  284   2HB   TYR  28          3HB       TYR  28  30.872  -2.741 -14.796
  285    HD1  TYR  28           HD1      TYR  28  30.403  -1.991 -11.299
  286    HD2  TYR  28           HD2      TYR  28  31.671  -5.034 -14.025
  287    HE1  TYR  28           HE1      TYR  28  30.073  -3.753  -9.496
  288    HE2  TYR  28           HE2      TYR  28  31.337  -6.785 -12.214
  289    HH   TYR  28           HH       TYR  28  29.797  -6.913 -10.096
  290    H    CYS  29           HN       CYS  29  32.006  -2.922 -16.334
  291    HA   CYS  29           HA       CYS  29  34.066  -4.968 -16.254
  292   1HB   CYS  29          2HB       CYS  29  32.832  -6.014 -18.094
  293   2HB   CYS  29          3HB       CYS  29  31.790  -5.723 -16.715
  294    H    LYS  30           HN       LYS  30  33.146  -1.908 -17.743
  295    HA   LYS  30           HA       LYS  30  34.539  -0.531 -18.874
  296   1HB   LYS  30          2HB       LYS  30  36.386  -2.362 -18.252
  297   2HB   LYS  30          3HB       LYS  30  36.270  -2.708 -19.966
  298   1HG   LYS  30          2HG       LYS  30  37.491  -0.864 -20.457
  299   2HG   LYS  30          3HG       LYS  30  36.318   0.160 -19.654
  300   1HD   LYS  30          2HD       LYS  30  38.150  -1.376 -17.849
  301   2HD   LYS  30          3HD       LYS  30  38.907  -0.122 -18.813
  302   1HE   LYS  30          2HE       LYS  30  36.391   0.846 -17.664
  303   2HE   LYS  30          3HE       LYS  30  37.441   0.224 -16.407
  304   1HZ   LYS  30          1HZ       LYS  30  37.721   2.567 -17.940
  305   2HZ   LYS  30          2HZ       LYS  30  38.513   2.125 -16.582
  306   3HZ   LYS  30          3HZ       LYS  30  39.072   1.656 -18.043
  307    H    GLU  31           HN       GLU  31  32.130  -2.182 -19.629
  308    HA   GLU  31           HA       GLU  31  32.568  -2.445 -22.476
  309   1HB   GLU  31          2HB       GLU  31  30.270  -3.253 -20.648
  310   2HB   GLU  31          3HB       GLU  31  30.178  -3.388 -22.393
  311   1HG   GLU  31          2HG       GLU  31  32.022  -4.957 -22.469
  312   2HG   GLU  31          3HG       GLU  31  32.460  -4.632 -20.803
  313    H    LYS  32           HN       LYS  32  32.048  -0.809 -23.861
  314    HA   LYS  32           HA       LYS  32  30.650   1.473 -22.808
  315   1HB   LYS  32          2HB       LYS  32  32.614   1.831 -24.171
  316   2HB   LYS  32          3HB       LYS  32  31.940   0.892 -25.488
  317   1HG   LYS  32          2HG       LYS  32  30.305   3.207 -24.469
  318   2HG   LYS  32          3HG       LYS  32  31.745   3.587 -25.390
  319   1HD   LYS  32          2HD       LYS  32  29.607   1.640 -26.367
  320   2HD   LYS  32          3HD       LYS  32  29.601   3.347 -26.763
  321   1HE   LYS  32          2HE       LYS  32  31.921   3.079 -27.748
  322   2HE   LYS  32          3HE       LYS  32  31.818   1.357 -27.442
  323   1HZ   LYS  32          1HZ       LYS  32  29.509   2.041 -28.747
  324   2HZ   LYS  32          2HZ       LYS  32  30.698   2.825 -29.545
  325   3HZ   LYS  32          3HZ       LYS  32  30.771   1.205 -29.356
  326    H    GLY  33           HN       GLY  33  28.514   1.919 -23.020
  327   1HA   GLY  33          1HA       GLY  33  26.744   1.810 -24.864
  328   2HA   GLY  33          2HA       GLY  33  26.940   0.076 -24.699
  329    H    HIS  34           HN       HIS  34  27.367  -0.100 -21.853
  330    HA   HIS  34           HA       HIS  34  24.768   0.863 -20.899
  331   1HB   HIS  34          2HB       HIS  34  24.479  -1.158 -19.663
  332   2HB   HIS  34          3HB       HIS  34  24.830  -1.583 -21.326
  333    HD1  HIS  34           HD1      HIS  34  26.686  -3.236 -21.694
  334    HD2  HIS  34           HD2      HIS  34  26.875  -1.438 -17.909
  335    HE1  HIS  34           HE1      HIS  34  28.554  -4.429 -20.429
  336    H    TRP  35           HN       TRP  35  24.659   1.306 -18.547
  337    HA   TRP  35           HA       TRP  35  27.153   2.503 -17.683
  338   1HB   TRP  35          2HB       TRP  35  24.277   2.847 -17.099
  339   2HB   TRP  35          3HB       TRP  35  25.354   3.075 -15.734
  340    HD1  TRP  35           HD1      TRP  35  26.018   4.211 -19.414
  341    HE1  TRP  35           HE1      TRP  35  26.452   6.812 -19.515
  342    HE3  TRP  35           HE3      TRP  35  25.135   5.079 -14.482
  343    HZ2  TRP  35           HZ2      TRP  35  26.378   8.894 -17.565
  344    HZ3  TRP  35           HZ3      TRP  35  25.338   7.425 -13.662
  345    HH2  TRP  35           HH2      TRP  35  25.935   9.298 -15.115
  346    H    ALA  36           HN       ALA  36  27.919   2.119 -15.411
  347    HA   ALA  36           HA       ALA  36  28.243  -0.600 -14.913
  348   1HB   ALA  36          1HB       ALA  36  29.861   1.033 -14.172
  349   2HB   ALA  36          2HB       ALA  36  28.640   1.872 -13.185
  350   3HB   ALA  36          3HB       ALA  36  29.188   0.243 -12.727
  351    H    LYS  37           HN       LYS  37  25.844   1.796 -13.779
  352    HA   LYS  37           HA       LYS  37  24.825   0.208 -11.689
  353   1HB   LYS  37          2HB       LYS  37  23.855   2.615 -13.215
  354   2HB   LYS  37          3HB       LYS  37  22.791   1.796 -12.089
  355   1HG   LYS  37          2HG       LYS  37  23.996   2.468 -10.238
  356   2HG   LYS  37          3HG       LYS  37  25.541   2.320 -11.053
  357   1HD   LYS  37          2HD       LYS  37  25.486   4.489 -11.868
  358   2HD   LYS  37          3HD       LYS  37  23.745   4.490 -12.070
  359   1HE   LYS  37          2HE       LYS  37  24.769   4.346  -9.247
  360   2HE   LYS  37          3HE       LYS  37  24.997   5.867 -10.088
  361   1HZ   LYS  37          1HZ       LYS  37  22.763   6.169 -10.283
  362   2HZ   LYS  37          2HZ       LYS  37  22.391   4.582 -10.198
  363   3HZ   LYS  37          3HZ       LYS  37  22.816   5.394  -8.846
  364    H    ASP  38           HN       ASP  38  24.826  -0.231 -15.062
  365    HA   ASP  38           HA       ASP  38  22.520  -1.990 -14.780
  366   1HB   ASP  38          2HB       ASP  38  22.606   0.226 -16.423
  367   2HB   ASP  38          3HB       ASP  38  23.213  -1.004 -17.513
  368    H    CYS  39           HN       CYS  39  25.594  -2.244 -14.521
  369    HA   CYS  39           HA       CYS  39  26.573  -3.522 -16.806
  370   1HB   CYS  39          2HB       CYS  39  27.985  -2.542 -15.002
  371   2HB   CYS  39          3HB       CYS  39  27.497  -3.840 -13.931
  372    HA   PRO  40           HA       PRO  40  24.406  -7.295 -16.230
  373   1HB   PRO  40          2HB       PRO  40  25.403  -8.641 -18.390
  374   2HB   PRO  40          3HB       PRO  40  24.050  -7.531 -18.492
  375   1HG   PRO  40          2HG       PRO  40  26.848  -7.128 -19.359
  376   2HG   PRO  40          3HG       PRO  40  25.415  -6.233 -19.823
  377   1HD   PRO  40          2HD       PRO  40  27.437  -5.395 -17.968
  378   2HD   PRO  40          3HD       PRO  40  25.948  -4.553 -18.347
  379    H    LYS  41           HN       LYS  41  27.511  -6.677 -15.557
  380    HA   LYS  41           HA       LYS  41  28.166  -9.477 -15.072
  381   1HB   LYS  41          2HB       LYS  41  29.656  -7.211 -15.879
  382   2HB   LYS  41          3HB       LYS  41  30.206  -7.599 -14.262
  383   1HG   LYS  41          2HG       LYS  41  30.014 -10.123 -15.421
  384   2HG   LYS  41          3HG       LYS  41  30.517  -9.139 -16.782
  385   1HD   LYS  41          2HD       LYS  41  32.638  -9.239 -15.987
  386   2HD   LYS  41          3HD       LYS  41  32.129  -8.234 -14.645
  387   1HE   LYS  41          2HE       LYS  41  33.114 -10.206 -13.670
  388   2HE   LYS  41          3HE       LYS  41  31.384 -10.360 -13.438
  389   1HZ   LYS  41          1HZ       LYS  41  32.357 -12.376 -14.291
  390   2HZ   LYS  41          2HZ       LYS  41  31.299 -11.767 -15.376
  391   3HZ   LYS  41          3HZ       LYS  41  32.906 -11.606 -15.622
  392    H    LYS  42           HN       LYS  42  26.927  -6.612 -13.519
  393    HA   LYS  42           HA       LYS  42  27.672  -7.599 -10.886
  394   1HB   LYS  42          2HB       LYS  42  27.013  -5.483 -10.060
  395   2HB   LYS  42          3HB       LYS  42  27.899  -5.174 -11.539
  396   1HG   LYS  42          2HG       LYS  42  26.068  -4.306 -12.601
  397   2HG   LYS  42          3HG       LYS  42  25.010  -5.575 -12.019
  398   1HD   LYS  42          2HD       LYS  42  24.100  -3.983 -10.668
  399   2HD   LYS  42          3HD       LYS  42  25.536  -4.172  -9.680
  400   1HE   LYS  42          2HE       LYS  42  26.632  -2.417 -11.293
  401   2HE   LYS  42          3HE       LYS  42  24.995  -2.073 -11.814
  402   1HZ   LYS  42          1HZ       LYS  42  25.932  -0.762  -9.887
  403   2HZ   LYS  42          2HZ       LYS  42  24.421  -1.357  -9.712
  404   3HZ   LYS  42          3HZ       LYS  42  25.679  -2.091  -8.973
  405    HA   PRO  43           HA       PRO  43  23.831  -9.501 -10.332
  406   1HB   PRO  43          2HB       PRO  43  23.822  -9.786  -7.615
  407   2HB   PRO  43          3HB       PRO  43  24.677 -10.874  -8.689
  408   1HG   PRO  43          2HG       PRO  43  25.771  -8.751  -6.948
  409   2HG   PRO  43          3HG       PRO  43  26.606 -10.103  -7.687
  410   1HD   PRO  43          2HD       PRO  43  26.673  -7.367  -8.547
  411   2HD   PRO  43          3HD       PRO  43  27.412  -8.737  -9.352
  412    H    ARG  44           HN       ARG  44  23.369  -7.006 -11.066
  413    HA   ARG  44           HA       ARG  44  21.943  -5.391 -10.913
  414   1HB   ARG  44          2HB       ARG  44  20.552  -7.453  -9.171
  415   2HB   ARG  44          3HB       ARG  44  19.849  -5.857  -9.340
  416   1HG   ARG  44          2HG       ARG  44  18.832  -6.796 -11.176
  417   2HG   ARG  44          3HG       ARG  44  20.338  -6.376 -11.967
  418   1HD   ARG  44          2HD       ARG  44  20.697  -8.573 -12.412
  419   2HD   ARG  44          3HD       ARG  44  20.800  -8.893 -10.692
  420    HE   ARG  44           HE       ARG  44  18.066  -8.756 -11.159
  421   1HH1  ARG  44          2HH2      ARG  44  20.705 -10.628 -12.543
  422   2HH1  ARG  44          1HH2      ARG  44  19.704 -11.985 -12.939
  423   1HH2  ARG  44          2HH1      ARG  44  16.745 -10.546 -11.681
  424   2HH2  ARG  44          1HH1      ARG  44  17.437 -11.939 -12.444
  425    H    GLY  45           HN       GLY  45  22.383  -3.440  -9.931
  426   1HA   GLY  45          1HA       GLY  45  23.031  -3.486  -7.050
  427   2HA   GLY  45          2HA       GLY  45  23.656  -2.347  -8.227
  428    HA   PRO  46           HA       PRO  46  23.820  -1.249  -6.464
  429   1HB   PRO  46          2HB       PRO  46  23.423   0.026  -4.079
  430   2HB   PRO  46          3HB       PRO  46  23.725   0.875  -5.582
  431   1HG   PRO  46          2HG       PRO  46  21.182   0.559  -4.110
  432   2HG   PRO  46          3HG       PRO  46  21.594   1.728  -5.350
  433   1HD   PRO  46          2HD       PRO  46  19.974  -0.618  -5.673
  434   2HD   PRO  46          3HD       PRO  46  20.484   0.486  -6.935
  435    H    ARG  47           HN       ARG  47  25.102  -2.092  -4.591
  436    HA   ARG  47           HA       ARG  47  23.737  -3.624  -2.724
  437   1HB   ARG  47          2HB       ARG  47  23.579  -4.938  -5.071
  438   2HB   ARG  47          3HB       ARG  47  25.200  -5.446  -4.644
  439   1HG   ARG  47          2HG       ARG  47  23.531  -5.700  -2.294
  440   2HG   ARG  47          3HG       ARG  47  22.695  -6.453  -3.638
  441   1HD   ARG  47          2HD       ARG  47  25.570  -7.121  -3.619
  442   2HD   ARG  47          3HD       ARG  47  24.779  -7.594  -2.129
  443    HE   ARG  47           HE       ARG  47  24.439  -8.850  -4.696
  444   1HH1  ARG  47          2HH2      ARG  47  22.614  -7.941  -1.828
  445   2HH1  ARG  47          1HH2      ARG  47  21.429  -9.188  -2.031
  446   1HH2  ARG  47          2HH1      ARG  47  22.876 -10.495  -4.965
  447   2HH2  ARG  47          1HH1      ARG  47  21.579 -10.650  -3.827
  448    H    GLY  48           HN       GLY  48  25.164  -3.718  -1.008
  449   1HA   GLY  48          1HA       GLY  48  27.944  -4.362  -1.425
  450   2HA   GLY  48          2HA       GLY  48  27.672  -2.689  -0.977
  451    HA   PRO  49           HA       PRO  49  27.804  -4.846   2.953
  452   1HB   PRO  49          2HB       PRO  49  29.276  -2.976   4.296
  453   2HB   PRO  49          3HB       PRO  49  29.992  -4.338   3.459
  454   1HG   PRO  49          2HG       PRO  49  29.918  -1.497   2.647
  455   2HG   PRO  49          3HG       PRO  49  30.966  -2.777   2.068
  456   1HD   PRO  49          2HD       PRO  49  28.687  -1.680   0.715
  457   2HD   PRO  49          3HD       PRO  49  29.665  -3.036   0.191
  458    H    ARG  50           HN       ARG  50  25.521  -4.649   3.057
  459    HA   ARG  50           HA       ARG  50  24.892  -2.479   4.855
  460   1HB   ARG  50          2HB       ARG  50  23.465  -3.072   2.225
  461   2HB   ARG  50          3HB       ARG  50  22.660  -2.213   3.523
  462   1HG   ARG  50          2HG       ARG  50  25.394  -1.267   2.637
  463   2HG   ARG  50          3HG       ARG  50  24.008  -0.890   1.632
  464   1HD   ARG  50          2HD       ARG  50  22.878   0.226   3.523
  465   2HD   ARG  50          3HD       ARG  50  24.155  -0.261   4.620
  466    HE   ARG  50           HE       ARG  50  25.570   1.406   3.716
  467   1HH1  ARG  50          2HH2      ARG  50  22.640   1.106   1.791
  468   2HH1  ARG  50          1HH2      ARG  50  22.930   2.558   0.891
  469   1HH2  ARG  50          2HH1      ARG  50  25.953   3.321   2.529
  470   2HH2  ARG  50          1HH1      ARG  50  24.828   3.825   1.313
  471    HA   PRO  51           HA       PRO  51  22.589  -5.686   6.713
  472   1HB   PRO  51          2HB       PRO  51  20.893  -4.272   8.323
  473   2HB   PRO  51          3HB       PRO  51  22.563  -4.601   8.743
  474   1HG   PRO  51          2HG       PRO  51  21.350  -2.073   7.804
  475   2HG   PRO  51          3HG       PRO  51  22.881  -2.320   8.620
  476   1HD   PRO  51          2HD       PRO  51  22.490  -1.811   5.825
  477   2HD   PRO  51          3HD       PRO  51  24.008  -2.173   6.622
  478    H    GLN  52           HN       GLN  52  20.334  -3.068   5.941
  479    HA   GLN  52           HA       GLN  52  18.272  -3.183   5.202
  480   1HB   GLN  52          2HB       GLN  52  20.034  -3.828   3.199
  481   2HB   GLN  52          3HB       GLN  52  18.943  -5.196   3.105
  482   1HG   GLN  52          2HG       GLN  52  17.223  -3.930   2.283
  483   2HG   GLN  52          3HG       GLN  52  17.516  -2.623   3.413
  484   1HE2  GLN  52          1HE2      GLN  52  18.125  -3.927   0.281
  485   2HE2  GLN  52          2HE2      GLN  52  18.996  -2.593  -0.400
  486    H    THR  53           HN       THR  53  17.048  -4.167   6.852
  487    HA   THR  53           HA       THR  53  15.753  -5.704   7.803
  488    HB   THR  53           HB       THR  53  16.059  -6.890   5.005
  489    HG1  THR  53           HG1      THR  53  14.318  -5.528   4.772
  490   1HG2  THR  53          1HG2      THR  53  15.322  -8.828   6.157
  491   2HG2  THR  53          2HG2      THR  53  14.499  -7.877   7.417
  492   3HG2  THR  53          3HG2      THR  53  13.782  -8.013   5.794
  493    H    SER  54           HN       SER  54  17.741  -7.991   5.838
  494    HA   SER  54           HA       SER  54  19.222  -9.475   6.425
  495   1HB   SER  54          2HB       SER  54  19.776  -7.435   8.230
  496   2HB   SER  54          3HB       SER  54  19.527  -8.804   9.295
  497    HG   SER  54           HG       SER  54  21.342  -8.734   7.035
  498    H    LEU  55           HN       LEU  55  18.599 -11.590   6.686
  499    HA   LEU  55           HA       LEU  55  17.568 -12.588   9.080
  500   1HB   LEU  55          2HB       LEU  55  15.597 -11.235   8.275
  501   2HB   LEU  55          3HB       LEU  55  15.472 -12.344   6.925
  502    HG   LEU  55           HG       LEU  55  13.878 -12.913   8.666
  503   1HD1  LEU  55          1HD1      LEU  55  14.929 -14.700   7.269
  504   2HD1  LEU  55          2HD1      LEU  55  16.059 -15.012   8.610
  505   3HD1  LEU  55          3HD1      LEU  55  14.311 -15.260   8.842
  506   1HD2  LEU  55          1HD2      LEU  55  15.485 -14.001  10.726
  507   2HD2  LEU  55          2HD2      LEU  55  16.072 -12.349  10.423
  508   3HD2  LEU  55          3HD2      LEU  55  14.357 -12.627  10.810
  509    H    LEU  56           HN       LEU  56  19.401 -13.941   8.525
  510    HA   LEU  56           HA       LEU  56  18.899 -15.702   6.240
  511   1HB   LEU  56          2HB       LEU  56  21.310 -14.656   7.595
  512   2HB   LEU  56          3HB       LEU  56  21.391 -16.328   7.079
  513    HG   LEU  56           HG       LEU  56  20.354 -15.013   4.854
  514   1HD1  LEU  56          1HD1      LEU  56  20.845 -12.839   5.853
  515   2HD1  LEU  56          2HD1      LEU  56  22.547 -13.311   6.071
  516   3HD1  LEU  56          3HD1      LEU  56  21.873 -13.143   4.432
  517   1HD2  LEU  56          1HD2      LEU  56  22.778 -16.428   5.640
  518   2HD2  LEU  56          2HD2      LEU  56  21.861 -16.476   4.114
  519   3HD2  LEU  56          3HD2      LEU  56  23.081 -15.207   4.380
  Start of MODEL    3
    1   1H5*    C 504          1H5*        C 504  36.459  -4.640  -2.060
    2   2H5*    C 504          2H5*        C 504  37.370  -4.781  -3.562
    3    H4*    C 504           H4*        C 504  36.057  -6.817  -2.815
    4    H3*    C 504           H3*        C 504  35.393  -5.760  -5.591
    5    H2*    C 504           H2*        C 504  34.820  -8.023  -6.001
    6   2HO*    C 504          2HO*        C 504  35.509  -9.362  -3.878
    7    H1*    C 504           H1*        C 504  33.656  -8.328  -3.428
    8   1H4     C 504          1H4         C 504  28.680  -7.472  -7.332
    9   2H4     C 504          2H4         C 504  29.005  -5.753  -7.358
   10    H5     C 504           H5         C 504  30.877  -4.751  -6.326
   11    H6     C 504           H6         C 504  32.920  -5.156  -4.998
   12   1H5*    C 505          1H5*        C 505  39.861  -7.161  -7.248
   13   2H5*    C 505          2H5*        C 505  39.985  -5.677  -8.194
   14    H4*    C 505           H4*        C 505  40.155  -7.587  -9.649
   15    H3*    C 505           H3*        C 505  37.698  -5.893  -9.934
   16    H2*    C 505           H2*        C 505  36.930  -7.243 -11.729
   17   2HO*    C 505          2HO*        C 505  39.469  -8.556 -11.368
   18    H1*    C 505           H1*        C 505  37.480  -9.645 -10.330
   19   1H4     C 505          1H4         C 505  31.200  -8.718  -9.607
   20   2H4     C 505          2H4         C 505  31.531  -7.602  -8.301
   21    H5     C 505           H5         C 505  33.702  -6.911  -7.678
   22    H6     C 505           H6         C 505  36.114  -7.123  -8.161
   23   1H5*    U 506          1H5*        U 506  39.434  -2.013  -9.561
   24   2H5*    U 506          2H5*        U 506  38.127  -2.409  -8.446
   25    H4*    U 506           H4*        U 506  37.610  -1.295 -10.743
   26    H3*    U 506           H3*        U 506  36.050  -3.534  -9.464
   27    H2*    U 506           H2*        U 506  34.611  -3.591 -11.273
   28   2HO*    U 506          2HO*        U 506  35.425  -1.115 -12.316
   29    H1*    U 506           H1*        U 506  36.771  -2.467 -12.997
   30    H3     U 506           H3         U 506  36.661  -5.737 -16.056
   31    H5     U 506           H5         U 506  34.684  -7.471 -12.797
   32    H6     U 506           H6         U 506  35.206  -5.439 -11.527
   33   1H5*    C 507          1H5*        C 507  34.183   0.700 -10.418
   34   2H5*    C 507          2H5*        C 507  33.810   1.016  -8.724
   35    H4*    C 507           H4*        C 507  32.406   2.043 -10.753
   36    H3*    C 507           H3*        C 507  31.543   1.329  -7.968
   37    H2*    C 507           H2*        C 507  29.324   2.028  -8.458
   38   2HO*    C 507          2HO*        C 507  30.544   2.807 -10.950
   39    H1*    C 507           H1*        C 507  29.235   0.584 -10.868
   40   1H4     C 507          1H4         C 507  26.485  -3.133  -6.430
   41   2H4     C 507          2H4         C 507  28.044  -3.877  -6.157
   42    H5     C 507           H5         C 507  30.053  -3.125  -7.147
   43    H6     C 507           H6         C 507  31.070  -1.457  -8.658
   44   1H5*    C 508          1H5*        C 508  32.486   6.252  -6.494
   45   2H5*    C 508          2H5*        C 508  32.023   6.285  -8.196
   46    H4*    C 508           H4*        C 508  33.666   8.079  -7.071
   47    H3*    C 508           H3*        C 508  33.512   7.085  -9.900
   48    H2*    C 508           H2*        C 508  35.347   8.459 -10.506
   49   2HO*    C 508          2HO*        C 508  34.780  10.253  -9.273
   50    H1*    C 508           H1*        C 508  36.845   7.691  -8.221
   51   1H4     C 508          1H4         C 508  39.396   3.740 -12.491
   52   2H4     C 508          2H4         C 508  37.817   3.351 -13.138
   53    H5     C 508           H5         C 508  35.799   4.266 -12.322
   54    H6     C 508           H6         C 508  34.786   5.794 -10.667
   55   1H5*    G 509          1H5*        G 509  32.409  11.006 -11.852
   56   2H5*    G 509          2H5*        G 509  31.303  12.223 -11.216
   57    H4*    G 509           H4*        G 509  30.254  11.754 -13.176
   58    H3*    G 509           H3*        G 509  29.150   9.712 -11.238
   59    H2*    G 509           H2*        G 509  27.685   8.985 -12.927
   60   2HO*    G 509          2HO*        G 509  26.995  10.944 -13.705
   61    H1*    G 509           H1*        G 509  29.734   9.334 -14.947
   62    H8     G 509           H8         G 509  29.491   7.243 -11.729
   63    H1     G 509           H1         G 509  29.731   3.880 -17.252
   64   1H2     G 509          1H2         G 509  29.844   5.183 -18.847
   65   2H2     G 509          2H2         G 509  29.870   6.926 -18.708
   66   1H5*    U 510          1H5*        U 510  25.343   9.528 -10.665
   67   2H5*    U 510          2H5*        U 510  26.284  10.485 -11.809
   68    H4*    U 510           H4*        U 510  24.961  12.285 -10.032
   69    H3*    U 510           H3*        U 510  23.213  10.027 -10.974
   70    H2*    U 510           H2*        U 510  21.459  11.547 -11.412
   71   2HO*    U 510          2HO*        U 510  21.854  13.793 -10.616
   72    H1*    U 510           H1*        U 510  23.290  13.443 -12.569
   73    H3     U 510           H3         U 510  20.124  12.432 -15.744
   74    H5     U 510           H5         U 510  22.912   9.312 -15.912
   75    H6     U 510           H6         U 510  23.917  10.231 -13.873
   76   1H    ALA   1           HN       ALA   1  69.250  14.969 -25.875
   77    HA   ALA   1           HA       ALA   1  67.538  16.625 -27.569
   78   1HB   ALA   1          1HB       ALA   1  65.853  15.120 -27.671
   79   2HB   ALA   1          2HB       ALA   1  67.082  13.908 -27.239
   80   3HB   ALA   1          3HB       ALA   1  66.067  14.636 -25.971
   81    H    THR   2           HN       THR   2  66.677  18.334 -26.454
   82    HA   THR   2           HA       THR   2  67.571  18.815 -23.819
   83    HB   THR   2           HB       THR   2  66.134  20.858 -24.097
   84    HG1  THR   2           HG1      THR   2  64.519  19.401 -25.317
   85   1HG2  THR   2          1HG2      THR   2  68.106  21.331 -25.284
   86   2HG2  THR   2          2HG2      THR   2  67.923  19.914 -26.344
   87   3HG2  THR   2          3HG2      THR   2  66.930  21.365 -26.619
   88    H    VAL   3           HN       VAL   3  66.768  18.326 -21.867
   89    HA   VAL   3           HA       VAL   3  64.372  16.721 -21.813
   90    HB   VAL   3           HB       VAL   3  64.969  16.416 -19.453
   91   1HG1  VAL   3          1HG1      VAL   3  67.414  16.056 -21.210
   92   2HG1  VAL   3          2HG1      VAL   3  66.919  15.076 -19.808
   93   3HG1  VAL   3          3HG1      VAL   3  65.964  15.028 -21.311
   94   1HG2  VAL   3          1HG2      VAL   3  67.382  18.168 -20.020
   95   2HG2  VAL   3          2HG2      VAL   3  65.941  18.701 -19.120
   96   3HG2  VAL   3          3HG2      VAL   3  66.950  17.382 -18.482
   97    H    VAL   4           HN       VAL   4  62.638  17.186 -20.161
   98    HA   VAL   4           HA       VAL   4  62.393  19.897 -19.279
   99    HB   VAL   4           HB       VAL   4  61.804  20.009 -21.703
  100   1HG1  VAL   4          1HG1      VAL   4  59.916  18.947 -22.607
  101   2HG1  VAL   4          2HG1      VAL   4  60.704  17.675 -21.644
  102   3HG1  VAL   4          3HG1      VAL   4  59.273  18.517 -21.004
  103   1HG2  VAL   4          1HG2      VAL   4  59.496  20.588 -19.818
  104   2HG2  VAL   4          2HG2      VAL   4  60.938  21.613 -20.014
  105   3HG2  VAL   4          3HG2      VAL   4  59.824  21.374 -21.381
  106    H    SER   5           HN       SER   5  60.581  20.149 -17.800
  107    HA   SER   5           HA       SER   5  58.851  17.983 -17.345
  108   1HB   SER   5          2HB       SER   5  59.675  17.428 -15.030
  109   2HB   SER   5          3HB       SER   5  60.755  16.906 -16.308
  110    HG   SER   5           HG       SER   5  62.243  18.429 -15.759
  111    H    GLY   6           HN       GLY   6  57.006  19.064 -16.768
  112   1HA   GLY   6          1HA       GLY   6  56.894  20.813 -14.552
  113   2HA   GLY   6          2HA       GLY   6  56.934  21.749 -16.033
  114    H    GLN   7           HN       GLN   7  54.728  21.247 -13.987
  115    HA   GLN   7           HA       GLN   7  52.720  20.673 -15.967
  116   1HB   GLN   7          2HB       GLN   7  53.496  18.684 -14.108
  117   2HB   GLN   7          3HB       GLN   7  51.997  19.332 -13.473
  118   1HG   GLN   7          2HG       GLN   7  51.274  19.125 -16.082
  119   2HG   GLN   7          3HG       GLN   7  52.499  17.872 -16.053
  120   1HE2  GLN   7          1HE2      GLN   7  49.736  17.485 -16.474
  121   2HE2  GLN   7          2HE2      GLN   7  49.096  16.506 -15.196
  122    H    LYS   8           HN       LYS   8  50.993  22.068 -15.747
  123    HA   LYS   8           HA       LYS   8  51.017  23.730 -13.341
  124   1HB   LYS   8          2HB       LYS   8  50.512  24.203 -16.193
  125   2HB   LYS   8          3HB       LYS   8  49.282  24.899 -15.156
  126   1HG   LYS   8          2HG       LYS   8  50.700  26.502 -14.373
  127   2HG   LYS   8          3HG       LYS   8  51.971  25.337 -14.053
  128   1HD   LYS   8          2HD       LYS   8  53.050  25.795 -16.014
  129   2HD   LYS   8          3HD       LYS   8  51.565  25.771 -16.944
  130   1HE   LYS   8          2HE       LYS   8  51.154  28.097 -15.608
  131   2HE   LYS   8          3HE       LYS   8  52.905  28.083 -15.563
  132   1HZ   LYS   8          1HZ       LYS   8  52.290  29.138 -17.532
  133   2HZ   LYS   8          2HZ       LYS   8  52.784  27.655 -18.006
  134   3HZ   LYS   8          3HZ       LYS   8  51.189  28.001 -17.937
  135    H    GLN   9           HN       GLN   9  49.314  23.765 -11.917
  136    HA   GLN   9           HA       GLN   9  46.836  22.582 -12.744
  137   1HB   GLN   9          2HB       GLN   9  48.677  21.312 -10.711
  138   2HB   GLN   9          3HB       GLN   9  46.944  21.179 -10.487
  139   1HG   GLN   9          2HG       GLN   9  46.997  19.418 -11.921
  140   2HG   GLN   9          3HG       GLN   9  47.280  20.574 -13.207
  141   1HE2  GLN   9          1HE2      GLN   9  48.907  18.666 -10.703
  142   2HE2  GLN   9          2HE2      GLN   9  50.388  18.387 -11.555
  143    H    ASP  10           HN       ASP  10  46.314  24.913 -12.454
  144    HA   ASP  10           HA       ASP  10  46.195  25.628  -9.633
  145   1HB   ASP  10          2HB       ASP  10  47.430  27.221 -11.082
  146   2HB   ASP  10          3HB       ASP  10  46.049  27.352 -12.152
  147    H    ARG  11           HN       ARG  11  44.136  25.354  -8.764
  148    HA   ARG  11           HA       ARG  11  41.992  25.107  -8.603
  149   1HB   ARG  11          2HB       ARG  11  42.259  27.466 -10.453
  150   2HB   ARG  11          3HB       ARG  11  40.652  26.787 -10.282
  151   1HG   ARG  11          2HG       ARG  11  42.371  27.491  -7.866
  152   2HG   ARG  11          3HG       ARG  11  41.315  28.664  -8.627
  153   1HD   ARG  11          2HD       ARG  11  40.175  25.967  -7.856
  154   2HD   ARG  11          3HD       ARG  11  40.441  27.160  -6.599
  155    HE   ARG  11           HE       ARG  11  39.111  28.639  -8.483
  156   1HH1  ARG  11          2HH2      ARG  11  38.440  25.492  -7.060
  157   2HH1  ARG  11          1HH2      ARG  11  36.722  25.638  -7.231
  158   1HH2  ARG  11          2HH1      ARG  11  36.845  28.834  -8.707
  159   2HH2  ARG  11          1HH1      ARG  11  35.810  27.553  -8.174
  160    H    GLN  12           HN       GLN  12  41.385  23.054  -9.305
  161    HA   GLN  12           HA       GLN  12  40.479  22.916 -12.054
  162   1HB   GLN  12          2HB       GLN  12  42.819  21.570 -11.037
  163   2HB   GLN  12          3HB       GLN  12  41.603  20.357 -11.380
  164   1HG   GLN  12          2HG       GLN  12  42.805  20.653 -13.434
  165   2HG   GLN  12          3HG       GLN  12  41.275  21.474 -13.668
  166   1HE2  GLN  12          1HE2      GLN  12  42.243  22.716 -15.301
  167   2HE2  GLN  12          2HE2      GLN  12  43.254  24.078 -14.952
  168    H    GLY  13           HN       GLY  13  38.691  21.478 -12.380
  169   1HA   GLY  13          1HA       GLY  13  37.408  20.646  -9.861
  170   2HA   GLY  13          2HA       GLY  13  36.596  21.034 -11.364
  171    H    GLY  14           HN       GLY  14  38.600  18.614  -9.657
  172   1HA   GLY  14          1HA       GLY  14  37.328  16.462 -11.024
  173   2HA   GLY  14          2HA       GLY  14  38.955  16.716 -11.624
  174    H    GLU  15           HN       GLU  15  36.974  15.853  -8.789
  175    HA   GLU  15           HA       GLU  15  38.715  15.775  -6.790
  176   1HB   GLU  15          2HB       GLU  15  36.366  15.028  -6.630
  177   2HB   GLU  15          3HB       GLU  15  36.737  13.579  -7.543
  178   1HG   GLU  15          2HG       GLU  15  36.693  13.068  -5.130
  179   2HG   GLU  15          3HG       GLU  15  38.310  12.835  -5.764
  180    H    ARG  16           HN       ARG  16  38.271  13.011  -9.124
  181    HA   ARG  16           HA       ARG  16  41.098  12.566  -8.986
  182   1HB   ARG  16          2HB       ARG  16  39.043  10.695  -7.809
  183   2HB   ARG  16          3HB       ARG  16  40.387   9.967  -8.667
  184   1HG   ARG  16          2HG       ARG  16  41.805  10.375  -6.941
  185   2HG   ARG  16          3HG       ARG  16  41.388  12.077  -6.929
  186   1HD   ARG  16          2HD       ARG  16  39.977  11.835  -5.145
  187   2HD   ARG  16          3HD       ARG  16  39.215  10.412  -5.830
  188    HE   ARG  16           HE       ARG  16  41.940   9.966  -4.796
  189   1HH1  ARG  16          2HH2      ARG  16  38.492   9.883  -4.097
  190   2HH1  ARG  16          1HH2      ARG  16  38.659   8.785  -2.768
  191   1HH2  ARG  16          2HH1      ARG  16  42.161   8.519  -3.043
  192   2HH2  ARG  16          1HH1      ARG  16  40.760   8.004  -2.164
  193    H    ARG  17           HN       ARG  17  41.831  11.933 -11.016
  194    HA   ARG  17           HA       ARG  17  40.218  12.006 -13.168
  195   1HB   ARG  17          2HB       ARG  17  42.950  10.944 -12.586
  196   2HB   ARG  17          3HB       ARG  17  42.218  10.304 -14.044
  197   1HG   ARG  17          2HG       ARG  17  41.633  13.041 -14.200
  198   2HG   ARG  17          3HG       ARG  17  43.237  13.024 -13.495
  199   1HD   ARG  17          2HD       ARG  17  44.021  12.758 -15.618
  200   2HD   ARG  17          3HD       ARG  17  43.454  11.103 -15.512
  201    HE   ARG  17           HE       ARG  17  41.615  11.644 -16.882
  202   1HH1  ARG  17          2HH2      ARG  17  43.252  14.583 -15.849
  203   2HH1  ARG  17          1HH2      ARG  17  42.377  15.606 -16.939
  204   1HH2  ARG  17          2HH1      ARG  17  40.459  12.994 -18.320
  205   2HH2  ARG  17          1HH1      ARG  17  40.777  14.696 -18.354
  206    H    ARG  18           HN       ARG  18  39.462  10.292 -14.695
  207    HA   ARG  18           HA       ARG  18  39.284   7.668 -13.515
  208   1HB   ARG  18          2HB       ARG  18  37.172   9.322 -13.104
  209   2HB   ARG  18          3HB       ARG  18  36.742   8.770 -14.710
  210   1HG   ARG  18          2HG       ARG  18  37.409   6.897 -12.391
  211   2HG   ARG  18          3HG       ARG  18  35.778   7.363 -12.829
  212   1HD   ARG  18          2HD       ARG  18  36.042   5.322 -13.986
  213   2HD   ARG  18          3HD       ARG  18  36.401   6.500 -15.233
  214    HE   ARG  18           HE       ARG  18  38.817   5.812 -13.816
  215   1HH1  ARG  18          2HH2      ARG  18  36.556   4.537 -16.191
  216   2HH1  ARG  18          1HH2      ARG  18  37.730   3.509 -16.945
  217   1HH2  ARG  18          2HH1      ARG  18  40.366   4.457 -14.810
  218   2HH2  ARG  18          1HH1      ARG  18  39.911   3.464 -16.154
  219    H    SER  19           HN       SER  19  40.963   8.293 -15.591
  220    HA   SER  19           HA       SER  19  41.394   8.115 -17.739
  221   1HB   SER  19          2HB       SER  19  41.328   5.759 -16.966
  222   2HB   SER  19          3HB       SER  19  39.626   5.657 -17.367
  223    HG   SER  19           HG       SER  19  40.105   5.349 -19.436
  224    H    GLN  20           HN       GLN  20  39.573  10.083 -17.667
  225    HA   GLN  20           HA       GLN  20  37.782  11.016 -18.553
  226   1HB   GLN  20          2HB       GLN  20  39.692  10.726 -20.388
  227   2HB   GLN  20          3HB       GLN  20  38.503   9.709 -21.177
  228   1HG   GLN  20          2HG       GLN  20  37.009  11.481 -21.539
  229   2HG   GLN  20          3HG       GLN  20  37.594  12.402 -20.169
  230   1HE2  GLN  20          1HE2      GLN  20  38.162  14.271 -21.046
  231   2HE2  GLN  20          2HE2      GLN  20  39.329  14.500 -22.305
  232    H    LEU  21           HN       LEU  21  36.727   8.949 -17.222
  233    HA   LEU  21           HA       LEU  21  35.557   6.854 -18.408
  234   1HB   LEU  21          2HB       LEU  21  35.385   8.047 -15.998
  235   2HB   LEU  21          3HB       LEU  21  33.794   8.428 -16.624
  236    HG   LEU  21           HG       LEU  21  34.977   5.654 -16.331
  237   1HD1  LEU  21          1HD1      LEU  21  32.800   7.078 -14.777
  238   2HD1  LEU  21          2HD1      LEU  21  33.223   5.357 -14.613
  239   3HD1  LEU  21          3HD1      LEU  21  34.412   6.610 -14.183
  240   1HD2  LEU  21          1HD2      LEU  21  32.152   5.625 -16.767
  241   2HD2  LEU  21          2HD2      LEU  21  32.925   6.557 -18.074
  242   3HD2  LEU  21          3HD2      LEU  21  33.448   4.888 -17.740
  243    H    ASP  22           HN       ASP  22  34.608   6.705 -20.370
  244    HA   ASP  22           HA       ASP  22  33.453   8.874 -21.637
  245   1HB   ASP  22          2HB       ASP  22  34.069   6.166 -22.226
  246   2HB   ASP  22          3HB       ASP  22  32.345   6.303 -22.510
  247    H    ARG  23           HN       ARG  23  31.225   9.507 -21.858
  248    HA   ARG  23           HA       ARG  23  29.589   8.939 -19.712
  249   1HB   ARG  23          2HB       ARG  23  29.615  10.876 -21.598
  250   2HB   ARG  23          3HB       ARG  23  28.383   9.863 -22.323
  251   1HG   ARG  23          2HG       ARG  23  27.417  11.605 -20.801
  252   2HG   ARG  23          3HG       ARG  23  27.000   9.977 -20.305
  253   1HD   ARG  23          2HD       ARG  23  28.206  10.121 -18.350
  254   2HD   ARG  23          3HD       ARG  23  29.538  10.965 -19.114
  255    HE   ARG  23           HE       ARG  23  27.579  12.887 -19.123
  256   1HH1  ARG  23          2HH2      ARG  23  28.821  10.785 -16.590
  257   2HH1  ARG  23          1HH2      ARG  23  28.483  11.909 -15.316
  258   1HH2  ARG  23          2HH1      ARG  23  27.133  14.370 -17.442
  259   2HH2  ARG  23          1HH1      ARG  23  27.517  13.961 -15.804
  260    H    ASP  24           HN       ASP  24  30.340   7.055 -22.466
  261    HA   ASP  24           HA       ASP  24  27.890   5.526 -22.070
  262   1HB   ASP  24          2HB       ASP  24  28.109   4.812 -24.472
  263   2HB   ASP  24          3HB       ASP  24  27.790   6.525 -24.285
  264    H    GLN  25           HN       GLN  25  30.446   5.283 -20.640
  265    HA   GLN  25           HA       GLN  25  31.284   2.697 -21.693
  266   1HB   GLN  25          2HB       GLN  25  33.019   4.482 -22.075
  267   2HB   GLN  25          3HB       GLN  25  33.096   4.748 -20.344
  268   1HG   GLN  25          2HG       GLN  25  33.836   2.423 -19.972
  269   2HG   GLN  25          3HG       GLN  25  33.634   2.050 -21.672
  270   1HE2  GLN  25          1HE2      GLN  25  35.513   3.737 -19.277
  271   2HE2  GLN  25          2HE2      GLN  25  36.907   4.085 -20.245
  272    H    CYS  26           HN       CYS  26  30.938   1.052 -20.261
  273    HA   CYS  26           HA       CYS  26  29.853   1.570 -17.744
  274   1HB   CYS  26          2HB       CYS  26  29.357  -0.475 -18.979
  275   2HB   CYS  26          3HB       CYS  26  31.031  -0.986 -18.884
  276    H    ALA  27           HN       ALA  27  30.822   1.754 -15.708
  277    HA   ALA  27           HA       ALA  27  33.746   1.787 -15.722
  278   1HB   ALA  27          1HB       ALA  27  33.608   3.396 -14.054
  279   2HB   ALA  27          2HB       ALA  27  32.119   3.737 -14.966
  280   3HB   ALA  27          3HB       ALA  27  32.041   2.796 -13.457
  281    H    TYR  28           HN       TYR  28  32.207  -0.732 -15.754
  282    HA   TYR  28           HA       TYR  28  33.066  -1.732 -13.126
  283   1HB   TYR  28          2HB       TYR  28  30.492  -1.451 -13.669
  284   2HB   TYR  28          3HB       TYR  28  30.724  -2.716 -14.859
  285    HD1  TYR  28           HD1      TYR  28  30.551  -1.946 -11.271
  286    HD2  TYR  28           HD2      TYR  28  31.135  -5.034 -14.174
  287    HE1  TYR  28           HE1      TYR  28  30.178  -3.709  -9.479
  288    HE2  TYR  28           HE2      TYR  28  30.760  -6.788 -12.372
  289    HH   TYR  28           HH       TYR  28  30.257  -7.166 -10.308
  290    H    CYS  29           HN       CYS  29  31.898  -2.934 -16.359
  291    HA   CYS  29           HA       CYS  29  33.904  -5.016 -16.194
  292   1HB   CYS  29          2HB       CYS  29  32.761  -5.960 -18.172
  293   2HB   CYS  29          3HB       CYS  29  31.676  -5.729 -16.815
  294    H    LYS  30           HN       LYS  30  33.276  -1.873 -17.602
  295    HA   LYS  30           HA       LYS  30  34.797  -0.557 -18.627
  296   1HB   LYS  30          2HB       LYS  30  36.504  -2.479 -17.966
  297   2HB   LYS  30          3HB       LYS  30  36.429  -2.837 -19.680
  298   1HG   LYS  30          2HG       LYS  30  37.938  -1.171 -20.000
  299   2HG   LYS  30          3HG       LYS  30  36.659  -0.035 -19.613
  300   1HD   LYS  30          2HD       LYS  30  37.579  -1.008 -17.102
  301   2HD   LYS  30          3HD       LYS  30  39.029  -0.744 -18.052
  302   1HE   LYS  30          2HE       LYS  30  36.890   1.393 -18.072
  303   2HE   LYS  30          3HE       LYS  30  37.909   1.249 -16.655
  304   1HZ   LYS  30          1HZ       LYS  30  39.028   2.684 -18.050
  305   2HZ   LYS  30          2HZ       LYS  30  39.804   1.270 -18.308
  306   3HZ   LYS  30          3HZ       LYS  30  38.723   1.821 -19.402
  307    H    GLU  31           HN       GLU  31  32.357  -2.150 -19.569
  308    HA   GLU  31           HA       GLU  31  32.848  -2.544 -22.336
  309   1HB   GLU  31          2HB       GLU  31  30.432  -2.673 -20.528
  310   2HB   GLU  31          3HB       GLU  31  30.192  -2.643 -22.263
  311   1HG   GLU  31          2HG       GLU  31  32.221  -4.570 -21.118
  312   2HG   GLU  31          3HG       GLU  31  30.518  -4.955 -20.961
  313    H    LYS  32           HN       LYS  32  30.808  -1.441 -23.760
  314    HA   LYS  32           HA       LYS  32  30.764   1.401 -23.102
  315   1HB   LYS  32          2HB       LYS  32  32.658   0.539 -24.811
  316   2HB   LYS  32          3HB       LYS  32  31.333   0.711 -25.943
  317   1HG   LYS  32          2HG       LYS  32  30.951   3.060 -25.064
  318   2HG   LYS  32          3HG       LYS  32  32.369   2.873 -24.051
  319   1HD   LYS  32          2HD       LYS  32  33.801   2.543 -26.035
  320   2HD   LYS  32          3HD       LYS  32  32.402   2.574 -27.090
  321   1HE   LYS  32          2HE       LYS  32  32.101   4.958 -25.692
  322   2HE   LYS  32          3HE       LYS  32  33.845   4.831 -25.801
  323   1HZ   LYS  32          1HZ       LYS  32  32.966   5.926 -27.714
  324   2HZ   LYS  32          2HZ       LYS  32  33.589   4.491 -28.183
  325   3HZ   LYS  32          3HZ       LYS  32  31.972   4.678 -28.059
  326    H    GLY  33           HN       GLY  33  28.641   1.868 -22.933
  327   1HA   GLY  33          1HA       GLY  33  26.773   2.114 -24.709
  328   2HA   GLY  33          2HA       GLY  33  26.750   0.365 -24.606
  329    H    HIS  34           HN       HIS  34  26.987  -0.333 -22.016
  330    HA   HIS  34           HA       HIS  34  24.638   0.921 -20.847
  331   1HB   HIS  34          2HB       HIS  34  24.434  -1.064 -19.512
  332   2HB   HIS  34          3HB       HIS  34  24.650  -1.522 -21.189
  333    HD1  HIS  34           HD1      HIS  34  26.729  -2.904 -21.806
  334    HD2  HIS  34           HD2      HIS  34  26.691  -1.623 -17.812
  335    HE1  HIS  34           HE1      HIS  34  28.611  -4.165 -20.633
  336    H    TRP  35           HN       TRP  35  24.710   0.998 -18.306
  337    HA   TRP  35           HA       TRP  35  27.227   2.342 -17.629
  338   1HB   TRP  35          2HB       TRP  35  24.375   2.714 -16.821
  339   2HB   TRP  35          3HB       TRP  35  25.632   3.130 -15.673
  340    HD1  TRP  35           HD1      TRP  35  25.889   3.797 -19.498
  341    HE1  TRP  35           HE1      TRP  35  26.136   6.379 -19.982
  342    HE3  TRP  35           HE3      TRP  35  25.267   5.293 -14.679
  343    HZ2  TRP  35           HZ2      TRP  35  26.045   8.706 -18.331
  344    HZ3  TRP  35           HZ3      TRP  35  25.361   7.737 -14.200
  345    HH2  TRP  35           HH2      TRP  35  25.734   9.420 -15.932
  346    H    ALA  36           HN       ALA  36  27.996   1.998 -15.334
  347    HA   ALA  36           HA       ALA  36  28.294  -0.713 -14.798
  348   1HB   ALA  36          1HB       ALA  36  29.410   0.051 -12.775
  349   2HB   ALA  36          2HB       ALA  36  29.825   1.149 -14.114
  350   3HB   ALA  36          3HB       ALA  36  28.622   1.642 -12.897
  351    H    LYS  37           HN       LYS  37  25.942   1.729 -13.637
  352    HA   LYS  37           HA       LYS  37  24.893   0.130 -11.568
  353   1HB   LYS  37          2HB       LYS  37  23.939   2.571 -13.061
  354   2HB   LYS  37          3HB       LYS  37  22.908   1.771 -11.891
  355   1HG   LYS  37          2HG       LYS  37  24.969   1.913 -10.277
  356   2HG   LYS  37          3HG       LYS  37  25.615   3.074 -11.420
  357   1HD   LYS  37          2HD       LYS  37  22.857   3.770 -10.919
  358   2HD   LYS  37          3HD       LYS  37  23.631   3.501  -9.370
  359   1HE   LYS  37          2HE       LYS  37  23.921   5.850  -9.988
  360   2HE   LYS  37          3HE       LYS  37  25.486   5.062 -10.043
  361   1HZ   LYS  37          1HZ       LYS  37  23.759   5.713 -12.322
  362   2HZ   LYS  37          2HZ       LYS  37  25.247   6.303 -11.999
  363   3HZ   LYS  37          3HZ       LYS  37  25.067   4.745 -12.455
  364    H    ASP  38           HN       ASP  38  24.821  -0.187 -14.974
  365    HA   ASP  38           HA       ASP  38  22.518  -1.951 -14.690
  366   1HB   ASP  38          2HB       ASP  38  22.455   0.318 -16.187
  367   2HB   ASP  38          3HB       ASP  38  23.173  -0.756 -17.372
  368    H    CYS  39           HN       CYS  39  25.534  -2.325 -14.471
  369    HA   CYS  39           HA       CYS  39  26.495  -3.442 -16.854
  370   1HB   CYS  39          2HB       CYS  39  27.932  -2.631 -14.992
  371   2HB   CYS  39          3HB       CYS  39  27.405  -3.981 -14.007
  372    HA   PRO  40           HA       PRO  40  24.325  -7.234 -16.596
  373   1HB   PRO  40          2HB       PRO  40  25.508  -8.533 -18.689
  374   2HB   PRO  40          3HB       PRO  40  24.188  -7.396 -18.888
  375   1HG   PRO  40          2HG       PRO  40  27.064  -7.019 -19.465
  376   2HG   PRO  40          3HG       PRO  40  25.697  -6.084 -20.038
  377   1HD   PRO  40          2HD       PRO  40  27.539  -5.338 -17.970
  378   2HD   PRO  40          3HD       PRO  40  26.106  -4.459 -18.465
  379    H    LYS  41           HN       LYS  41  27.354  -6.692 -15.601
  380    HA   LYS  41           HA       LYS  41  27.878  -9.524 -15.104
  381   1HB   LYS  41          2HB       LYS  41  29.519  -7.331 -15.815
  382   2HB   LYS  41          3HB       LYS  41  29.941  -7.736 -14.164
  383   1HG   LYS  41          2HG       LYS  41  29.794 -10.255 -15.200
  384   2HG   LYS  41          3HG       LYS  41  30.221  -9.381 -16.658
  385   1HD   LYS  41          2HD       LYS  41  32.379  -9.365 -15.969
  386   2HD   LYS  41          3HD       LYS  41  31.917  -8.317 -14.643
  387   1HE   LYS  41          2HE       LYS  41  32.886 -10.135 -13.505
  388   2HE   LYS  41          3HE       LYS  41  31.182 -10.535 -13.433
  389   1HZ   LYS  41          1HZ       LYS  41  33.104 -12.108 -14.443
  390   2HZ   LYS  41          2HZ       LYS  41  31.505 -12.284 -14.728
  391   3HZ   LYS  41          3HZ       LYS  41  32.442 -11.483 -15.799
  392    H    LYS  42           HN       LYS  42  26.626  -6.620 -13.656
  393    HA   LYS  42           HA       LYS  42  27.360  -7.105 -10.996
  394   1HB   LYS  42          2HB       LYS  42  25.384  -5.403 -12.437
  395   2HB   LYS  42          3HB       LYS  42  25.075  -5.704 -10.738
  396   1HG   LYS  42          2HG       LYS  42  27.301  -4.867 -10.121
  397   2HG   LYS  42          3HG       LYS  42  27.762  -4.725 -11.805
  398   1HD   LYS  42          2HD       LYS  42  27.149  -2.514 -11.269
  399   2HD   LYS  42          3HD       LYS  42  25.693  -3.127 -12.026
  400   1HE   LYS  42          2HE       LYS  42  24.571  -3.409  -9.933
  401   2HE   LYS  42          3HE       LYS  42  26.066  -3.352  -9.019
  402   1HZ   LYS  42          1HZ       LYS  42  26.108  -0.995 -10.217
  403   2HZ   LYS  42          2HZ       LYS  42  24.494  -1.192 -10.055
  404   3HZ   LYS  42          3HZ       LYS  42  25.460  -1.241  -8.738
  405    HA   PRO  43           HA       PRO  43  24.746 -10.387  -9.968
  406   1HB   PRO  43          2HB       PRO  43  24.706 -10.165  -7.245
  407   2HB   PRO  43          3HB       PRO  43  26.024 -10.913  -8.126
  408   1HG   PRO  43          2HG       PRO  43  25.932  -8.257  -6.832
  409   2HG   PRO  43          3HG       PRO  43  27.330  -9.185  -7.334
  410   1HD   PRO  43          2HD       PRO  43  26.203  -6.917  -8.681
  411   2HD   PRO  43          3HD       PRO  43  27.529  -7.917  -9.241
  412    H    ARG  44           HN       ARG  44  23.225  -8.619 -11.149
  413    HA   ARG  44           HA       ARG  44  21.387  -7.412  -9.478
  414   1HB   ARG  44          2HB       ARG  44  21.584  -8.081 -12.390
  415   2HB   ARG  44          3HB       ARG  44  19.955  -7.814 -11.801
  416   1HG   ARG  44          2HG       ARG  44  20.850  -5.638 -10.722
  417   2HG   ARG  44          3HG       ARG  44  22.311  -5.885 -11.659
  418   1HD   ARG  44          2HD       ARG  44  19.585  -5.907 -13.011
  419   2HD   ARG  44          3HD       ARG  44  20.403  -4.393 -12.677
  420    HE   ARG  44           HE       ARG  44  22.046  -4.918 -14.299
  421   1HH1  ARG  44          2HH2      ARG  44  19.934  -7.677 -13.742
  422   2HH1  ARG  44          1HH2      ARG  44  20.504  -8.554 -15.122
  423   1HH2  ARG  44          2HH1      ARG  44  22.799  -6.076 -16.120
  424   2HH2  ARG  44          1HH1      ARG  44  22.145  -7.638 -16.484
  425    H    GLY  45           HN       GLY  45  19.865  -8.363  -8.162
  426   1HA   GLY  45          1HA       GLY  45  17.806  -9.834  -8.514
  427   2HA   GLY  45          2HA       GLY  45  18.980 -11.094  -8.838
  428    HA   PRO  46           HA       PRO  46  17.450 -12.192  -7.960
  429   1HB   PRO  46          2HB       PRO  46  15.479 -13.188  -6.351
  430   2HB   PRO  46          3HB       PRO  46  16.996 -14.018  -6.633
  431   1HG   PRO  46          2HG       PRO  46  16.114 -12.532  -4.235
  432   2HG   PRO  46          3HG       PRO  46  17.410 -13.703  -4.386
  433   1HD   PRO  46          2HD       PRO  46  17.684 -10.852  -4.223
  434   2HD   PRO  46          3HD       PRO  46  18.967 -12.015  -4.491
  435    H    ARG  47           HN       ARG  47  15.521 -11.931  -9.176
  436    HA   ARG  47           HA       ARG  47  14.674  -9.306  -9.088
  437   1HB   ARG  47          2HB       ARG  47  13.732 -11.824 -10.476
  438   2HB   ARG  47          3HB       ARG  47  12.698 -10.411 -10.544
  439   1HG   ARG  47          2HG       ARG  47  14.969  -9.169 -11.224
  440   2HG   ARG  47          3HG       ARG  47  15.476 -10.784 -11.674
  441   1HD   ARG  47          2HD       ARG  47  14.506  -9.983 -13.674
  442   2HD   ARG  47          3HD       ARG  47  13.200 -10.919 -12.975
  443    HE   ARG  47           HE       ARG  47  12.709  -8.451 -11.910
  444   1HH1  ARG  47          2HH2      ARG  47  13.409  -9.470 -15.204
  445   2HH1  ARG  47          1HH2      ARG  47  12.502  -8.187 -15.930
  446   1HH2  ARG  47          2HH1      ARG  47  11.511  -6.756 -12.868
  447   2HH2  ARG  47          1HH1      ARG  47  11.415  -6.632 -14.593
  448    H    GLY  48           HN       GLY  48  12.859  -8.289  -8.150
  449   1HA   GLY  48          1HA       GLY  48  10.635  -9.721  -7.116
  450   2HA   GLY  48          2HA       GLY  48  11.753  -9.315  -5.829
  451    HA   PRO  49           HA       PRO  49   9.165  -5.651  -6.479
  452   1HB   PRO  49          2HB       PRO  49   8.331  -5.334  -3.897
  453   2HB   PRO  49          3HB       PRO  49   7.405  -6.204  -5.102
  454   1HG   PRO  49          2HG       PRO  49   9.003  -7.280  -2.860
  455   2HG   PRO  49          3HG       PRO  49   7.754  -8.074  -3.797
  456   1HD   PRO  49          2HD       PRO  49  10.585  -8.454  -4.043
  457   2HD   PRO  49          3HD       PRO  49   9.341  -9.159  -5.056
  458    H    ARG  50           HN       ARG  50   9.770  -3.531  -6.390
  459    HA   ARG  50           HA       ARG  50  12.339  -3.217  -5.195
  460   1HB   ARG  50          2HB       ARG  50  12.283  -0.968  -6.267
  461   2HB   ARG  50          3HB       ARG  50  11.853  -2.221  -7.415
  462   1HG   ARG  50          2HG       ARG  50   9.440  -1.736  -7.080
  463   2HG   ARG  50          3HG       ARG  50   9.829  -0.535  -5.866
  464   1HD   ARG  50          2HD       ARG  50  11.172  -0.202  -8.530
  465   2HD   ARG  50          3HD       ARG  50   9.443   0.078  -8.497
  466    HE   ARG  50           HE       ARG  50  11.512   1.693  -7.158
  467   1HH1  ARG  50          2HH2      ARG  50   8.083   0.940  -7.390
  468   2HH1  ARG  50          1HH2      ARG  50   7.575   2.437  -6.680
  469   1HH2  ARG  50          2HH1      ARG  50  10.843   3.667  -6.220
  470   2HH2  ARG  50          1HH1      ARG  50   9.156   3.998  -6.009
  471    HA   PRO  51           HA       PRO  51  10.850  -1.256  -1.590
  472   1HB   PRO  51          2HB       PRO  51  13.093   0.064  -0.756
  473   2HB   PRO  51          3HB       PRO  51  12.824  -1.644  -0.471
  474   1HG   PRO  51          2HG       PRO  51  14.626  -0.351  -2.427
  475   2HG   PRO  51          3HG       PRO  51  14.651  -2.000  -1.835
  476   1HD   PRO  51          2HD       PRO  51  13.679  -1.104  -4.381
  477   2HD   PRO  51          3HD       PRO  51  13.598  -2.734  -3.743
  478    H    GLN  52           HN       GLN  52  10.099   0.684  -0.598
  479    HA   GLN  52           HA       GLN  52   9.576   2.594  -2.620
  480   1HB   GLN  52          2HB       GLN  52   8.424   1.823  -0.145
  481   2HB   GLN  52          3HB       GLN  52   8.909   3.494   0.076
  482   1HG   GLN  52          2HG       GLN  52   7.635   4.207  -1.877
  483   2HG   GLN  52          3HG       GLN  52   7.332   2.550  -2.358
  484   1HE2  GLN  52          1HE2      GLN  52   5.632   4.921  -1.534
  485   2HE2  GLN  52          2HE2      GLN  52   4.522   4.304  -0.357
  486    H    THR  53           HN       THR  53  10.009   4.980  -2.349
  487    HA   THR  53           HA       THR  53  12.743   5.332  -1.382
  488    HB   THR  53           HB       THR  53  11.995   5.944  -3.751
  489    HG1  THR  53           HG1      THR  53  12.725   8.150  -1.960
  490   1HG2  THR  53          1HG2      THR  53  10.742   8.022  -4.052
  491   2HG2  THR  53          2HG2      THR  53   9.746   6.949  -3.039
  492   3HG2  THR  53          3HG2      THR  53  10.661   8.282  -2.293
  493    H    SER  54           HN       SER  54  13.285   6.411   0.417
  494    HA   SER  54           HA       SER  54  11.114   7.387   2.001
  495   1HB   SER  54          2HB       SER  54  12.831   7.649   3.763
  496   2HB   SER  54          3HB       SER  54  12.900   6.051   3.047
  497    HG   SER  54           HG       SER  54  15.003   7.263   3.360
  498    H    LEU  55           HN       LEU  55  11.491   9.582   3.219
  499    HA   LEU  55           HA       LEU  55  12.870  11.503   1.510
  500   1HB   LEU  55          2HB       LEU  55  10.022  11.168   1.659
  501   2HB   LEU  55          3HB       LEU  55  10.461  12.720   2.344
  502    HG   LEU  55           HG       LEU  55  11.510  11.854  -0.348
  503   1HD1  LEU  55          1HD1      LEU  55   9.557  12.118  -1.372
  504   2HD1  LEU  55          2HD1      LEU  55   8.785  12.131   0.232
  505   3HD1  LEU  55          3HD1      LEU  55   9.257  13.663  -0.540
  506   1HD2  LEU  55          1HD2      LEU  55  10.914  14.666   0.007
  507   2HD2  LEU  55          2HD2      LEU  55  11.996  14.069   1.289
  508   3HD2  LEU  55          3HD2      LEU  55  12.446  13.865  -0.421
  509    H    LEU  56           HN       LEU  56  14.400  11.154   3.371
  510    HA   LEU  56           HA       LEU  56  13.554  12.006   5.951
  511   1HB   LEU  56          2HB       LEU  56  16.068  11.105   4.655
  512   2HB   LEU  56          3HB       LEU  56  16.230  12.097   6.090
  513    HG   LEU  56           HG       LEU  56  16.316   9.737   6.653
  514   1HD1  LEU  56          1HD1      LEU  56  15.223  10.018   8.589
  515   2HD1  LEU  56          2HD1      LEU  56  14.849  11.638   7.954
  516   3HD1  LEU  56          3HD1      LEU  56  13.664  10.320   7.786
  517   1HD2  LEU  56          1HD2      LEU  56  15.100   8.702   4.898
  518   2HD2  LEU  56          2HD2      LEU  56  14.233   8.336   6.410
  519   3HD2  LEU  56          3HD2      LEU  56  13.612   9.589   5.309
  Start of MODEL    4
    1   1H5*    C 504          1H5*        C 504  32.889  -7.047  -1.627
    2   2H5*    C 504          2H5*        C 504  33.797  -6.227  -2.898
    3    H4*    C 504           H4*        C 504  34.360  -8.667  -2.423
    4    H3*    C 504           H3*        C 504  33.648  -7.930  -5.289
    5    H2*    C 504           H2*        C 504  34.952  -9.829  -5.826
    6   2HO*    C 504          2HO*        C 504  36.483 -10.523  -4.277
    7    H1*    C 504           H1*        C 504  33.895 -11.021  -3.324
    8   1H4     C 504          1H4         C 504  31.961 -15.182  -7.740
    9   2H4     C 504          2H4         C 504  31.010 -13.938  -8.519
   10    H5     C 504           H5         C 504  30.984 -11.678  -7.833
   11    H6     C 504           H6         C 504  31.876 -10.039  -6.216
   12   1H5*    C 505          1H5*        C 505  37.289  -8.042  -5.575
   13   2H5*    C 505          2H5*        C 505  38.329  -6.851  -6.356
   14    H4*    C 505           H4*        C 505  38.613  -8.672  -7.721
   15    H3*    C 505           H3*        C 505  36.423  -6.976  -8.883
   16    H2*    C 505           H2*        C 505  36.172  -8.481 -10.682
   17   2HO*    C 505          2HO*        C 505  38.116  -9.247 -11.265
   18    H1*    C 505           H1*        C 505  36.434 -10.752  -8.929
   19   1H4     C 505          1H4         C 505  30.266 -10.525 -10.615
   20   2H4     C 505          2H4         C 505  29.990  -9.372  -9.329
   21    H5     C 505           H5         C 505  31.711  -8.436  -8.010
   22    H6     C 505           H6         C 505  34.145  -8.376  -7.596
   23   1H5*    U 506          1H5*        U 506  39.424  -2.618  -9.911
   24   2H5*    U 506          2H5*        U 506  38.256  -3.195  -8.721
   25    H4*    U 506           H4*        U 506  37.423  -1.952 -10.832
   26    H3*    U 506           H3*        U 506  36.195  -4.504  -9.771
   27    H2*    U 506           H2*        U 506  34.483  -4.273 -11.350
   28   2HO*    U 506          2HO*        U 506  33.873  -2.186 -11.304
   29    H1*    U 506           H1*        U 506  36.356  -3.130 -13.281
   30    H3     U 506           H3         U 506  36.303  -6.636 -16.091
   31    H5     U 506           H5         U 506  34.711  -8.237 -12.564
   32    H6     U 506           H6         U 506  35.198  -6.089 -11.486
   33   1H5*    C 507          1H5*        C 507  34.651  -0.246 -10.501
   34   2H5*    C 507          2H5*        C 507  34.223   0.001  -8.809
   35    H4*    C 507           H4*        C 507  33.112   1.292 -10.962
   36    H3*    C 507           H3*        C 507  32.318   0.995  -8.097
   37    H2*    C 507           H2*        C 507  30.204   1.996  -8.498
   38   2HO*    C 507          2HO*        C 507  31.128   3.501 -10.005
   39    H1*    C 507           H1*        C 507  29.633   0.394 -10.709
   40   1H4     C 507          1H4         C 507  27.087  -2.542  -5.603
   41   2H4     C 507          2H4         C 507  28.520  -3.541  -5.538
   42    H5     C 507           H5         C 507  30.424  -3.201  -6.894
   43    H6     C 507           H6         C 507  31.430  -1.805  -8.665
   44   1H5*    C 508          1H5*        C 508  35.464   4.805  -6.742
   45   2H5*    C 508          2H5*        C 508  33.851   5.371  -7.174
   46    H4*    C 508           H4*        C 508  35.292   7.250  -7.222
   47    H3*    C 508           H3*        C 508  34.454   6.275  -9.930
   48    H2*    C 508           H2*        C 508  35.655   8.035 -10.977
   49   2HO*    C 508          2HO*        C 508  36.082   8.854  -8.247
   50    H1*    C 508           H1*        C 508  37.943   7.579  -9.340
   51   1H4     C 508          1H4         C 508  39.821   4.324 -14.463
   52   2H4     C 508          2H4         C 508  38.174   3.847 -14.812
   53    H5     C 508           H5         C 508  36.322   4.434 -13.470
   54    H6     C 508           H6         C 508  35.586   5.635 -11.441
   55   1H5*    G 509          1H5*        G 509  33.070   9.911 -10.857
   56   2H5*    G 509          2H5*        G 509  32.123  11.085  -9.944
   57    H4*    G 509           H4*        G 509  31.128  11.347 -11.957
   58    H3*    G 509           H3*        G 509  29.650   9.070 -10.662
   59    H2*    G 509           H2*        G 509  28.249   8.892 -12.562
   60   2HO*    G 509          2HO*        G 509  29.659  11.256 -13.416
   61    H1*    G 509           H1*        G 509  30.455   9.136 -14.354
   62    H8     G 509           H8         G 509  29.989   6.882 -11.274
   63    H1     G 509           H1         G 509  29.855   3.872 -17.002
   64   1H2     G 509          1H2         G 509  30.079   5.257 -18.513
   65   2H2     G 509          2H2         G 509  30.273   6.977 -18.266
   66   1H5*    U 510          1H5*        U 510  25.822   8.633 -11.457
   67   2H5*    U 510          2H5*        U 510  25.991  10.389 -11.489
   68    H4*    U 510           H4*        U 510  25.160   9.637  -8.866
   69    H3*    U 510           H3*        U 510  23.859   8.013 -10.975
   70    H2*    U 510           H2*        U 510  21.658   8.557 -10.268
   71   2HO*    U 510          2HO*        U 510  23.059   9.982  -8.192
   72    H1*    U 510           H1*        U 510  22.049  11.278 -10.265
   73    H3     U 510           H3         U 510  19.786  10.529 -14.131
   74    H5     U 510           H5         U 510  23.739   9.493 -15.044
   75    H6     U 510           H6         U 510  24.259   9.775 -12.665
   76   1H    ALA   1           HN       ALA   1  55.039 -32.932 -22.892
   77    HA   ALA   1           HA       ALA   1  53.878 -31.790 -24.875
   78   1HB   ALA   1          1HB       ALA   1  52.587 -33.821 -25.437
   79   2HB   ALA   1          2HB       ALA   1  51.764 -33.734 -23.861
   80   3HB   ALA   1          3HB       ALA   1  51.509 -32.453 -25.069
   81    H    THR   2           HN       THR   2  53.234 -29.790 -24.172
   82    HA   THR   2           HA       THR   2  51.950 -29.590 -21.563
   83    HB   THR   2           HB       THR   2  54.589 -28.223 -22.309
   84    HG1  THR   2           HG1      THR   2  55.193 -29.589 -20.396
   85   1HG2  THR   2          1HG2      THR   2  53.841 -28.142 -19.501
   86   2HG2  THR   2          2HG2      THR   2  54.206 -26.777 -20.584
   87   3HG2  THR   2          3HG2      THR   2  52.544 -27.402 -20.470
   88    H    VAL   3           HN       VAL   3  50.469 -27.966 -21.430
   89    HA   VAL   3           HA       VAL   3  49.422 -26.907 -23.716
   90    HB   VAL   3           HB       VAL   3  49.366 -25.911 -20.865
   91   1HG1  VAL   3          1HG1      VAL   3  48.577 -24.007 -21.835
   92   2HG1  VAL   3          2HG1      VAL   3  48.090 -24.836 -23.333
   93   3HG1  VAL   3          3HG1      VAL   3  47.068 -24.951 -21.880
   94   1HG2  VAL   3          1HG2      VAL   3  47.716 -27.396 -20.477
   95   2HG2  VAL   3          2HG2      VAL   3  46.967 -27.133 -22.070
   96   3HG2  VAL   3          3HG2      VAL   3  48.357 -28.234 -21.910
   97    H    VAL   4           HN       VAL   4  49.621 -24.964 -24.878
   98    HA   VAL   4           HA       VAL   4  52.156 -23.924 -25.139
   99    HB   VAL   4           HB       VAL   4  51.066 -22.159 -26.445
  100   1HG1  VAL   4          1HG1      VAL   4  51.088 -23.733 -28.025
  101   2HG1  VAL   4          2HG1      VAL   4  50.770 -25.010 -26.826
  102   3HG1  VAL   4          3HG1      VAL   4  49.412 -24.141 -27.581
  103   1HG2  VAL   4          1HG2      VAL   4  48.397 -22.740 -26.577
  104   2HG2  VAL   4          2HG2      VAL   4  48.723 -22.976 -24.843
  105   3HG2  VAL   4          3HG2      VAL   4  49.102 -21.418 -25.616
  106    H    SER   5           HN       SER   5  52.568 -21.389 -24.910
  107    HA   SER   5           HA       SER   5  51.860 -20.770 -22.149
  108   1HB   SER   5          2HB       SER   5  54.411 -20.752 -23.605
  109   2HB   SER   5          3HB       SER   5  54.094 -19.202 -22.850
  110    HG   SER   5           HG       SER   5  54.362 -21.787 -21.622
  111    H    GLY   6           HN       GLY   6  51.169 -18.619 -21.654
  112   1HA   GLY   6          1HA       GLY   6  50.518 -16.989 -24.034
  113   2HA   GLY   6          2HA       GLY   6  49.542 -17.091 -22.582
  114    H    GLN   7           HN       GLN   7  50.833 -14.715 -23.916
  115    HA   GLN   7           HA       GLN   7  52.819 -13.992 -21.944
  116   1HB   GLN   7          2HB       GLN   7  52.038 -13.027 -24.665
  117   2HB   GLN   7          3HB       GLN   7  52.636 -11.802 -23.563
  118   1HG   GLN   7          2HG       GLN   7  54.701 -13.097 -23.169
  119   2HG   GLN   7          3HG       GLN   7  54.094 -14.423 -24.141
  120   1HE2  GLN   7          1HE2      GLN   7  56.240 -12.080 -24.188
  121   2HE2  GLN   7          2HE2      GLN   7  56.272 -11.615 -25.857
  122    H    LYS   8           HN       LYS   8  52.662 -11.678 -21.012
  123    HA   LYS   8           HA       LYS   8  49.868 -10.905 -20.619
  124   1HB   LYS   8          2HB       LYS   8  51.151 -12.376 -18.729
  125   2HB   LYS   8          3HB       LYS   8  51.616 -10.763 -18.226
  126   1HG   LYS   8          2HG       LYS   8  49.581 -10.999 -17.099
  127   2HG   LYS   8          3HG       LYS   8  49.048 -10.198 -18.562
  128   1HD   LYS   8          2HD       LYS   8  48.638 -12.551 -19.548
  129   2HD   LYS   8          3HD       LYS   8  48.895 -13.177 -17.931
  130   1HE   LYS   8          2HE       LYS   8  47.084 -11.401 -17.204
  131   2HE   LYS   8          3HE       LYS   8  46.676 -11.347 -18.908
  132   1HZ   LYS   8          1HZ       LYS   8  45.368 -12.986 -17.825
  133   2HZ   LYS   8          2HZ       LYS   8  46.406 -13.763 -18.816
  134   3HZ   LYS   8          3HZ       LYS   8  46.675 -13.741 -17.205
  135    H    GLN   9           HN       GLN   9  49.539  -8.666 -20.319
  136    HA   GLN   9           HA       GLN   9  51.934  -7.120 -20.929
  137   1HB   GLN   9          2HB       GLN   9  49.381  -7.192 -22.163
  138   2HB   GLN   9          3HB       GLN   9  49.425  -5.670 -21.295
  139   1HG   GLN   9          2HG       GLN   9  50.663  -4.821 -22.995
  140   2HG   GLN   9          3HG       GLN   9  51.982  -5.849 -22.472
  141   1HE2  GLN   9          1HE2      GLN   9  51.319  -4.979 -25.133
  142   2HE2  GLN   9          2HE2      GLN   9  51.040  -6.384 -26.106
  143    H    ASP  10           HN       ASP  10  51.934  -4.819 -19.999
  144    HA   ASP  10           HA       ASP  10  50.350  -4.527 -17.631
  145   1HB   ASP  10          2HB       ASP  10  52.884  -5.698 -17.399
  146   2HB   ASP  10          3HB       ASP  10  53.211  -4.009 -17.067
  147    H    ARG  11           HN       ARG  11  49.907  -2.306 -17.397
  148    HA   ARG  11           HA       ARG  11  51.676  -0.527 -18.875
  149   1HB   ARG  11          2HB       ARG  11  49.318  -0.824 -19.828
  150   2HB   ARG  11          3HB       ARG  11  48.690  -0.113 -18.355
  151   1HG   ARG  11          2HG       ARG  11  49.955   1.975 -18.783
  152   2HG   ARG  11          3HG       ARG  11  50.691   1.266 -20.206
  153   1HD   ARG  11          2HD       ARG  11  47.667   1.369 -19.991
  154   2HD   ARG  11          3HD       ARG  11  48.548   2.811 -20.458
  155    HE   ARG  11           HE       ARG  11  49.195   1.765 -22.493
  156   1HH1  ARG  11          2HH2      ARG  11  47.487  -0.488 -20.398
  157   2HH1  ARG  11          1HH2      ARG  11  47.250  -1.666 -21.645
  158   1HH2  ARG  11          2HH1      ARG  11  48.882   0.211 -24.138
  159   2HH2  ARG  11          1HH1      ARG  11  48.050  -1.266 -23.787
  160    H    GLN  12           HN       GLN  12  52.753   0.907 -17.554
  161    HA   GLN  12           HA       GLN  12  52.354   0.978 -14.845
  162   1HB   GLN  12          2HB       GLN  12  54.308   1.848 -16.461
  163   2HB   GLN  12          3HB       GLN  12  53.501   3.388 -16.243
  164   1HG   GLN  12          2HG       GLN  12  54.698   3.575 -14.317
  165   2HG   GLN  12          3HG       GLN  12  53.575   2.413 -13.640
  166   1HE2  GLN  12          1HE2      GLN  12  54.271   0.494 -13.005
  167   2HE2  GLN  12          2HE2      GLN  12  55.853  -0.164 -13.263
  168    H    GLY  13           HN       GLY  13  51.347   3.400 -17.363
  169   1HA   GLY  13          1HA       GLY  13  48.874   3.996 -16.727
  170   2HA   GLY  13          2HA       GLY  13  49.684   4.757 -15.372
  171    H    GLY  14           HN       GLY  14  51.713   6.172 -16.059
  172   1HA   GLY  14          1HA       GLY  14  52.647   7.749 -17.427
  173   2HA   GLY  14          2HA       GLY  14  51.471   7.392 -18.675
  174    H    GLU  15           HN       GLU  15  49.637   8.672 -18.900
  175    HA   GLU  15           HA       GLU  15  49.086  10.495 -16.707
  176   1HB   GLU  15          2HB       GLU  15  50.515  11.522 -18.638
  177   2HB   GLU  15          3HB       GLU  15  49.043  11.455 -19.586
  178   1HG   GLU  15          2HG       GLU  15  49.067  13.641 -18.604
  179   2HG   GLU  15          3HG       GLU  15  47.879  12.733 -17.689
  180    H    ARG  16           HN       ARG  16  47.142   9.539 -16.096
  181    HA   ARG  16           HA       ARG  16  45.031   9.840 -18.011
  182   1HB   ARG  16          2HB       ARG  16  44.172   7.466 -17.379
  183   2HB   ARG  16          3HB       ARG  16  45.500   7.557 -18.521
  184   1HG   ARG  16          2HG       ARG  16  47.072   6.764 -16.984
  185   2HG   ARG  16          3HG       ARG  16  46.215   7.413 -15.600
  186   1HD   ARG  16          2HD       ARG  16  44.645   5.618 -15.564
  187   2HD   ARG  16          3HD       ARG  16  44.973   5.169 -17.225
  188    HE   ARG  16           HE       ARG  16  47.397   4.893 -15.729
  189   1HH1  ARG  16          2HH2      ARG  16  44.227   3.391 -16.022
  190   2HH1  ARG  16          1HH2      ARG  16  44.778   1.831 -15.509
  191   1HH2  ARG  16          2HH1      ARG  16  48.123   2.835 -15.051
  192   2HH2  ARG  16          1HH1      ARG  16  47.008   1.512 -14.953
  193    H    ARG  17           HN       ARG  17  43.016  10.271 -16.980
  194    HA   ARG  17           HA       ARG  17  43.274  10.760 -14.170
  195   1HB   ARG  17          2HB       ARG  17  42.016  12.123 -16.211
  196   2HB   ARG  17          3HB       ARG  17  40.655  11.253 -15.534
  197   1HG   ARG  17          2HG       ARG  17  40.774  12.363 -13.481
  198   2HG   ARG  17          3HG       ARG  17  42.505  12.618 -13.593
  199   1HD   ARG  17          2HD       ARG  17  42.261  14.466 -15.096
  200   2HD   ARG  17          3HD       ARG  17  40.618  14.026 -15.517
  201    HE   ARG  17           HE       ARG  17  39.846  15.127 -13.594
  202   1HH1  ARG  17          2HH2      ARG  17  43.319  14.627 -13.335
  203   2HH1  ARG  17          1HH2      ARG  17  43.482  15.601 -11.912
  204   1HH2  ARG  17          2HH1      ARG  17  40.060  16.413 -11.718
  205   2HH2  ARG  17          1HH1      ARG  17  41.615  16.623 -10.987
  206    H    ARG  18           HN       ARG  18  40.597   9.378 -16.228
  207    HA   ARG  18           HA       ARG  18  40.358   7.286 -14.228
  208   1HB   ARG  18          2HB       ARG  18  38.128   8.983 -15.436
  209   2HB   ARG  18          3HB       ARG  18  37.802   7.442 -14.671
  210   1HG   ARG  18          2HG       ARG  18  38.585   8.207 -12.531
  211   2HG   ARG  18          3HG       ARG  18  39.386   9.601 -13.228
  212   1HD   ARG  18          2HD       ARG  18  36.419   9.379 -13.683
  213   2HD   ARG  18          3HD       ARG  18  36.941   9.758 -12.054
  214    HE   ARG  18           HE       ARG  18  38.430  11.528 -13.509
  215   1HH1  ARG  18          2HH2      ARG  18  35.007  10.722 -13.616
  216   2HH1  ARG  18          1HH2      ARG  18  34.522  12.297 -14.148
  217   1HH2  ARG  18          2HH1      ARG  18  37.791  13.607 -14.212
  218   2HH2  ARG  18          1HH1      ARG  18  36.116  13.948 -14.489
  219    H    SER  19           HN       SER  19  41.834   6.858 -16.505
  220    HA   SER  19           HA       SER  19  42.011   5.769 -18.387
  221   1HB   SER  19          2HB       SER  19  40.045   4.186 -16.767
  222   2HB   SER  19          3HB       SER  19  40.249   3.701 -18.438
  223    HG   SER  19           HG       SER  19  42.005   2.678 -17.781
  224    H    GLN  20           HN       GLN  20  40.524   8.100 -18.777
  225    HA   GLN  20           HA       GLN  20  39.032   9.092 -20.019
  226   1HB   GLN  20          2HB       GLN  20  40.259   6.989 -21.652
  227   2HB   GLN  20          3HB       GLN  20  38.670   7.412 -22.257
  228   1HG   GLN  20          2HG       GLN  20  39.751   9.134 -23.302
  229   2HG   GLN  20          3HG       GLN  20  39.684   9.919 -21.737
  230   1HE2  GLN  20          1HE2      GLN  20  41.610  10.623 -23.474
  231   2HE2  GLN  20          2HE2      GLN  20  43.172  10.076 -22.964
  232    H    LEU  21           HN       LEU  21  37.767   7.724 -17.970
  233    HA   LEU  21           HA       LEU  21  35.879   5.852 -18.627
  234   1HB   LEU  21          2HB       LEU  21  36.612   7.154 -16.393
  235   2HB   LEU  21          3HB       LEU  21  35.103   7.985 -16.717
  236    HG   LEU  21           HG       LEU  21  35.537   5.048 -16.165
  237   1HD1  LEU  21          1HD1      LEU  21  33.563   5.742 -14.529
  238   2HD1  LEU  21          2HD1      LEU  21  35.274   6.008 -14.114
  239   3HD1  LEU  21          3HD1      LEU  21  34.290   7.353 -14.738
  240   1HD2  LEU  21          1HD2      LEU  21  32.830   6.157 -16.857
  241   2HD2  LEU  21          2HD2      LEU  21  33.927   5.580 -18.134
  242   3HD2  LEU  21          3HD2      LEU  21  33.400   4.470 -16.846
  243    H    ASP  22           HN       ASP  22  34.754   6.006 -20.536
  244    HA   ASP  22           HA       ASP  22  33.871   8.361 -21.627
  245   1HB   ASP  22          2HB       ASP  22  33.836   5.665 -22.309
  246   2HB   ASP  22          3HB       ASP  22  32.129   5.995 -22.095
  247    H    ARG  23           HN       ARG  23  31.769   9.420 -21.576
  248    HA   ARG  23           HA       ARG  23  30.486   9.293 -19.122
  249   1HB   ARG  23          2HB       ARG  23  30.125  10.734 -21.714
  250   2HB   ARG  23          3HB       ARG  23  28.660  10.572 -20.766
  251   1HG   ARG  23          2HG       ARG  23  31.294  11.817 -19.858
  252   2HG   ARG  23          3HG       ARG  23  29.779  12.653 -20.134
  253   1HD   ARG  23          2HD       ARG  23  29.127  10.601 -18.291
  254   2HD   ARG  23          3HD       ARG  23  30.682  11.200 -17.749
  255    HE   ARG  23           HE       ARG  23  29.067  13.463 -18.362
  256   1HH1  ARG  23          2HH2      ARG  23  29.161  10.823 -16.038
  257   2HH1  ARG  23          1HH2      ARG  23  28.356  11.719 -14.794
  258   1HH2  ARG  23          2HH1      ARG  23  28.005  14.647 -16.722
  259   2HH2  ARG  23          1HH1      ARG  23  27.694  13.910 -15.185
  260    H    ASP  24           HN       ASP  24  30.337   7.191 -21.788
  261    HA   ASP  24           HA       ASP  24  27.766   6.210 -20.852
  262   1HB   ASP  24          2HB       ASP  24  28.252   7.341 -23.399
  263   2HB   ASP  24          3HB       ASP  24  28.293   5.612 -23.684
  264    H    GLN  25           HN       GLN  25  30.655   5.529 -20.288
  265    HA   GLN  25           HA       GLN  25  30.703   2.873 -21.494
  266   1HB   GLN  25          2HB       GLN  25  32.654   4.060 -22.223
  267   2HB   GLN  25          3HB       GLN  25  32.952   4.722 -20.628
  268   1HG   GLN  25          2HG       GLN  25  34.007   2.820 -19.885
  269   2HG   GLN  25          3HG       GLN  25  32.873   1.752 -20.688
  270   1HE2  GLN  25          1HE2      GLN  25  35.599   1.301 -20.632
  271   2HE2  GLN  25          2HE2      GLN  25  36.263   1.429 -22.227
  272    H    CYS  26           HN       CYS  26  30.504   1.132 -20.129
  273    HA   CYS  26           HA       CYS  26  29.761   1.468 -17.510
  274   1HB   CYS  26          2HB       CYS  26  29.259  -0.546 -18.810
  275   2HB   CYS  26          3HB       CYS  26  30.954  -0.987 -18.837
  276    H    ALA  27           HN       ALA  27  30.897   1.682 -15.576
  277    HA   ALA  27           HA       ALA  27  33.812   1.772 -15.834
  278   1HB   ALA  27          1HB       ALA  27  32.786   3.829 -15.056
  279   2HB   ALA  27          2HB       ALA  27  31.870   2.951 -13.809
  280   3HB   ALA  27          3HB       ALA  27  33.641   3.073 -13.690
  281    H    TYR  28           HN       TYR  28  32.319  -0.768 -15.738
  282    HA   TYR  28           HA       TYR  28  33.395  -1.748 -13.184
  283   1HB   TYR  28          2HB       TYR  28  30.775  -1.505 -13.554
  284   2HB   TYR  28          3HB       TYR  28  30.951  -2.800 -14.720
  285    HD1  TYR  28           HD1      TYR  28  30.582  -1.968 -11.242
  286    HD2  TYR  28           HD2      TYR  28  31.886  -5.046 -13.912
  287    HE1  TYR  28           HE1      TYR  28  30.373  -3.685  -9.377
  288    HE2  TYR  28           HE2      TYR  28  31.673  -6.752 -12.039
  289    HH   TYR  28           HH       TYR  28  31.712  -6.165  -9.056
  290    H    CYS  29           HN       CYS  29  32.016  -2.951 -16.333
  291    HA   CYS  29           HA       CYS  29  34.097  -4.979 -16.325
  292   1HB   CYS  29          2HB       CYS  29  32.794  -6.069 -18.079
  293   2HB   CYS  29          3HB       CYS  29  31.793  -5.740 -16.678
  294    H    LYS  30           HN       LYS  30  33.365  -1.838 -17.532
  295    HA   LYS  30           HA       LYS  30  34.598  -0.498 -18.816
  296   1HB   LYS  30          2HB       LYS  30  36.380  -2.651 -18.450
  297   2HB   LYS  30          3HB       LYS  30  36.371  -2.343 -20.175
  298   1HG   LYS  30          2HG       LYS  30  37.875  -0.694 -19.666
  299   2HG   LYS  30          3HG       LYS  30  36.456   0.235 -19.227
  300   1HD   LYS  30          2HD       LYS  30  36.886  -1.209 -16.905
  301   2HD   LYS  30          3HD       LYS  30  38.528  -0.995 -17.478
  302   1HE   LYS  30          2HE       LYS  30  37.827   0.879 -15.989
  303   2HE   LYS  30          3HE       LYS  30  38.222   1.450 -17.599
  304   1HZ   LYS  30          1HZ       LYS  30  35.470   0.743 -16.936
  305   2HZ   LYS  30          2HZ       LYS  30  36.064   2.208 -16.525
  306   3HZ   LYS  30          3HZ       LYS  30  36.014   1.757 -18.094
  307    H    GLU  31           HN       GLU  31  32.193  -2.233 -19.508
  308    HA   GLU  31           HA       GLU  31  32.535  -2.531 -22.349
  309   1HB   GLU  31          2HB       GLU  31  31.314  -4.266 -21.080
  310   2HB   GLU  31          3HB       GLU  31  30.150  -3.078 -20.528
  311   1HG   GLU  31          2HG       GLU  31  29.023  -3.052 -22.529
  312   2HG   GLU  31          3HG       GLU  31  30.494  -3.121 -23.478
  313    H    LYS  32           HN       LYS  32  32.007  -0.967 -23.819
  314    HA   LYS  32           HA       LYS  32  30.745   1.431 -22.816
  315   1HB   LYS  32          2HB       LYS  32  32.691   1.751 -24.159
  316   2HB   LYS  32          3HB       LYS  32  32.092   0.694 -25.421
  317   1HG   LYS  32          2HG       LYS  32  30.065   2.379 -25.545
  318   2HG   LYS  32          3HG       LYS  32  31.123   3.472 -24.675
  319   1HD   LYS  32          2HD       LYS  32  32.733   3.520 -26.440
  320   2HD   LYS  32          3HD       LYS  32  32.106   2.060 -27.178
  321   1HE   LYS  32          2HE       LYS  32  29.974   4.030 -27.037
  322   2HE   LYS  32          3HE       LYS  32  31.385   4.773 -27.763
  323   1HZ   LYS  32          1HZ       LYS  32  31.307   2.380 -28.954
  324   2HZ   LYS  32          2HZ       LYS  32  29.715   2.704 -28.786
  325   3HZ   LYS  32          3HZ       LYS  32  30.681   3.751 -29.583
  326    H    GLY  33           HN       GLY  33  28.618   1.900 -22.996
  327   1HA   GLY  33          1HA       GLY  33  26.841   1.847 -24.835
  328   2HA   GLY  33          2HA       GLY  33  26.992   0.107 -24.680
  329    H    HIS  34           HN       HIS  34  27.417  -0.103 -21.839
  330    HA   HIS  34           HA       HIS  34  24.847   0.922 -20.873
  331   1HB   HIS  34          2HB       HIS  34  24.512  -1.096 -19.646
  332   2HB   HIS  34          3HB       HIS  34  24.854  -1.523 -21.310
  333    HD1  HIS  34           HD1      HIS  34  26.811  -3.079 -21.744
  334    HD2  HIS  34           HD2      HIS  34  26.760  -1.575 -17.829
  335    HE1  HIS  34           HE1      HIS  34  28.613  -4.355 -20.465
  336    H    TRP  35           HN       TRP  35  24.754   1.354 -18.515
  337    HA   TRP  35           HA       TRP  35  27.285   2.477 -17.651
  338   1HB   TRP  35          2HB       TRP  35  24.425   2.935 -17.099
  339   2HB   TRP  35          3HB       TRP  35  25.481   3.097 -15.709
  340    HD1  TRP  35           HD1      TRP  35  25.940   4.331 -19.405
  341    HE1  TRP  35           HE1      TRP  35  26.610   6.883 -19.442
  342    HE3  TRP  35           HE3      TRP  35  25.784   4.984 -14.365
  343    HZ2  TRP  35           HZ2      TRP  35  26.992   8.844 -17.405
  344    HZ3  TRP  35           HZ3      TRP  35  26.319   7.248 -13.471
  345    HH2  TRP  35           HH2      TRP  35  26.907   9.141 -14.902
  346    H    ALA  36           HN       ALA  36  27.998   2.087 -15.349
  347    HA   ALA  36           HA       ALA  36  28.269  -0.635 -14.854
  348   1HB   ALA  36          1HB       ALA  36  29.134   0.204 -12.615
  349   2HB   ALA  36          2HB       ALA  36  29.897   0.935 -14.047
  350   3HB   ALA  36          3HB       ALA  36  28.666   1.841 -13.136
  351    H    LYS  37           HN       LYS  37  25.906   1.802 -13.701
  352    HA   LYS  37           HA       LYS  37  24.801   0.202 -11.676
  353   1HB   LYS  37          2HB       LYS  37  23.963   2.662 -13.176
  354   2HB   LYS  37          3HB       LYS  37  22.788   1.834 -12.176
  355   1HG   LYS  37          2HG       LYS  37  23.729   3.306 -10.620
  356   2HG   LYS  37          3HG       LYS  37  24.695   1.871 -10.340
  357   1HD   LYS  37          2HD       LYS  37  25.852   3.456 -12.508
  358   2HD   LYS  37          3HD       LYS  37  25.625   4.456 -11.086
  359   1HE   LYS  37          2HE       LYS  37  26.977   1.720 -10.994
  360   2HE   LYS  37          3HE       LYS  37  27.864   3.215 -11.216
  361   1HZ   LYS  37          1HZ       LYS  37  26.545   3.901  -9.118
  362   2HZ   LYS  37          2HZ       LYS  37  26.415   2.291  -8.875
  363   3HZ   LYS  37          3HZ       LYS  37  27.891   2.986  -8.973
  364    H    ASP  38           HN       ASP  38  24.827  -0.143 -15.079
  365    HA   ASP  38           HA       ASP  38  22.518  -1.909 -14.851
  366   1HB   ASP  38          2HB       ASP  38  22.515   0.325 -16.389
  367   2HB   ASP  38          3HB       ASP  38  23.300  -0.758 -17.521
  368    H    CYS  39           HN       CYS  39  25.520  -2.291 -14.494
  369    HA   CYS  39           HA       CYS  39  26.557  -3.475 -16.819
  370   1HB   CYS  39          2HB       CYS  39  27.946  -2.590 -14.958
  371   2HB   CYS  39          3HB       CYS  39  27.394  -3.897 -13.931
  372    HA   PRO  40           HA       PRO  40  24.329  -7.233 -16.448
  373   1HB   PRO  40          2HB       PRO  40  25.413  -8.541 -18.589
  374   2HB   PRO  40          3HB       PRO  40  24.085  -7.407 -18.732
  375   1HG   PRO  40          2HG       PRO  40  26.929  -7.030 -19.445
  376   2HG   PRO  40          3HG       PRO  40  25.536  -6.099 -19.957
  377   1HD   PRO  40          2HD       PRO  40  27.474  -5.343 -17.982
  378   2HD   PRO  40          3HD       PRO  40  26.019  -4.467 -18.412
  379    H    LYS  41           HN       LYS  41  27.675  -6.858 -16.144
  380    HA   LYS  41           HA       LYS  41  28.068  -9.630 -15.427
  381   1HB   LYS  41          2HB       LYS  41  29.693  -7.937 -16.663
  382   2HB   LYS  41          3HB       LYS  41  30.141  -7.504 -15.026
  383   1HG   LYS  41          2HG       LYS  41  30.061 -10.327 -14.988
  384   2HG   LYS  41          3HG       LYS  41  30.772  -9.942 -16.543
  385   1HD   LYS  41          2HD       LYS  41  32.742  -9.627 -15.458
  386   2HD   LYS  41          3HD       LYS  41  32.055  -8.157 -14.795
  387   1HE   LYS  41          2HE       LYS  41  31.634 -10.882 -13.490
  388   2HE   LYS  41          3HE       LYS  41  32.997  -9.854 -13.093
  389   1HZ   LYS  41          1HZ       LYS  41  30.819  -8.228 -12.968
  390   2HZ   LYS  41          2HZ       LYS  41  30.315  -9.619 -12.277
  391   3HZ   LYS  41          3HZ       LYS  41  31.636  -8.852 -11.700
  392    H    LYS  42           HN       LYS  42  26.824  -6.818 -13.970
  393    HA   LYS  42           HA       LYS  42  27.947  -7.132 -11.388
  394   1HB   LYS  42          2HB       LYS  42  26.216  -5.309 -12.754
  395   2HB   LYS  42          3HB       LYS  42  25.411  -5.821 -11.284
  396   1HG   LYS  42          2HG       LYS  42  27.925  -5.433 -10.292
  397   2HG   LYS  42          3HG       LYS  42  27.966  -4.286 -11.618
  398   1HD   LYS  42          2HD       LYS  42  25.463  -4.213 -10.000
  399   2HD   LYS  42          3HD       LYS  42  26.908  -3.758  -9.120
  400   1HE   LYS  42          2HE       LYS  42  27.318  -2.344 -11.430
  401   2HE   LYS  42          3HE       LYS  42  25.566  -2.374 -11.413
  402   1HZ   LYS  42          1HZ       LYS  42  26.991  -0.622 -10.076
  403   2HZ   LYS  42          2HZ       LYS  42  25.502  -1.091  -9.599
  404   3HZ   LYS  42          3HZ       LYS  42  26.826  -1.748  -8.904
  405    HA   PRO  43           HA       PRO  43  25.466 -10.313  -9.857
  406   1HB   PRO  43          2HB       PRO  43  25.460  -9.786  -7.175
  407   2HB   PRO  43          3HB       PRO  43  26.798 -10.565  -7.996
  408   1HG   PRO  43          2HG       PRO  43  26.594  -7.786  -7.008
  409   2HG   PRO  43          3HG       PRO  43  28.029  -8.698  -7.434
  410   1HD   PRO  43          2HD       PRO  43  26.765  -6.654  -9.001
  411   2HD   PRO  43          3HD       PRO  43  28.131  -7.646  -9.476
  412    H    ARG  44           HN       ARG  44  23.680  -9.318 -11.178
  413    HA   ARG  44           HA       ARG  44  21.474  -9.207  -9.436
  414   1HB   ARG  44          2HB       ARG  44  22.709  -6.687 -10.216
  415   2HB   ARG  44          3HB       ARG  44  21.114  -6.786 -10.937
  416   1HG   ARG  44          2HG       ARG  44  20.121  -7.292  -8.709
  417   2HG   ARG  44          3HG       ARG  44  21.712  -7.250  -7.976
  418   1HD   ARG  44          2HD       ARG  44  21.957  -4.891  -8.363
  419   2HD   ARG  44          3HD       ARG  44  20.652  -4.858  -9.532
  420    HE   ARG  44           HE       ARG  44  19.764  -5.754  -6.896
  421   1HH1  ARG  44          2HH2      ARG  44  20.430  -2.923  -8.879
  422   2HH1  ARG  44          1HH2      ARG  44  19.375  -1.887  -7.978
  423   1HH2  ARG  44          2HH1      ARG  44  18.372  -4.386  -5.707
  424   2HH2  ARG  44          1HH1      ARG  44  18.197  -2.724  -6.162
  425    H    GLY  45           HN       GLY  45  20.619 -10.893 -10.733
  426   1HA   GLY  45          1HA       GLY  45  19.780 -10.067 -13.433
  427   2HA   GLY  45          2HA       GLY  45  20.627 -11.585 -13.207
  428    HA   PRO  46           HA       PRO  46  19.364 -12.057 -14.793
  429   1HB   PRO  46          2HB       PRO  46  17.258 -12.438 -16.490
  430   2HB   PRO  46          3HB       PRO  46  18.147 -13.757 -15.756
  431   1HG   PRO  46          2HG       PRO  46  15.461 -12.728 -15.076
  432   2HG   PRO  46          3HG       PRO  46  16.182 -14.272 -14.665
  433   1HD   PRO  46          2HD       PRO  46  15.854 -12.013 -12.927
  434   2HD   PRO  46          3HD       PRO  46  16.677 -13.514 -12.551
  435    H    ARG  47           HN       ARG  47  16.465 -10.225 -14.153
  436    HA   ARG  47           HA       ARG  47  15.798  -8.282 -14.871
  437   1HB   ARG  47          2HB       ARG  47  18.301  -7.982 -13.622
  438   2HB   ARG  47          3HB       ARG  47  18.465  -7.013 -15.073
  439   1HG   ARG  47          2HG       ARG  47  15.974  -6.214 -14.287
  440   2HG   ARG  47          3HG       ARG  47  16.645  -6.625 -12.721
  441   1HD   ARG  47          2HD       ARG  47  17.849  -4.701 -12.695
  442   2HD   ARG  47          3HD       ARG  47  18.658  -5.152 -14.182
  443    HE   ARG  47           HE       ARG  47  15.948  -4.146 -14.630
  444   1HH1  ARG  47          2HH2      ARG  47  19.314  -3.223 -14.187
  445   2HH1  ARG  47          1HH2      ARG  47  19.138  -1.704 -15.001
  446   1HH2  ARG  47          2HH1      ARG  47  15.714  -2.143 -15.704
  447   2HH2  ARG  47          1HH1      ARG  47  17.076  -1.085 -15.870
  448    H    GLY  48           HN       GLY  48  15.075  -8.697 -17.023
  449   1HA   GLY  48          1HA       GLY  48  17.052  -8.197 -19.163
  450   2HA   GLY  48          2HA       GLY  48  15.618  -9.193 -19.311
  451    HA   PRO  49           HA       PRO  49  14.742  -4.730 -20.363
  452   1HB   PRO  49          2HB       PRO  49  15.239  -4.615 -23.048
  453   2HB   PRO  49          3HB       PRO  49  16.373  -4.049 -21.837
  454   1HG   PRO  49          2HG       PRO  49  16.472  -6.519 -23.457
  455   2HG   PRO  49          3HG       PRO  49  17.766  -5.731 -22.577
  456   1HD   PRO  49          2HD       PRO  49  16.335  -8.086 -21.781
  457   2HD   PRO  49          3HD       PRO  49  17.548  -7.231 -20.849
  458    H    ARG  50           HN       ARG  50  12.611  -4.965 -19.918
  459    HA   ARG  50           HA       ARG  50  11.182  -6.277 -22.090
  460   1HB   ARG  50          2HB       ARG  50  11.138  -6.790 -19.269
  461   2HB   ARG  50          3HB       ARG  50   9.595  -6.053 -19.653
  462   1HG   ARG  50          2HG       ARG  50   9.170  -7.727 -21.409
  463   2HG   ARG  50          3HG       ARG  50  10.771  -8.407 -21.202
  464   1HD   ARG  50          2HD       ARG  50   9.852  -8.575 -18.619
  465   2HD   ARG  50          3HD       ARG  50   8.337  -8.726 -19.488
  466    HE   ARG  50           HE       ARG  50   9.051 -10.797 -20.379
  467   1HH1  ARG  50          2HH2      ARG  50  11.711  -9.193 -18.726
  468   2HH1  ARG  50          1HH2      ARG  50  12.736 -10.589 -18.752
  469   1HH2  ARG  50          2HH1      ARG  50  10.403 -12.639 -20.412
  470   2HH2  ARG  50          1HH1      ARG  50  11.988 -12.562 -19.717
  471    HA   PRO  51           HA       PRO  51   9.723  -2.047 -22.223
  472   1HB   PRO  51          2HB       PRO  51   9.203  -1.975 -24.904
  473   2HB   PRO  51          3HB       PRO  51  10.753  -1.534 -24.217
  474   1HG   PRO  51          2HG       PRO  51  10.005  -3.997 -25.671
  475   2HG   PRO  51          3HG       PRO  51  11.603  -3.350 -25.357
  476   1HD   PRO  51          2HD       PRO  51  10.343  -5.545 -24.008
  477   2HD   PRO  51          3HD       PRO  51  11.892  -4.825 -23.617
  478    H    GLN  52           HN       GLN  52   8.127  -3.597 -20.901
  479    HA   GLN  52           HA       GLN  52   5.623  -2.833 -21.977
  480   1HB   GLN  52          2HB       GLN  52   6.597  -5.569 -22.425
  481   2HB   GLN  52          3HB       GLN  52   5.088  -5.558 -21.534
  482   1HG   GLN  52          2HG       GLN  52   5.557  -4.035 -24.141
  483   2HG   GLN  52          3HG       GLN  52   4.781  -5.602 -24.041
  484   1HE2  GLN  52          1HE2      GLN  52   2.924  -4.689 -24.974
  485   2HE2  GLN  52          2HE2      GLN  52   1.795  -3.749 -24.056
  486    H    THR  53           HN       THR  53   3.865  -3.127 -20.385
  487    HA   THR  53           HA       THR  53   3.081  -2.993 -18.308
  488    HB   THR  53           HB       THR  53   5.018  -5.343 -18.111
  489    HG1  THR  53           HG1      THR  53   2.732  -6.291 -18.003
  490   1HG2  THR  53          1HG2      THR  53   3.529  -5.947 -16.078
  491   2HG2  THR  53          2HG2      THR  53   4.766  -4.699 -15.791
  492   3HG2  THR  53          3HG2      THR  53   3.066  -4.229 -16.039
  493    H    SER  54           HN       SER  54   3.489  -2.319 -16.050
  494    HA   SER  54           HA       SER  54   6.168  -1.387 -15.584
  495   1HB   SER  54          2HB       SER  54   5.296   0.947 -15.038
  496   2HB   SER  54          3HB       SER  54   5.351   0.543 -16.742
  497    HG   SER  54           HG       SER  54   3.092   0.168 -16.740
  498    H    LEU  55           HN       LEU  55   6.295  -2.693 -13.723
  499    HA   LEU  55           HA       LEU  55   5.910  -3.392 -11.663
  500   1HB   LEU  55          2HB       LEU  55   6.327  -0.901 -11.367
  501   2HB   LEU  55          3HB       LEU  55   4.595  -0.727 -11.161
  502    HG   LEU  55           HG       LEU  55   5.872  -2.778  -9.444
  503   1HD1  LEU  55          1HD1      LEU  55   6.708   0.091  -9.397
  504   2HD1  LEU  55          2HD1      LEU  55   6.471  -0.756  -7.849
  505   3HD1  LEU  55          3HD1      LEU  55   7.638  -1.385  -9.037
  506   1HD2  LEU  55          1HD2      LEU  55   3.767  -2.551  -8.702
  507   2HD2  LEU  55          2HD2      LEU  55   4.409  -1.136  -7.834
  508   3HD2  LEU  55          3HD2      LEU  55   3.584  -0.923  -9.397
  509    H    LEU  56           HN       LEU  56   4.472  -5.070 -12.398
  510    HA   LEU  56           HA       LEU  56   1.669  -4.521 -12.528
  511   1HB   LEU  56          2HB       LEU  56   3.106  -6.265 -13.806
  512   2HB   LEU  56          3HB       LEU  56   2.912  -7.249 -12.369
  513    HG   LEU  56           HG       LEU  56   0.324  -6.583 -12.806
  514   1HD1  LEU  56          1HD1      LEU  56  -0.266  -6.257 -14.987
  515   2HD1  LEU  56          2HD1      LEU  56   1.301  -5.412 -14.972
  516   3HD1  LEU  56          3HD1      LEU  56   1.188  -7.064 -15.624
  517   1HD2  LEU  56          1HD2      LEU  56   0.611  -8.809 -12.508
  518   2HD2  LEU  56          2HD2      LEU  56   0.413  -8.823 -14.277
  519   3HD2  LEU  56          3HD2      LEU  56   2.043  -8.885 -13.564
  Start of MODEL    5
    1   1H5*    C 504          1H5*        C 504  36.290 -10.869  -0.936
    2   2H5*    C 504          2H5*        C 504  37.351  -9.952  -2.006
    3    H4*    C 504           H4*        C 504  35.917 -11.812  -3.024
    4    H3*    C 504           H3*        C 504  35.498  -9.135  -4.386
    5    H2*    C 504           H2*        C 504  35.394 -10.548  -6.274
    6   2HO*    C 504          2HO*        C 504  36.450 -12.642  -6.068
    7    H1*    C 504           H1*        C 504  34.036 -12.596  -5.110
    8   1H4     C 504          1H4         C 504  29.254  -8.669  -6.612
    9   2H4     C 504          2H4         C 504  29.687  -7.608  -5.289
   10    H5     C 504           H5         C 504  31.567  -7.937  -3.899
   11    H6     C 504           H6         C 504  33.515  -9.381  -3.430
   12   1H5*    C 505          1H5*        C 505  36.661  -6.907  -6.625
   13   2H5*    C 505          2H5*        C 505  36.325  -8.549  -6.075
   14    H4*    C 505           H4*        C 505  38.752  -8.426  -7.675
   15    H3*    C 505           H3*        C 505  36.376  -7.026  -8.768
   16    H2*    C 505           H2*        C 505  36.415  -8.220 -10.815
   17   2HO*    C 505          2HO*        C 505  38.325  -9.814 -10.914
   18    H1*    C 505           H1*        C 505  36.557 -10.721  -9.661
   19   1H4     C 505          1H4         C 505  30.296  -9.491 -10.128
   20   2H4     C 505          2H4         C 505  30.347  -8.782  -8.529
   21    H5     C 505           H5         C 505  32.338  -8.447  -7.302
   22    H6     C 505           H6         C 505  34.792  -8.713  -7.307
   23   1H5*    U 506          1H5*        U 506  39.026  -2.225  -9.377
   24   2H5*    U 506          2H5*        U 506  37.815  -2.936  -8.310
   25    H4*    U 506           H4*        U 506  37.174  -1.743 -10.587
   26    H3*    U 506           H3*        U 506  35.858  -4.187  -9.382
   27    H2*    U 506           H2*        U 506  34.281  -4.121 -11.099
   28   2HO*    U 506          2HO*        U 506  33.657  -2.017 -11.075
   29    H1*    U 506           H1*        U 506  36.295  -3.012 -12.937
   30    H3     U 506           H3         U 506  36.358  -6.541 -15.711
   31    H5     U 506           H5         U 506  34.544  -8.095 -12.271
   32    H6     U 506           H6         U 506  34.980  -5.939 -11.187
   33   1H5*    C 507          1H5*        C 507  34.149  -0.107 -10.386
   34   2H5*    C 507          2H5*        C 507  33.797   0.296  -8.707
   35    H4*    C 507           H4*        C 507  32.605   1.480 -10.790
   36    H3*    C 507           H3*        C 507  31.641   1.006  -7.996
   37    H2*    C 507           H2*        C 507  29.521   1.940  -8.513
   38   2HO*    C 507          2HO*        C 507  29.337   2.966 -10.634
   39    H1*    C 507           H1*        C 507  29.224   0.432 -10.858
   40   1H4     C 507          1H4         C 507  26.200  -2.804  -6.224
   41   2H4     C 507          2H4         C 507  27.666  -3.727  -5.984
   42    H5     C 507           H5         C 507  29.712  -3.250  -7.061
   43    H6     C 507           H6         C 507  30.869  -1.755  -8.649
   44   1H5*    C 508          1H5*        C 508  34.691   4.869  -5.902
   45   2H5*    C 508          2H5*        C 508  33.294   5.856  -6.334
   46    H4*    C 508           H4*        C 508  35.462   7.042  -6.516
   47    H3*    C 508           H3*        C 508  33.751   6.745  -8.988
   48    H2*    C 508           H2*        C 508  35.227   8.153 -10.137
   49   2HO*    C 508          2HO*        C 508  35.206   9.632  -8.334
   50    H1*    C 508           H1*        C 508  37.488   7.055  -8.633
   51   1H4     C 508          1H4         C 508  38.888   4.491 -14.286
   52   2H4     C 508          2H4         C 508  37.249   4.756 -14.839
   53    H5     C 508           H5         C 508  35.531   5.646 -13.485
   54    H6     C 508           H6         C 508  34.955   6.509 -11.244
   55   1H5*    G 509          1H5*        G 509  33.410  10.603 -10.632
   56   2H5*    G 509          2H5*        G 509  32.042  10.970  -9.581
   57    H4*    G 509           H4*        G 509  31.557  11.302 -11.978
   58    H3*    G 509           H3*        G 509  29.940   9.295 -10.417
   59    H2*    G 509           H2*        G 509  28.568   8.943 -12.293
   60   2HO*    G 509          2HO*        G 509  28.669  10.557 -13.986
   61    H1*    G 509           H1*        G 509  30.853   9.119 -14.075
   62    H8     G 509           H8         G 509  29.987   6.821 -11.114
   63    H1     G 509           H1         G 509  30.156   3.975 -16.925
   64   1H2     G 509          1H2         G 509  30.607   5.379 -18.366
   65   2H2     G 509          2H2         G 509  30.896   7.074 -18.048
   66   1H5*    U 510          1H5*        U 510  26.324  13.809 -10.428
   67   2H5*    U 510          2H5*        U 510  26.710  13.143  -8.841
   68    H4*    U 510           H4*        U 510  24.399  13.143  -8.856
   69    H3*    U 510           H3*        U 510  25.349  10.404  -9.693
   70    H2*    U 510           H2*        U 510  23.098   9.661  -9.643
   71   2HO*    U 510          2HO*        U 510  22.493  10.771  -7.776
   72    H1*    U 510           H1*        U 510  22.185  12.001 -10.992
   73    H3     U 510           H3         U 510  22.087  10.210 -15.131
   74    H5     U 510           H5         U 510  24.468   7.526 -12.971
   75    H6     U 510           H6         U 510  24.356   9.095 -11.089
   76   1H    ALA   1           HN       ALA   1  18.950  41.733 -24.229
   77    HA   ALA   1           HA       ALA   1  17.372  42.331 -21.896
   78   1HB   ALA   1          1HB       ALA   1  15.817  40.629 -23.704
   79   2HB   ALA   1          2HB       ALA   1  15.310  42.054 -22.767
   80   3HB   ALA   1          3HB       ALA   1  16.066  42.262 -24.365
   81    H    THR   2           HN       THR   2  17.229  40.527 -20.504
   82    HA   THR   2           HA       THR   2  19.134  38.450 -21.104
   83    HB   THR   2           HB       THR   2  18.902  39.611 -18.862
   84    HG1  THR   2           HG1      THR   2  18.846  37.434 -17.769
   85   1HG2  THR   2          1HG2      THR   2  16.293  38.004 -18.808
   86   2HG2  THR   2          2HG2      THR   2  17.054  38.744 -17.379
   87   3HG2  THR   2          3HG2      THR   2  16.433  39.775 -18.690
   88    H    VAL   3           HN       VAL   3  18.775  36.269 -21.429
   89    HA   VAL   3           HA       VAL   3  15.979  35.442 -21.598
   90    HB   VAL   3           HB       VAL   3  16.407  34.382 -23.767
   91   1HG1  VAL   3          1HG1      VAL   3  15.706  36.217 -24.872
   92   2HG1  VAL   3          2HG1      VAL   3  15.787  37.006 -23.279
   93   3HG1  VAL   3          3HG1      VAL   3  17.144  37.163 -24.420
   94   1HG2  VAL   3          1HG2      VAL   3  19.014  35.938 -23.810
   95   2HG2  VAL   3          2HG2      VAL   3  18.887  34.188 -23.504
   96   3HG2  VAL   3          3HG2      VAL   3  18.380  34.857 -25.075
   97    H    VAL   4           HN       VAL   4  15.893  32.950 -21.904
   98    HA   VAL   4           HA       VAL   4  17.522  31.839 -19.855
   99    HB   VAL   4           HB       VAL   4  15.162  31.266 -20.220
  100   1HG1  VAL   4          1HG1      VAL   4  15.837  31.095 -22.899
  101   2HG1  VAL   4          2HG1      VAL   4  15.627  29.392 -22.427
  102   3HG1  VAL   4          3HG1      VAL   4  14.305  30.556 -22.169
  103   1HG2  VAL   4          1HG2      VAL   4  15.740  28.619 -20.459
  104   2HG2  VAL   4          2HG2      VAL   4  17.349  29.274 -20.069
  105   3HG2  VAL   4          3HG2      VAL   4  15.979  29.566 -18.970
  106    H    SER   5           HN       SER   5  19.561  31.094 -20.081
  107    HA   SER   5           HA       SER   5  20.271  30.118 -22.738
  108   1HB   SER   5          2HB       SER   5  21.350  32.334 -21.788
  109   2HB   SER   5          3HB       SER   5  22.309  31.247 -20.802
  110    HG   SER   5           HG       SER   5  22.129  31.187 -23.695
  111    H    GLY   6           HN       GLY   6  21.498  28.163 -22.833
  112   1HA   GLY   6          1HA       GLY   6  22.399  26.930 -20.367
  113   2HA   GLY   6          2HA       GLY   6  21.027  26.150 -21.128
  114    H    GLN   7           HN       GLN   7  23.780  25.099 -20.771
  115    HA   GLN   7           HA       GLN   7  24.075  24.006 -23.309
  116   1HB   GLN   7          2HB       GLN   7  26.237  24.946 -23.997
  117   2HB   GLN   7          3HB       GLN   7  25.042  26.222 -23.870
  118   1HG   GLN   7          2HG       GLN   7  26.143  26.084 -21.281
  119   2HG   GLN   7          3HG       GLN   7  27.523  25.829 -22.330
  120   1HE2  GLN   7          1HE2      GLN   7  24.932  27.980 -21.418
  121   2HE2  GLN   7          2HE2      GLN   7  25.542  29.430 -22.145
  122    H    LYS   8           HN       LYS   8  25.351  22.119 -23.194
  123    HA   LYS   8           HA       LYS   8  25.814  21.060 -20.687
  124   1HB   LYS   8          2HB       LYS   8  26.215  20.298 -23.469
  125   2HB   LYS   8          3HB       LYS   8  27.507  19.695 -22.451
  126   1HG   LYS   8          2HG       LYS   8  26.133  18.225 -21.357
  127   2HG   LYS   8          3HG       LYS   8  24.836  19.396 -21.210
  128   1HD   LYS   8          2HD       LYS   8  23.785  18.049 -22.743
  129   2HD   LYS   8          3HD       LYS   8  24.731  18.957 -23.904
  130   1HE   LYS   8          2HE       LYS   8  26.409  16.846 -22.876
  131   2HE   LYS   8          3HE       LYS   8  24.864  16.135 -23.303
  132   1HZ   LYS   8          1HZ       LYS   8  26.242  17.961 -25.127
  133   2HZ   LYS   8          2HZ       LYS   8  26.577  16.362 -25.109
  134   3HZ   LYS   8          3HZ       LYS   8  25.070  16.877 -25.473
  135    H    GLN   9           HN       GLN   9  27.560  20.955 -19.293
  136    HA   GLN   9           HA       GLN   9  30.128  21.733 -20.112
  137   1HB   GLN   9          2HB       GLN   9  30.374  23.802 -18.817
  138   2HB   GLN   9          3HB       GLN   9  29.110  23.997 -20.015
  139   1HG   GLN   9          2HG       GLN   9  27.849  24.748 -18.261
  140   2HG   GLN   9          3HG       GLN   9  27.635  23.048 -17.893
  141   1HE2  GLN   9          1HE2      GLN   9  27.290  24.156 -15.754
  142   2HE2  GLN   9          2HE2      GLN   9  28.654  24.319 -14.699
  143    H    ASP  10           HN       ASP  10  31.390  20.383 -18.913
  144    HA   ASP  10           HA       ASP  10  30.410  18.957 -16.790
  145   1HB   ASP  10          2HB       ASP  10  32.916  18.533 -16.315
  146   2HB   ASP  10          3HB       ASP  10  32.319  18.083 -17.899
  147    H    ARG  11           HN       ARG  11  30.275  19.412 -14.564
  148    HA   ARG  11           HA       ARG  11  30.612  22.012 -13.712
  149   1HB   ARG  11          2HB       ARG  11  30.029  19.359 -12.437
  150   2HB   ARG  11          3HB       ARG  11  30.618  20.602 -11.352
  151   1HG   ARG  11          2HG       ARG  11  28.752  21.978 -11.674
  152   2HG   ARG  11          3HG       ARG  11  28.450  21.379 -13.293
  153   1HD   ARG  11          2HD       ARG  11  27.391  19.395 -12.506
  154   2HD   ARG  11          3HD       ARG  11  28.123  19.518 -10.918
  155    HE   ARG  11           HE       ARG  11  26.450  21.822 -11.453
  156   1HH1  ARG  11          2HH2      ARG  11  26.319  18.428 -10.532
  157   2HH1  ARG  11          1HH2      ARG  11  24.803  18.580  -9.706
  158   1HH2  ARG  11          2HH1      ARG  11  24.451  22.022 -10.364
  159   2HH2  ARG  11          1HH1      ARG  11  23.734  20.638  -9.610
  160    H    GLN  12           HN       GLN  12  32.305  23.094 -12.639
  161    HA   GLN  12           HA       GLN  12  34.863  22.028 -12.961
  162   1HB   GLN  12          2HB       GLN  12  34.075  24.507 -12.860
  163   2HB   GLN  12          3HB       GLN  12  34.170  24.340 -11.118
  164   1HG   GLN  12          2HG       GLN  12  36.528  23.501 -12.829
  165   2HG   GLN  12          3HG       GLN  12  36.275  25.200 -12.480
  166   1HE2  GLN  12          1HE2      GLN  12  38.523  24.336 -11.585
  167   2HE2  GLN  12          2HE2      GLN  12  38.547  24.029  -9.881
  168    H    GLY  13           HN       GLY  13  35.265  20.111 -11.837
  169   1HA   GLY  13          1HA       GLY  13  35.267  20.360  -8.900
  170   2HA   GLY  13          2HA       GLY  13  34.523  18.973  -9.671
  171    H    GLY  14           HN       GLY  14  36.191  17.745  -8.387
  172   1HA   GLY  14          1HA       GLY  14  38.930  17.979  -9.377
  173   2HA   GLY  14          2HA       GLY  14  38.359  17.015  -8.029
  174    H    GLU  15           HN       GLU  15  38.564  17.226 -11.598
  175    HA   GLU  15           HA       GLU  15  38.125  14.343 -11.634
  176   1HB   GLU  15          2HB       GLU  15  37.072  16.489 -13.491
  177   2HB   GLU  15          3HB       GLU  15  37.321  14.863 -14.097
  178   1HG   GLU  15          2HG       GLU  15  35.177  14.545 -13.330
  179   2HG   GLU  15          3HG       GLU  15  35.990  14.249 -11.807
  180    H    ARG  16           HN       ARG  16  39.747  13.144 -12.584
  181    HA   ARG  16           HA       ARG  16  41.618  14.636 -14.231
  182   1HB   ARG  16          2HB       ARG  16  43.500  13.343 -13.170
  183   2HB   ARG  16          3HB       ARG  16  42.679  14.388 -12.028
  184   1HG   ARG  16          2HG       ARG  16  41.179  12.180 -11.638
  185   2HG   ARG  16          3HG       ARG  16  42.618  11.381 -12.238
  186   1HD   ARG  16          2HD       ARG  16  43.815  13.049 -10.469
  187   2HD   ARG  16          3HD       ARG  16  42.240  12.965  -9.705
  188    HE   ARG  16           HE       ARG  16  42.957  10.304 -10.346
  189   1HH1  ARG  16          2HH2      ARG  16  44.145  12.900  -8.288
  190   2HH1  ARG  16          1HH2      ARG  16  44.843  11.828  -7.121
  191   1HH2  ARG  16          2HH1      ARG  16  43.878   8.889  -8.806
  192   2HH2  ARG  16          1HH1      ARG  16  44.690   9.531  -7.417
  193    H    ARG  17           HN       ARG  17  39.744  13.342 -15.587
  194    HA   ARG  17           HA       ARG  17  39.265  11.766 -16.986
  195   1HB   ARG  17          2HB       ARG  17  42.282  11.419 -16.823
  196   2HB   ARG  17          3HB       ARG  17  41.337  10.355 -17.845
  197   1HG   ARG  17          2HG       ARG  17  41.068  11.963 -19.430
  198   2HG   ARG  17          3HG       ARG  17  40.527  13.139 -18.249
  199   1HD   ARG  17          2HD       ARG  17  43.432  12.563 -18.066
  200   2HD   ARG  17          3HD       ARG  17  42.959  13.223 -19.618
  201    HE   ARG  17           HE       ARG  17  41.808  14.660 -17.331
  202   1HH1  ARG  17          2HH2      ARG  17  44.554  14.419 -19.519
  203   2HH1  ARG  17          1HH2      ARG  17  45.061  16.056 -19.266
  204   1HH2  ARG  17          2HH1      ARG  17  42.478  16.819 -16.996
  205   2HH2  ARG  17          1HH1      ARG  17  43.872  17.430 -17.821
  206    H    ARG  18           HN       ARG  18  39.307   9.240 -17.406
  207    HA   ARG  18           HA       ARG  18  39.782   7.871 -14.894
  208   1HB   ARG  18          2HB       ARG  18  37.209   7.979 -16.503
  209   2HB   ARG  18          3HB       ARG  18  37.573   6.544 -15.566
  210   1HG   ARG  18          2HG       ARG  18  37.372   7.645 -13.520
  211   2HG   ARG  18          3HG       ARG  18  37.896   9.186 -14.169
  212   1HD   ARG  18          2HD       ARG  18  35.459   8.530 -15.527
  213   2HD   ARG  18          3HD       ARG  18  35.186   8.183 -13.830
  214    HE   ARG  18           HE       ARG  18  36.415  10.643 -13.728
  215   1HH1  ARG  18          2HH2      ARG  18  33.673   9.421 -15.563
  216   2HH1  ARG  18          1HH2      ARG  18  32.879  10.959 -15.643
  217   1HH2  ARG  18          2HH1      ARG  18  35.368  12.671 -13.832
  218   2HH2  ARG  18          1HH1      ARG  18  33.849  12.819 -14.652
  219    H    SER  19           HN       SER  19  41.674   7.660 -16.779
  220    HA   SER  19           HA       SER  19  42.810   6.247 -17.974
  221   1HB   SER  19          2HB       SER  19  41.407   4.581 -16.319
  222   2HB   SER  19          3HB       SER  19  40.847   3.993 -17.871
  223    HG   SER  19           HG       SER  19  42.718   3.004 -18.131
  224    H    GLN  20           HN       GLN  20  39.443   5.060 -18.700
  225    HA   GLN  20           HA       GLN  20  39.390   6.436 -21.162
  226   1HB   GLN  20          2HB       GLN  20  40.734   3.945 -21.205
  227   2HB   GLN  20          3HB       GLN  20  39.148   3.608 -21.870
  228   1HG   GLN  20          2HG       GLN  20  39.521   4.865 -23.760
  229   2HG   GLN  20          3HG       GLN  20  40.361   6.128 -22.881
  230   1HE2  GLN  20          1HE2      GLN  20  42.455   6.304 -23.128
  231   2HE2  GLN  20          2HE2      GLN  20  43.541   5.103 -23.742
  232    H    LEU  21           HN       LEU  21  37.823   6.048 -18.663
  233    HA   LEU  21           HA       LEU  21  35.534   4.504 -19.545
  234   1HB   LEU  21          2HB       LEU  21  36.274   4.237 -17.272
  235   2HB   LEU  21          3HB       LEU  21  36.184   5.963 -16.984
  236    HG   LEU  21           HG       LEU  21  34.305   4.376 -16.114
  237   1HD1  LEU  21          1HD1      LEU  21  33.068   6.227 -15.751
  238   2HD1  LEU  21          2HD1      LEU  21  34.482   7.049 -16.453
  239   3HD1  LEU  21          3HD1      LEU  21  33.062   6.698 -17.468
  240   1HD2  LEU  21          1HD2      LEU  21  32.957   4.948 -18.719
  241   2HD2  LEU  21          2HD2      LEU  21  34.048   3.546 -18.611
  242   3HD2  LEU  21          3HD2      LEU  21  32.648   3.670 -17.520
  243    H    ASP  22           HN       ASP  22  34.515   5.561 -21.224
  244    HA   ASP  22           HA       ASP  22  34.286   8.351 -21.269
  245   1HB   ASP  22          2HB       ASP  22  32.924   6.080 -22.764
  246   2HB   ASP  22          3HB       ASP  22  32.455   7.744 -23.048
  247    H    ARG  23           HN       ARG  23  32.003   9.451 -21.383
  248    HA   ARG  23           HA       ARG  23  30.676   8.882 -18.993
  249   1HB   ARG  23          2HB       ARG  23  30.013  10.698 -21.356
  250   2HB   ARG  23          3HB       ARG  23  29.003  10.632 -19.926
  251   1HG   ARG  23          2HG       ARG  23  31.997  11.207 -19.799
  252   2HG   ARG  23          3HG       ARG  23  30.798  12.475 -19.960
  253   1HD   ARG  23          2HD       ARG  23  30.596  10.420 -17.724
  254   2HD   ARG  23          3HD       ARG  23  31.615  11.834 -17.553
  255    HE   ARG  23           HE       ARG  23  29.006  12.639 -18.468
  256   1HH1  ARG  23          2HH2      ARG  23  30.665  11.470 -15.593
  257   2HH1  ARG  23          1HH2      ARG  23  29.558  12.222 -14.493
  258   1HH2  ARG  23          2HH1      ARG  23  27.546  13.631 -17.018
  259   2HH2  ARG  23          1HH1      ARG  23  27.772  13.459 -15.309
  260    H    ASP  24           HN       ASP  24  30.594   7.300 -21.963
  261    HA   ASP  24           HA       ASP  24  27.839   6.466 -21.489
  262   1HB   ASP  24          2HB       ASP  24  27.788   5.901 -23.958
  263   2HB   ASP  24          3HB       ASP  24  27.909   7.616 -23.615
  264    H    GLN  25           HN       GLN  25  30.636   5.522 -20.535
  265    HA   GLN  25           HA       GLN  25  30.519   2.853 -21.710
  266   1HB   GLN  25          2HB       GLN  25  32.751   4.666 -21.179
  267   2HB   GLN  25          3HB       GLN  25  32.989   3.138 -20.354
  268   1HG   GLN  25          2HG       GLN  25  33.333   2.002 -22.306
  269   2HG   GLN  25          3HG       GLN  25  31.972   2.771 -23.100
  270   1HE2  GLN  25          1HE2      GLN  25  35.310   3.266 -22.041
  271   2HE2  GLN  25          2HE2      GLN  25  35.778   4.391 -23.272
  272    H    CYS  26           HN       CYS  26  31.321   1.081 -20.109
  273    HA   CYS  26           HA       CYS  26  29.857   1.511 -17.653
  274   1HB   CYS  26          2HB       CYS  26  29.383  -0.520 -18.923
  275   2HB   CYS  26          3HB       CYS  26  31.067  -1.000 -18.858
  276    H    ALA  27           HN       ALA  27  30.851   1.709 -15.636
  277    HA   ALA  27           HA       ALA  27  33.777   1.759 -15.683
  278   1HB   ALA  27          1HB       ALA  27  31.939   2.809 -13.510
  279   2HB   ALA  27          2HB       ALA  27  33.624   3.265 -13.853
  280   3HB   ALA  27          3HB       ALA  27  32.325   3.760 -14.963
  281    H    TYR  28           HN       TYR  28  32.266  -0.769 -15.704
  282    HA   TYR  28           HA       TYR  28  33.145  -1.763 -13.080
  283   1HB   TYR  28          2HB       TYR  28  30.563  -1.497 -13.630
  284   2HB   TYR  28          3HB       TYR  28  30.808  -2.786 -14.792
  285    HD1  TYR  28           HD1      TYR  28  30.315  -1.959 -11.303
  286    HD2  TYR  28           HD2      TYR  28  31.553  -5.063 -13.974
  287    HE1  TYR  28           HE1      TYR  28  29.961  -3.686  -9.472
  288    HE2  TYR  28           HE2      TYR  28  31.194  -6.780 -12.134
  289    HH   TYR  28           HH       TYR  28  30.456  -7.139 -10.130
  290    H    CYS  29           HN       CYS  29  31.971  -2.966 -16.310
  291    HA   CYS  29           HA       CYS  29  33.992  -5.036 -16.156
  292   1HB   CYS  29          2HB       CYS  29  32.845  -5.993 -18.121
  293   2HB   CYS  29          3HB       CYS  29  31.758  -5.753 -16.767
  294    H    LYS  30           HN       LYS  30  33.310  -1.907 -17.588
  295    HA   LYS  30           HA       LYS  30  34.817  -0.573 -18.616
  296   1HB   LYS  30          2HB       LYS  30  36.583  -2.361 -17.914
  297   2HB   LYS  30          3HB       LYS  30  36.455  -2.912 -19.573
  298   1HG   LYS  30          2HG       LYS  30  38.242  -1.304 -19.550
  299   2HG   LYS  30          3HG       LYS  30  36.885  -0.500 -20.314
  300   1HD   LYS  30          2HD       LYS  30  38.007   0.963 -18.628
  301   2HD   LYS  30          3HD       LYS  30  36.326   0.671 -18.227
  302   1HE   LYS  30          2HE       LYS  30  37.924   0.449 -16.263
  303   2HE   LYS  30          3HE       LYS  30  36.909  -0.954 -16.528
  304   1HZ   LYS  30          1HZ       LYS  30  38.668  -2.180 -17.048
  305   2HZ   LYS  30          2HZ       LYS  30  39.365  -1.031 -17.978
  306   3HZ   LYS  30          3HZ       LYS  30  39.571  -1.007 -16.358
  307    H    GLU  31           HN       GLU  31  32.387  -2.155 -19.543
  308    HA   GLU  31           HA       GLU  31  32.898  -2.534 -22.322
  309   1HB   GLU  31          2HB       GLU  31  30.479  -2.788 -20.522
  310   2HB   GLU  31          3HB       GLU  31  30.265  -2.785 -22.261
  311   1HG   GLU  31          2HG       GLU  31  32.384  -4.592 -21.090
  312   2HG   GLU  31          3HG       GLU  31  30.705  -5.062 -20.911
  313    H    LYS  32           HN       LYS  32  30.758  -1.510 -23.691
  314    HA   LYS  32           HA       LYS  32  30.599   1.317 -22.992
  315   1HB   LYS  32          2HB       LYS  32  31.157   1.952 -25.327
  316   2HB   LYS  32          3HB       LYS  32  32.507   1.270 -24.442
  317   1HG   LYS  32          2HG       LYS  32  32.172  -0.921 -25.529
  318   2HG   LYS  32          3HG       LYS  32  30.721  -0.346 -26.322
  319   1HD   LYS  32          2HD       LYS  32  31.949   1.164 -27.732
  320   2HD   LYS  32          3HD       LYS  32  33.388   1.055 -26.738
  321   1HE   LYS  32          2HE       LYS  32  33.931  -0.350 -28.553
  322   2HE   LYS  32          3HE       LYS  32  33.370  -1.498 -27.353
  323   1HZ   LYS  32          1HZ       LYS  32  31.534  -0.333 -29.312
  324   2HZ   LYS  32          2HZ       LYS  32  32.411  -1.669 -29.651
  325   3HZ   LYS  32          3HZ       LYS  32  31.336  -1.688 -28.422
  326    H    GLY  33           HN       GLY  33  28.535   2.028 -23.153
  327   1HA   GLY  33          1HA       GLY  33  26.629   2.123 -24.750
  328   2HA   GLY  33          2HA       GLY  33  26.678   0.371 -24.754
  329    H    HIS  34           HN       HIS  34  27.321   0.004 -21.915
  330    HA   HIS  34           HA       HIS  34  24.807   0.978 -20.763
  331   1HB   HIS  34          2HB       HIS  34  24.535  -1.084 -19.615
  332   2HB   HIS  34          3HB       HIS  34  24.836  -1.461 -21.301
  333    HD1  HIS  34           HD1      HIS  34  26.798  -2.980 -21.829
  334    HD2  HIS  34           HD2      HIS  34  26.842  -1.576 -17.877
  335    HE1  HIS  34           HE1      HIS  34  28.652  -4.263 -20.635
  336    H    TRP  35           HN       TRP  35  24.847   1.313 -18.386
  337    HA   TRP  35           HA       TRP  35  27.450   2.367 -17.616
  338   1HB   TRP  35          2HB       TRP  35  24.627   2.942 -16.946
  339   2HB   TRP  35          3HB       TRP  35  25.768   3.094 -15.626
  340    HD1  TRP  35           HD1      TRP  35  26.090   4.229 -19.366
  341    HE1  TRP  35           HE1      TRP  35  26.829   6.759 -19.494
  342    HE3  TRP  35           HE3      TRP  35  26.157   5.011 -14.342
  343    HZ2  TRP  35           HZ2      TRP  35  27.348   8.758 -17.525
  344    HZ3  TRP  35           HZ3      TRP  35  26.790   7.279 -13.528
  345    HH2  TRP  35           HH2      TRP  35  27.372   9.118 -15.029
  346    H    ALA  36           HN       ALA  36  28.140   1.962 -15.282
  347    HA   ALA  36           HA       ALA  36  28.332  -0.777 -14.820
  348   1HB   ALA  36          1HB       ALA  36  29.926   0.997 -14.060
  349   2HB   ALA  36          2HB       ALA  36  28.720   1.521 -12.860
  350   3HB   ALA  36          3HB       ALA  36  29.435  -0.106 -12.753
  351    H    LYS  37           HN       LYS  37  26.031   1.714 -13.684
  352    HA   LYS  37           HA       LYS  37  24.886   0.091 -11.671
  353   1HB   LYS  37          2HB       LYS  37  24.124   2.655 -13.050
  354   2HB   LYS  37          3HB       LYS  37  22.984   1.852 -11.988
  355   1HG   LYS  37          2HG       LYS  37  24.037   2.997 -10.315
  356   2HG   LYS  37          3HG       LYS  37  25.268   1.757 -10.445
  357   1HD   LYS  37          2HD       LYS  37  26.607   3.135 -11.952
  358   2HD   LYS  37          3HD       LYS  37  25.320   4.314 -12.110
  359   1HE   LYS  37          2HE       LYS  37  26.469   3.678  -9.372
  360   2HE   LYS  37          3HE       LYS  37  27.307   4.788 -10.438
  361   1HZ   LYS  37          1HZ       LYS  37  25.867   6.082  -9.191
  362   2HZ   LYS  37          2HZ       LYS  37  25.095   5.942 -10.623
  363   3HZ   LYS  37          3HZ       LYS  37  24.607   5.054  -9.343
  364    H    ASP  38           HN       ASP  38  24.948  -0.213 -15.035
  365    HA   ASP  38           HA       ASP  38  22.483  -1.760 -14.901
  366   1HB   ASP  38          2HB       ASP  38  22.855   0.514 -16.455
  367   2HB   ASP  38          3HB       ASP  38  23.300  -0.754 -17.579
  368    H    CYS  39           HN       CYS  39  25.593  -2.180 -14.671
  369    HA   CYS  39           HA       CYS  39  26.490  -3.465 -16.962
  370   1HB   CYS  39          2HB       CYS  39  27.919  -2.682 -15.065
  371   2HB   CYS  39          3HB       CYS  39  27.328  -4.017 -14.097
  372    HA   PRO  40           HA       PRO  40  24.110  -7.124 -16.654
  373   1HB   PRO  40          2HB       PRO  40  25.254  -8.537 -18.694
  374   2HB   PRO  40          3HB       PRO  40  24.003  -7.336 -18.944
  375   1HG   PRO  40          2HG       PRO  40  26.904  -7.130 -19.477
  376   2HG   PRO  40          3HG       PRO  40  25.601  -6.136 -20.098
  377   1HD   PRO  40          2HD       PRO  40  27.446  -5.442 -18.014
  378   2HD   PRO  40          3HD       PRO  40  26.072  -4.498 -18.556
  379    H    LYS  41           HN       LYS  41  27.158  -6.729 -15.633
  380    HA   LYS  41           HA       LYS  41  27.519  -9.570 -15.062
  381   1HB   LYS  41          2HB       LYS  41  29.351  -8.101 -16.081
  382   2HB   LYS  41          3HB       LYS  41  29.470  -7.325 -14.514
  383   1HG   LYS  41          2HG       LYS  41  29.945  -9.506 -13.434
  384   2HG   LYS  41          3HG       LYS  41  29.733 -10.337 -14.962
  385   1HD   LYS  41          2HD       LYS  41  31.686  -9.259 -15.924
  386   2HD   LYS  41          3HD       LYS  41  31.804  -8.130 -14.589
  387   1HE   LYS  41          2HE       LYS  41  33.374  -9.640 -13.831
  388   2HE   LYS  41          3HE       LYS  41  31.962 -10.441 -13.171
  389   1HZ   LYS  41          1HZ       LYS  41  31.879 -11.621 -15.385
  390   2HZ   LYS  41          2HZ       LYS  41  33.403 -11.086 -15.630
  391   3HZ   LYS  41          3HZ       LYS  41  33.073 -12.059 -14.360
  392    H    LYS  42           HN       LYS  42  26.369  -6.590 -13.695
  393    HA   LYS  42           HA       LYS  42  27.033  -6.973 -11.024
  394   1HB   LYS  42          2HB       LYS  42  25.259  -5.280 -12.604
  395   2HB   LYS  42          3HB       LYS  42  24.545  -5.702 -11.060
  396   1HG   LYS  42          2HG       LYS  42  27.230  -5.138 -10.418
  397   2HG   LYS  42          3HG       LYS  42  26.835  -3.942 -11.636
  398   1HD   LYS  42          2HD       LYS  42  24.829  -4.423  -9.435
  399   2HD   LYS  42          3HD       LYS  42  26.289  -3.542  -9.031
  400   1HE   LYS  42          2HE       LYS  42  25.496  -2.350 -11.439
  401   2HE   LYS  42          3HE       LYS  42  23.967  -2.682 -10.650
  402   1HZ   LYS  42          1HZ       LYS  42  25.938  -0.780  -9.969
  403   2HZ   LYS  42          2HZ       LYS  42  24.386  -0.879  -9.475
  404   3HZ   LYS  42          3HZ       LYS  42  25.549  -1.704  -8.680
  405    HA   PRO  43           HA       PRO  43  24.570 -10.551 -10.402
  406   1HB   PRO  43          2HB       PRO  43  25.687 -11.292  -8.020
  407   2HB   PRO  43          3HB       PRO  43  26.335 -11.776  -9.574
  408   1HG   PRO  43          2HG       PRO  43  27.360  -9.739  -7.694
  409   2HG   PRO  43          3HG       PRO  43  28.194 -10.532  -9.015
  410   1HD   PRO  43          2HD       PRO  43  27.144  -7.862  -9.003
  411   2HD   PRO  43          3HD       PRO  43  27.875  -8.695 -10.361
  412    H    ARG  44           HN       ARG  44  22.769 -11.215  -9.173
  413    HA   ARG  44           HA       ARG  44  21.052 -10.871  -7.908
  414   1HB   ARG  44          2HB       ARG  44  23.181  -9.453  -6.317
  415   2HB   ARG  44          3HB       ARG  44  21.519  -9.149  -5.851
  416   1HG   ARG  44          2HG       ARG  44  21.234 -11.752  -5.900
  417   2HG   ARG  44          3HG       ARG  44  22.986 -11.812  -5.915
  418   1HD   ARG  44          2HD       ARG  44  22.958 -10.313  -3.829
  419   2HD   ARG  44          3HD       ARG  44  21.221 -10.534  -3.775
  420    HE   ARG  44           HE       ARG  44  22.198 -13.129  -3.945
  421   1HH1  ARG  44          2HH2      ARG  44  22.775 -10.418  -1.778
  422   2HH1  ARG  44          1HH2      ARG  44  23.144 -11.422  -0.414
  423   1HH2  ARG  44          2HH1      ARG  44  22.683 -14.454  -2.147
  424   2HH2  ARG  44          1HH1      ARG  44  23.090 -13.732  -0.625
  425    H    GLY  45           HN       GLY  45  19.689  -9.783  -9.383
  426   1HA   GLY  45          1HA       GLY  45  19.052  -7.070  -8.808
  427   2HA   GLY  45          2HA       GLY  45  19.957  -7.192 -10.304
  428    HA   PRO  46           HA       PRO  46  18.653  -5.683 -10.814
  429   1HB   PRO  46          2HB       PRO  46  16.485  -4.081 -11.257
  430   2HB   PRO  46          3HB       PRO  46  17.458  -4.755 -12.549
  431   1HG   PRO  46          2HG       PRO  46  14.768  -5.574 -11.634
  432   2HG   PRO  46          3HG       PRO  46  15.567  -5.929 -13.153
  433   1HD   PRO  46          2HD       PRO  46  15.234  -7.711 -10.930
  434   2HD   PRO  46          3HD       PRO  46  16.132  -8.027 -12.401
  435    H    ARG  47           HN       ARG  47  18.300  -3.510  -9.601
  436    HA   ARG  47           HA       ARG  47  18.086  -2.536  -7.686
  437   1HB   ARG  47          2HB       ARG  47  15.704  -4.412  -7.527
  438   2HB   ARG  47          3HB       ARG  47  16.106  -3.421  -6.139
  439   1HG   ARG  47          2HG       ARG  47  16.249  -1.585  -8.235
  440   2HG   ARG  47          3HG       ARG  47  14.937  -2.628  -8.747
  441   1HD   ARG  47          2HD       ARG  47  13.699  -2.230  -6.689
  442   2HD   ARG  47          3HD       ARG  47  15.073  -1.446  -5.937
  443    HE   ARG  47           HE       ARG  47  14.230  -0.143  -8.421
  444   1HH1  ARG  47          2HH2      ARG  47  13.707  -0.329  -4.946
  445   2HH1  ARG  47          1HH2      ARG  47  13.033   1.262  -4.833
  446   1HH2  ARG  47          2HH1      ARG  47  13.340   1.957  -8.273
  447   2HH2  ARG  47          1HH1      ARG  47  12.823   2.571  -6.739
  448    H    GLY  48           HN       GLY  48  18.256  -2.881  -5.176
  449   1HA   GLY  48          1HA       GLY  48  18.927  -5.485  -4.218
  450   2HA   GLY  48          2HA       GLY  48  20.363  -4.542  -4.568
  451    HA   PRO  49           HA       PRO  49  19.203  -3.277  -0.420
  452   1HB   PRO  49          2HB       PRO  49  21.724  -3.277   0.636
  453   2HB   PRO  49          3HB       PRO  49  20.656  -4.664   0.706
  454   1HG   PRO  49          2HG       PRO  49  23.013  -4.225  -1.025
  455   2HG   PRO  49          3HG       PRO  49  22.203  -5.729  -0.633
  456   1HD   PRO  49          2HD       PRO  49  21.990  -4.252  -3.083
  457   2HD   PRO  49          3HD       PRO  49  21.093  -5.693  -2.646
  458    H    ARG  50           HN       ARG  50  20.190  -1.454   1.077
  459    HA   ARG  50           HA       ARG  50  20.608   0.657   1.263
  460   1HB   ARG  50          2HB       ARG  50  22.435  -0.178  -0.897
  461   2HB   ARG  50          3HB       ARG  50  22.013   1.518  -1.036
  462   1HG   ARG  50          2HG       ARG  50  23.375   2.050   0.696
  463   2HG   ARG  50          3HG       ARG  50  22.526   0.941   1.754
  464   1HD   ARG  50          2HD       ARG  50  24.048  -0.792   1.403
  465   2HD   ARG  50          3HD       ARG  50  24.416  -0.290  -0.234
  466    HE   ARG  50           HE       ARG  50  25.455   1.788   1.215
  467   1HH1  ARG  50          2HH2      ARG  50  25.782  -1.700   1.547
  468   2HH1  ARG  50          1HH2      ARG  50  27.368  -1.614   2.237
  469   1HH2  ARG  50          2HH1      ARG  50  27.547   1.902   2.125
  470   2HH2  ARG  50          1HH1      ARG  50  28.379   0.449   2.569
  471    HA   PRO  51           HA       PRO  51  17.586   2.692  -1.137
  472   1HB   PRO  51          2HB       PRO  51  17.971   5.298  -0.411
  473   2HB   PRO  51          3HB       PRO  51  17.089   4.149   0.576
  474   1HG   PRO  51          2HG       PRO  51  19.817   5.218   0.966
  475   2HG   PRO  51          3HG       PRO  51  18.772   4.423   2.127
  476   1HD   PRO  51          2HD       PRO  51  21.025   3.271   0.775
  477   2HD   PRO  51          3HD       PRO  51  19.911   2.445   1.847
  478    H    GLN  52           HN       GLN  52  17.076   4.114  -2.937
  479    HA   GLN  52           HA       GLN  52  19.135   5.501  -4.169
  480   1HB   GLN  52          2HB       GLN  52  19.537   4.039  -6.147
  481   2HB   GLN  52          3HB       GLN  52  20.119   3.317  -4.660
  482   1HG   GLN  52          2HG       GLN  52  17.289   2.666  -5.372
  483   2HG   GLN  52          3HG       GLN  52  18.501   2.022  -6.461
  484   1HE2  GLN  52          1HE2      GLN  52  16.732   0.653  -4.609
  485   2HE2  GLN  52          2HE2      GLN  52  17.720  -0.270  -3.525
  486    H    THR  53           HN       THR  53  16.686   6.372  -3.571
  487    HA   THR  53           HA       THR  53  14.641   5.803  -5.400
  488    HB   THR  53           HB       THR  53  14.435   6.925  -3.136
  489    HG1  THR  53           HG1      THR  53  12.913   8.561  -4.116
  490   1HG2  THR  53          1HG2      THR  53  16.328   8.558  -3.346
  491   2HG2  THR  53          2HG2      THR  53  15.486   9.339  -4.705
  492   3HG2  THR  53          3HG2      THR  53  14.781   9.394  -3.073
  493    H    SER  54           HN       SER  54  13.904   6.807  -7.282
  494    HA   SER  54           HA       SER  54  15.986   8.396  -8.564
  495   1HB   SER  54          2HB       SER  54  14.901   7.568 -10.728
  496   2HB   SER  54          3HB       SER  54  15.751   6.359  -9.787
  497    HG   SER  54           HG       SER  54  13.905   5.319  -9.362
  498    H    LEU  55           HN       LEU  55  15.393  10.366  -9.571
  499    HA   LEU  55           HA       LEU  55  14.186  12.164 -10.001
  500   1HB   LEU  55          2HB       LEU  55  11.866  10.230 -10.041
  501   2HB   LEU  55          3HB       LEU  55  11.776  11.906 -10.544
  502    HG   LEU  55           HG       LEU  55  13.916  10.389 -11.880
  503   1HD1  LEU  55          1HD1      LEU  55  11.877   9.475 -13.414
  504   2HD1  LEU  55          2HD1      LEU  55  12.711   8.511 -12.172
  505   3HD1  LEU  55          3HD1      LEU  55  11.166   9.310 -11.791
  506   1HD2  LEU  55          1HD2      LEU  55  11.632  11.906 -13.136
  507   2HD2  LEU  55          2HD2      LEU  55  13.024  12.731 -12.395
  508   3HD2  LEU  55          3HD2      LEU  55  13.272  11.622 -13.766
  509    H    LEU  56           HN       LEU  56  13.628  13.853  -8.694
  510    HA   LEU  56           HA       LEU  56  13.216  14.909  -6.793
  511   1HB   LEU  56          2HB       LEU  56  10.934  14.298  -7.658
  512   2HB   LEU  56          3HB       LEU  56  10.919  12.972  -6.513
  513    HG   LEU  56           HG       LEU  56  11.482  14.991  -4.814
  514   1HD1  LEU  56          1HD1      LEU  56  11.216  17.009  -5.692
  515   2HD1  LEU  56          2HD1      LEU  56  10.707  16.312  -7.248
  516   3HD1  LEU  56          3HD1      LEU  56   9.502  16.627  -5.978
  517   1HD2  LEU  56          1HD2      LEU  56   8.785  14.037  -5.795
  518   2HD2  LEU  56          2HD2      LEU  56   9.722  13.455  -4.398
  519   3HD2  LEU  56          3HD2      LEU  56   8.998  15.082  -4.370
  Start of MODEL    6
    1   1H5*    C 504          1H5*        C 504  32.941 -13.929  -7.268
    2   2H5*    C 504          2H5*        C 504  33.466 -12.269  -6.987
    3    H4*    C 504           H4*        C 504  35.238 -13.967  -7.664
    4    H3*    C 504           H3*        C 504  34.920 -11.222  -8.693
    5    H2*    C 504           H2*        C 504  35.516 -11.979 -10.804
    6   2HO*    C 504          2HO*        C 504  37.329 -10.898  -9.865
    7    H1*    C 504           H1*        C 504  37.088 -14.336 -10.269
    8   1H4     C 504          1H4         C 504  32.761 -17.069 -14.057
    9   2H4     C 504          2H4         C 504  31.680 -15.713 -13.830
   10    H5     C 504           H5         C 504  32.130 -13.898 -12.388
   11    H6     C 504           H6         C 504  33.747 -12.929 -10.791
   12   1H5*    C 505          1H5*        C 505  39.014  -9.537  -7.384
   13   2H5*    C 505          2H5*        C 505  38.186  -8.006  -7.091
   14    H4*    C 505           H4*        C 505  39.690  -7.899  -9.021
   15    H3*    C 505           H3*        C 505  36.746  -7.478  -9.458
   16    H2*    C 505           H2*        C 505  37.067  -7.186 -11.737
   17   2HO*    C 505          2HO*        C 505  39.323  -6.584 -12.377
   18    H1*    C 505           H1*        C 505  39.434  -8.970 -11.635
   19   1H4     C 505          1H4         C 505  35.793 -11.838 -16.000
   20   2H4     C 505          2H4         C 505  34.506 -12.028 -14.830
   21    H5     C 505           H5         C 505  34.593 -11.180 -12.628
   22    H6     C 505           H6         C 505  35.951  -9.929 -10.989
   23   1H5*    U 506          1H5*        U 506  39.053  -3.828  -9.306
   24   2H5*    U 506          2H5*        U 506  38.567  -2.313  -8.545
   25    H4*    U 506           H4*        U 506  37.508  -1.959 -10.487
   26    H3*    U 506           H3*        U 506  35.583  -3.790  -9.061
   27    H2*    U 506           H2*        U 506  34.278  -3.918 -10.951
   28   2HO*    U 506          2HO*        U 506  35.321  -1.642 -12.195
   29    H1*    U 506           H1*        U 506  36.633  -3.123 -12.618
   30    H3     U 506           H3         U 506  36.221  -6.460 -15.565
   31    H5     U 506           H5         U 506  34.096  -7.914 -12.261
   32    H6     U 506           H6         U 506  34.766  -5.883 -11.061
   33   1H5*    C 507          1H5*        C 507  34.132  -0.127 -10.360
   34   2H5*    C 507          2H5*        C 507  34.280   1.030  -9.038
   35    H4*    C 507           H4*        C 507  32.700   1.771 -10.760
   36    H3*    C 507           H3*        C 507  31.745   1.326  -7.959
   37    H2*    C 507           H2*        C 507  29.546   2.003  -8.543
   38   2HO*    C 507          2HO*        C 507  30.519   2.435 -11.203
   39    H1*    C 507           H1*        C 507  29.483   0.379 -10.844
   40   1H4     C 507          1H4         C 507  26.541  -2.885  -6.170
   41   2H4     C 507          2H4         C 507  28.060  -3.694  -5.859
   42    H5     C 507           H5         C 507  30.099  -3.108  -6.897
   43    H6     C 507           H6         C 507  31.193  -1.586  -8.505
   44   1H5*    C 508          1H5*        C 508  32.572   5.877  -5.752
   45   2H5*    C 508          2H5*        C 508  31.883   7.102  -6.818
   46    H4*    C 508           H4*        C 508  34.160   7.629  -5.945
   47    H3*    C 508           H3*        C 508  33.624   7.531  -8.907
   48    H2*    C 508           H2*        C 508  35.824   8.261  -9.332
   49   2HO*    C 508          2HO*        C 508  35.933   8.621  -6.476
   50    H1*    C 508           H1*        C 508  36.850   6.568  -7.218
   51   1H4     C 508          1H4         C 508  38.865   3.273 -12.260
   52   2H4     C 508          2H4         C 508  37.370   3.583 -13.115
   53    H5     C 508           H5         C 508  35.579   4.836 -12.221
   54    H6     C 508           H6         C 508  34.773   6.113 -10.267
   55   1H5*    G 509          1H5*        G 509  30.162   8.129  -9.672
   56   2H5*    G 509          2H5*        G 509  31.762   8.160 -10.415
   57    H4*    G 509           H4*        G 509  30.556  10.711 -10.832
   58    H3*    G 509           H3*        G 509  28.608   8.494 -11.049
   59    H2*    G 509           H2*        G 509  27.957   9.023 -13.255
   60   2HO*    G 509          2HO*        G 509  29.639  11.315 -12.786
   61    H1*    G 509           H1*        G 509  30.437   9.169 -14.339
   62    H8     G 509           H8         G 509  29.980   6.933 -11.267
   63    H1     G 509           H1         G 509  29.742   3.888 -16.972
   64   1H2     G 509          1H2         G 509  29.856   5.272 -18.497
   65   2H2     G 509          2H2         G 509  29.997   7.000 -18.264
   66   1H5*    U 510          1H5*        U 510  26.065  13.503  -9.823
   67   2H5*    U 510          2H5*        U 510  26.051  12.116  -8.733
   68    H4*    U 510           H4*        U 510  23.922  13.327  -8.728
   69    H3*    U 510           H3*        U 510  23.957  10.469  -9.658
   70    H2*    U 510           H2*        U 510  21.603  10.499  -9.892
   71   2HO*    U 510          2HO*        U 510  21.846  13.114  -8.708
   72    H1*    U 510           H1*        U 510  21.671  13.085 -11.129
   73    H3     U 510           H3         U 510  20.140  11.031 -14.788
   74    H5     U 510           H5         U 510  23.533   8.761 -13.848
   75    H6     U 510           H6         U 510  23.811  10.181 -11.867
   76   1H    ALA   1           HN       ALA   1  38.365  24.180  -6.827
   77    HA   ALA   1           HA       ALA   1  37.980  25.857  -8.715
   78   1HB   ALA   1          1HB       ALA   1  35.461  26.530  -7.265
   79   2HB   ALA   1          2HB       ALA   1  35.862  26.676  -8.994
   80   3HB   ALA   1          3HB       ALA   1  35.408  25.095  -8.317
   81    H    THR   2           HN       THR   2  36.506  26.104  -5.394
   82    HA   THR   2           HA       THR   2  38.735  27.879  -4.682
   83    HB   THR   2           HB       THR   2  37.025  29.361  -3.560
   84    HG1  THR   2           HG1      THR   2  35.222  27.679  -5.145
   85   1HG2  THR   2          1HG2      THR   2  35.666  29.501  -6.065
   86   2HG2  THR   2          2HG2      THR   2  37.028  30.516  -5.532
   87   3HG2  THR   2          3HG2      THR   2  37.337  29.020  -6.446
   88    H    VAL   3           HN       VAL   3  39.629  27.526  -2.714
   89    HA   VAL   3           HA       VAL   3  38.138  25.767  -0.907
   90    HB   VAL   3           HB       VAL   3  41.001  25.463  -1.827
   91   1HG1  VAL   3          1HG1      VAL   3  40.083  25.015   0.751
   92   2HG1  VAL   3          2HG1      VAL   3  39.977  23.408  -0.008
   93   3HG1  VAL   3          3HG1      VAL   3  41.526  24.285   0.007
   94   1HG2  VAL   3          1HG2      VAL   3  39.136  23.164  -1.841
   95   2HG2  VAL   3          2HG2      VAL   3  38.747  24.469  -2.988
   96   3HG2  VAL   3          3HG2      VAL   3  40.340  23.679  -3.047
   97    H    VAL   4           HN       VAL   4  37.641  27.965   0.009
   98    HA   VAL   4           HA       VAL   4  39.603  29.677   0.938
   99    HB   VAL   4           HB       VAL   4  37.848  30.507   2.438
  100   1HG1  VAL   4          1HG1      VAL   4  37.283  29.938  -0.454
  101   2HG1  VAL   4          2HG1      VAL   4  36.029  30.720   0.539
  102   3HG1  VAL   4          3HG1      VAL   4  37.627  31.483   0.360
  103   1HG2  VAL   4          1HG2      VAL   4  36.519  27.910   1.690
  104   2HG2  VAL   4          2HG2      VAL   4  36.699  28.674   3.289
  105   3HG2  VAL   4          3HG2      VAL   4  35.537  29.334   2.113
  106    H    SER   5           HN       SER   5  40.469  30.014   3.107
  107    HA   SER   5           HA       SER   5  41.749  27.944   4.146
  108   1HB   SER   5          2HB       SER   5  40.677  30.463   5.435
  109   2HB   SER   5          3HB       SER   5  41.547  29.299   6.414
  110    HG   SER   5           HG       SER   5  43.105  30.714   5.653
  111    H    GLY   6           HN       GLY   6  41.027  25.966   4.845
  112   1HA   GLY   6          1HA       GLY   6  39.341  25.660   7.056
  113   2HA   GLY   6          2HA       GLY   6  38.366  25.463   5.614
  114    H    GLN   7           HN       GLN   7  41.011  24.140   7.570
  115    HA   GLN   7           HA       GLN   7  40.793  21.712   5.973
  116   1HB   GLN   7          2HB       GLN   7  43.268  23.174   6.889
  117   2HB   GLN   7          3HB       GLN   7  43.319  21.424   6.802
  118   1HG   GLN   7          2HG       GLN   7  43.521  21.489   4.545
  119   2HG   GLN   7          3HG       GLN   7  42.047  22.425   4.397
  120   1HE2  GLN   7          1HE2      GLN   7  43.672  23.081   2.575
  121   2HE2  GLN   7          2HE2      GLN   7  44.571  24.533   2.865
  122    H    LYS   8           HN       LYS   8  41.619  19.724   7.285
  123    HA   LYS   8           HA       LYS   8  41.166  20.125  10.145
  124   1HB   LYS   8          2HB       LYS   8  39.216  19.080   8.435
  125   2HB   LYS   8          3HB       LYS   8  39.944  17.663   9.165
  126   1HG   LYS   8          2HG       LYS   8  39.251  18.226  11.310
  127   2HG   LYS   8          3HG       LYS   8  39.375  19.950  11.020
  128   1HD   LYS   8          2HD       LYS   8  37.069  19.783  11.018
  129   2HD   LYS   8          3HD       LYS   8  37.345  19.452   9.320
  130   1HE   LYS   8          2HE       LYS   8  37.232  17.236  11.413
  131   2HE   LYS   8          3HE       LYS   8  35.802  17.806  10.574
  132   1HZ   LYS   8          1HZ       LYS   8  37.611  15.976   9.668
  133   2HZ   LYS   8          2HZ       LYS   8  36.383  16.636   8.818
  134   3HZ   LYS   8          3HZ       LYS   8  37.874  17.298   8.747
  135    H    GLN   9           HN       GLN   9  41.985  18.263  11.454
  136    HA   GLN   9           HA       GLN   9  44.551  17.680  10.792
  137   1HB   GLN   9          2HB       GLN   9  43.062  17.359  13.011
  138   2HB   GLN   9          3HB       GLN   9  43.027  15.695  12.462
  139   1HG   GLN   9          2HG       GLN   9  45.240  15.350  12.949
  140   2HG   GLN   9          3HG       GLN   9  45.727  16.908  12.312
  141   1HE2  GLN   9          1HE2      GLN   9  43.871  15.489  14.996
  142   2HE2  GLN   9          2HE2      GLN   9  44.424  16.561  16.239
  143    H    ASP  10           HN       ASP  10  41.695  15.430  10.581
  144    HA   ASP  10           HA       ASP  10  42.983  13.312   9.511
  145   1HB   ASP  10          2HB       ASP  10  40.222  14.290   8.654
  146   2HB   ASP  10          3HB       ASP  10  40.797  12.636   8.598
  147    H    ARG  11           HN       ARG  11  43.290  12.567   7.258
  148    HA   ARG  11           HA       ARG  11  43.421  14.815   5.421
  149   1HB   ARG  11          2HB       ARG  11  45.370  12.903   6.166
  150   2HB   ARG  11          3HB       ARG  11  44.853  12.383   4.575
  151   1HG   ARG  11          2HG       ARG  11  46.496  13.908   3.960
  152   2HG   ARG  11          3HG       ARG  11  45.108  14.978   3.982
  153   1HD   ARG  11          2HD       ARG  11  46.603  14.607   6.574
  154   2HD   ARG  11          3HD       ARG  11  47.385  15.553   5.323
  155    HE   ARG  11           HE       ARG  11  44.978  16.294   6.832
  156   1HH1  ARG  11          2HH2      ARG  11  46.877  16.890   3.930
  157   2HH1  ARG  11          1HH2      ARG  11  46.239  18.481   3.685
  158   1HH2  ARG  11          2HH1      ARG  11  44.136  18.393   6.509
  159   2HH2  ARG  11          1HH1      ARG  11  44.669  19.342   5.161
  160    H    GLN  12           HN       GLN  12  42.112  14.771   3.602
  161    HA   GLN  12           HA       GLN  12  40.484  12.422   3.271
  162   1HB   GLN  12          2HB       GLN  12  40.365  15.286   2.378
  163   2HB   GLN  12          3HB       GLN  12  39.553  14.106   1.368
  164   1HG   GLN  12          2HG       GLN  12  37.834  13.954   2.839
  165   2HG   GLN  12          3HG       GLN  12  38.931  13.521   4.136
  166   1HE2  GLN  12          1HE2      GLN  12  37.622  16.239   2.293
  167   2HE2  GLN  12          2HE2      GLN  12  37.717  17.433   3.545
  168    H    GLY  13           HN       GLY  13  39.979  11.797   0.849
  169   1HA   GLY  13          1HA       GLY  13  42.564  11.260  -0.401
  170   2HA   GLY  13          2HA       GLY  13  41.030  10.485  -0.743
  171    H    GLY  14           HN       GLY  14  40.936  10.808  -2.981
  172   1HA   GLY  14          1HA       GLY  14  39.742  12.915  -4.101
  173   2HA   GLY  14          2HA       GLY  14  41.406  13.464  -4.063
  174    H    GLU  15           HN       GLU  15  42.997  12.486  -5.407
  175    HA   GLU  15           HA       GLU  15  43.733  11.528  -7.211
  176   1HB   GLU  15          2HB       GLU  15  43.310   9.478  -5.773
  177   2HB   GLU  15          3HB       GLU  15  41.787   9.259  -6.612
  178   1HG   GLU  15          2HG       GLU  15  43.437   9.497  -8.771
  179   2HG   GLU  15          3HG       GLU  15  44.586   8.855  -7.613
  180    H    ARG  16           HN       ARG  16  43.132  12.832  -8.932
  181    HA   ARG  16           HA       ARG  16  40.470  12.364  -9.991
  182   1HB   ARG  16          2HB       ARG  16  42.037  14.741  -9.565
  183   2HB   ARG  16          3HB       ARG  16  41.852  14.562 -11.298
  184   1HG   ARG  16          2HG       ARG  16  39.413  14.452 -11.097
  185   2HG   ARG  16          3HG       ARG  16  39.510  14.383  -9.348
  186   1HD   ARG  16          2HD       ARG  16  40.958  16.722 -10.361
  187   2HD   ARG  16          3HD       ARG  16  39.310  16.716 -10.956
  188    HE   ARG  16           HE       ARG  16  39.036  16.092  -8.259
  189   1HH1  ARG  16          2HH2      ARG  16  40.540  18.724 -10.045
  190   2HH1  ARG  16          1HH2      ARG  16  40.284  19.891  -8.791
  191   1HH2  ARG  16          2HH1      ARG  16  38.699  17.630  -6.603
  192   2HH2  ARG  16          1HH1      ARG  16  39.231  19.265  -6.820
  193    H    ARG  17           HN       ARG  17  40.942  10.432 -11.207
  194    HA   ARG  17           HA       ARG  17  41.901  10.903 -13.758
  195   1HB   ARG  17          2HB       ARG  17  44.120  10.820 -12.475
  196   2HB   ARG  17          3HB       ARG  17  43.765   9.150 -12.083
  197   1HG   ARG  17          2HG       ARG  17  44.418   8.434 -14.140
  198   2HG   ARG  17          3HG       ARG  17  43.405   9.613 -14.949
  199   1HD   ARG  17          2HD       ARG  17  45.108  11.273 -14.952
  200   2HD   ARG  17          3HD       ARG  17  45.990  10.516 -13.641
  201    HE   ARG  17           HE       ARG  17  45.938   8.648 -15.774
  202   1HH1  ARG  17          2HH2      ARG  17  47.257  11.843 -15.116
  203   2HH1  ARG  17          1HH2      ARG  17  48.598  11.653 -16.196
  204   1HH2  ARG  17          2HH1      ARG  17  47.707   8.396 -17.200
  205   2HH2  ARG  17          1HH1      ARG  17  48.855   9.679 -17.390
  206    H    ARG  18           HN       ARG  18  40.154   9.732 -14.572
  207    HA   ARG  18           HA       ARG  18  39.874   7.028 -13.532
  208   1HB   ARG  18          2HB       ARG  18  37.820   8.848 -14.886
  209   2HB   ARG  18          3HB       ARG  18  37.505   7.180 -14.454
  210   1HG   ARG  18          2HG       ARG  18  37.914   7.678 -12.064
  211   2HG   ARG  18          3HG       ARG  18  38.360   9.327 -12.457
  212   1HD   ARG  18          2HD       ARG  18  35.639   8.238 -13.266
  213   2HD   ARG  18          3HD       ARG  18  35.907   8.840 -11.642
  214    HE   ARG  18           HE       ARG  18  36.170  11.044 -12.495
  215   1HH1  ARG  18          2HH2      ARG  18  35.837   8.704 -15.101
  216   2HH1  ARG  18          1HH2      ARG  18  35.558   9.906 -16.317
  217   1HH2  ARG  18          2HH1      ARG  18  35.801  12.632 -14.098
  218   2HH2  ARG  18          1HH1      ARG  18  35.538  12.155 -15.742
  219    H    SER  19           HN       SER  19  41.861   6.946 -15.223
  220    HA   SER  19           HA       SER  19  42.638   6.541 -17.244
  221   1HB   SER  19          2HB       SER  19  41.721   4.470 -18.232
  222   2HB   SER  19          3HB       SER  19  41.829   4.337 -16.487
  223    HG   SER  19           HG       SER  19  39.506   4.975 -16.433
  224    H    GLN  20           HN       GLN  20  39.443   5.588 -18.474
  225    HA   GLN  20           HA       GLN  20  39.128   8.133 -19.788
  226   1HB   GLN  20          2HB       GLN  20  39.880   5.578 -21.175
  227   2HB   GLN  20          3HB       GLN  20  38.683   6.588 -21.964
  228   1HG   GLN  20          2HG       GLN  20  40.178   8.395 -22.232
  229   2HG   GLN  20          3HG       GLN  20  41.203   7.883 -20.905
  230   1HE2  GLN  20          1HE2      GLN  20  41.509   8.446 -23.905
  231   2HE2  GLN  20          2HE2      GLN  20  42.450   7.124 -24.509
  232    H    LEU  21           HN       LEU  21  37.595   7.142 -17.697
  233    HA   LEU  21           HA       LEU  21  35.476   5.501 -18.433
  234   1HB   LEU  21          2HB       LEU  21  36.367   6.663 -16.149
  235   2HB   LEU  21          3HB       LEU  21  34.947   7.639 -16.468
  236    HG   LEU  21           HG       LEU  21  35.088   4.658 -16.002
  237   1HD1  LEU  21          1HD1      LEU  21  34.110   5.033 -13.992
  238   2HD1  LEU  21          2HD1      LEU  21  34.918   6.609 -14.178
  239   3HD1  LEU  21          3HD1      LEU  21  33.190   6.443 -14.571
  240   1HD2  LEU  21          1HD2      LEU  21  33.392   5.829 -17.852
  241   2HD2  LEU  21          2HD2      LEU  21  33.161   4.260 -17.046
  242   3HD2  LEU  21          3HD2      LEU  21  32.399   5.723 -16.379
  243    H    ASP  22           HN       ASP  22  34.432   5.896 -20.354
  244    HA   ASP  22           HA       ASP  22  33.889   8.492 -21.228
  245   1HB   ASP  22          2HB       ASP  22  33.826   5.950 -22.327
  246   2HB   ASP  22          3HB       ASP  22  32.114   6.299 -22.192
  247    H    ARG  23           HN       ARG  23  31.702   9.507 -21.425
  248    HA   ARG  23           HA       ARG  23  30.252   9.284 -19.071
  249   1HB   ARG  23          2HB       ARG  23  29.953  10.750 -21.685
  250   2HB   ARG  23          3HB       ARG  23  28.516  10.627 -20.688
  251   1HG   ARG  23          2HG       ARG  23  31.209  11.811 -19.871
  252   2HG   ARG  23          3HG       ARG  23  29.709  12.686 -20.110
  253   1HD   ARG  23          2HD       ARG  23  29.022  10.695 -18.237
  254   2HD   ARG  23          3HD       ARG  23  30.632  11.181 -17.749
  255    HE   ARG  23           HE       ARG  23  29.005  13.503 -18.336
  256   1HH1  ARG  23          2HH2      ARG  23  29.568  11.040 -15.886
  257   2HH1  ARG  23          1HH2      ARG  23  29.004  12.028 -14.580
  258   1HH2  ARG  23          2HH1      ARG  23  28.260  14.807 -16.613
  259   2HH2  ARG  23          1HH1      ARG  23  28.256  14.186 -14.997
  260    H    ASP  24           HN       ASP  24  30.345   7.242 -21.772
  261    HA   ASP  24           HA       ASP  24  27.723   6.204 -21.068
  262   1HB   ASP  24          2HB       ASP  24  27.377   5.608 -23.484
  263   2HB   ASP  24          3HB       ASP  24  27.412   7.336 -23.201
  264    H    GLN  25           HN       GLN  25  30.552   5.539 -20.283
  265    HA   GLN  25           HA       GLN  25  30.708   2.903 -21.525
  266   1HB   GLN  25          2HB       GLN  25  32.634   4.376 -22.109
  267   2HB   GLN  25          3HB       GLN  25  32.991   4.590 -20.406
  268   1HG   GLN  25          2HG       GLN  25  32.852   1.808 -20.652
  269   2HG   GLN  25          3HG       GLN  25  33.575   2.289 -22.176
  270   1HE2  GLN  25          1HE2      GLN  25  35.386   1.069 -21.249
  271   2HE2  GLN  25          2HE2      GLN  25  36.538   1.888 -20.250
  272    H    CYS  26           HN       CYS  26  30.614   1.135 -20.162
  273    HA   CYS  26           HA       CYS  26  29.760   1.492 -17.552
  274   1HB   CYS  26          2HB       CYS  26  29.277  -0.521 -18.873
  275   2HB   CYS  26          3HB       CYS  26  30.970  -0.973 -18.852
  276    H    ALA  27           HN       ALA  27  30.871   1.713 -15.607
  277    HA   ALA  27           HA       ALA  27  33.789   1.785 -15.821
  278   1HB   ALA  27          1HB       ALA  27  33.534   3.041 -13.613
  279   2HB   ALA  27          2HB       ALA  27  32.863   3.852 -15.048
  280   3HB   ALA  27          3HB       ALA  27  31.779   3.021 -13.908
  281    H    TYR  28           HN       TYR  28  32.237  -0.741 -15.724
  282    HA   TYR  28           HA       TYR  28  33.280  -1.722 -13.155
  283   1HB   TYR  28          2HB       TYR  28  30.671  -1.472 -13.579
  284   2HB   TYR  28          3HB       TYR  28  30.866  -2.768 -14.742
  285    HD1  TYR  28           HD1      TYR  28  30.856  -1.893 -11.174
  286    HD2  TYR  28           HD2      TYR  28  31.347  -5.058 -14.010
  287    HE1  TYR  28           HE1      TYR  28  30.601  -3.608  -9.314
  288    HE2  TYR  28           HE2      TYR  28  31.090  -6.763 -12.141
  289    HH   TYR  28           HH       TYR  28  30.296  -7.003 -10.024
  290    H    CYS  29           HN       CYS  29  31.958  -2.937 -16.323
  291    HA   CYS  29           HA       CYS  29  34.001  -4.994 -16.261
  292   1HB   CYS  29          2HB       CYS  29  32.756  -6.007 -18.115
  293   2HB   CYS  29          3HB       CYS  29  31.718  -5.712 -16.734
  294    H    LYS  30           HN       LYS  30  33.285  -1.854 -17.588
  295    HA   LYS  30           HA       LYS  30  34.628  -0.516 -18.775
  296   1HB   LYS  30          2HB       LYS  30  36.398  -2.601 -18.225
  297   2HB   LYS  30          3HB       LYS  30  36.464  -2.448 -19.969
  298   1HG   LYS  30          2HG       LYS  30  37.845  -0.672 -19.670
  299   2HG   LYS  30          3HG       LYS  30  36.455   0.221 -19.083
  300   1HD   LYS  30          2HD       LYS  30  37.120  -1.199 -16.821
  301   2HD   LYS  30          3HD       LYS  30  38.702  -1.015 -17.550
  302   1HE   LYS  30          2HE       LYS  30  36.754   1.209 -16.798
  303   2HE   LYS  30          3HE       LYS  30  38.327   0.897 -16.090
  304   1HZ   LYS  30          1HZ       LYS  30  38.571   2.622 -17.637
  305   2HZ   LYS  30          2HZ       LYS  30  39.250   1.314 -18.341
  306   3HZ   LYS  30          3HZ       LYS  30  37.774   1.824 -18.817
  307    H    GLU  31           HN       GLU  31  32.242  -2.149 -19.596
  308    HA   GLU  31           HA       GLU  31  32.780  -2.375 -22.438
  309   1HB   GLU  31          2HB       GLU  31  30.427  -3.322 -20.746
  310   2HB   GLU  31          3HB       GLU  31  30.516  -3.510 -22.486
  311   1HG   GLU  31          2HG       GLU  31  32.466  -4.945 -22.328
  312   2HG   GLU  31          3HG       GLU  31  32.695  -4.561 -20.634
  313    H    LYS  32           HN       LYS  32  32.114  -0.800 -23.841
  314    HA   LYS  32           HA       LYS  32  30.629   1.413 -22.753
  315   1HB   LYS  32          2HB       LYS  32  32.500   1.960 -24.118
  316   2HB   LYS  32          3HB       LYS  32  31.989   0.879 -25.399
  317   1HG   LYS  32          2HG       LYS  32  29.982   2.950 -24.626
  318   2HG   LYS  32          3HG       LYS  32  31.451   3.579 -25.346
  319   1HD   LYS  32          2HD       LYS  32  30.893   2.807 -27.418
  320   2HD   LYS  32          3HD       LYS  32  30.471   1.221 -26.804
  321   1HE   LYS  32          2HE       LYS  32  28.355   1.889 -27.458
  322   2HE   LYS  32          3HE       LYS  32  28.335   2.562 -25.840
  323   1HZ   LYS  32          1HZ       LYS  32  27.725   4.090 -27.703
  324   2HZ   LYS  32          2HZ       LYS  32  28.850   4.662 -26.666
  325   3HZ   LYS  32          3HZ       LYS  32  29.300   4.106 -28.135
  326    H    GLY  33           HN       GLY  33  28.515   1.988 -23.210
  327   1HA   GLY  33          1HA       GLY  33  26.740   1.704 -24.960
  328   2HA   GLY  33          2HA       GLY  33  26.982  -0.018 -24.750
  329    H    HIS  34           HN       HIS  34  27.514   0.186 -21.807
  330    HA   HIS  34           HA       HIS  34  24.882   1.064 -20.895
  331   1HB   HIS  34          2HB       HIS  34  24.542  -0.946 -19.639
  332   2HB   HIS  34          3HB       HIS  34  24.828  -1.373 -21.314
  333    HD1  HIS  34           HD1      HIS  34  26.849  -2.856 -21.846
  334    HD2  HIS  34           HD2      HIS  34  26.726  -1.582 -17.852
  335    HE1  HIS  34           HE1      HIS  34  28.633  -4.199 -20.613
  336    H    TRP  35           HN       TRP  35  24.837   1.218 -18.409
  337    HA   TRP  35           HA       TRP  35  27.385   2.395 -17.594
  338   1HB   TRP  35          2HB       TRP  35  24.528   2.898 -16.979
  339   2HB   TRP  35          3HB       TRP  35  25.659   3.110 -15.656
  340    HD1  TRP  35           HD1      TRP  35  25.873   4.208 -19.417
  341    HE1  TRP  35           HE1      TRP  35  26.563   6.749 -19.591
  342    HE3  TRP  35           HE3      TRP  35  26.101   5.030 -14.406
  343    HZ2  TRP  35           HZ2      TRP  35  27.115   8.772 -17.656
  344    HZ3  TRP  35           HZ3      TRP  35  26.723   7.317 -13.631
  345    HH2  TRP  35           HH2      TRP  35  27.221   9.153 -15.166
  346    H    ALA  36           HN       ALA  36  28.109   1.955 -15.318
  347    HA   ALA  36           HA       ALA  36  28.253  -0.782 -14.830
  348   1HB   ALA  36          1HB       ALA  36  28.720   1.543 -12.918
  349   2HB   ALA  36          2HB       ALA  36  29.379  -0.103 -12.766
  350   3HB   ALA  36          3HB       ALA  36  29.901   0.943 -14.107
  351    H    LYS  37           HN       LYS  37  26.002   1.758 -13.708
  352    HA   LYS  37           HA       LYS  37  24.871   0.248 -11.622
  353   1HB   LYS  37          2HB       LYS  37  24.188   2.736 -13.126
  354   2HB   LYS  37          3HB       LYS  37  22.906   1.962 -12.218
  355   1HG   LYS  37          2HG       LYS  37  23.723   2.959 -10.353
  356   2HG   LYS  37          3HG       LYS  37  25.111   1.894 -10.461
  357   1HD   LYS  37          2HD       LYS  37  26.387   3.516 -11.722
  358   2HD   LYS  37          3HD       LYS  37  24.971   4.499 -12.034
  359   1HE   LYS  37          2HE       LYS  37  26.099   3.995  -9.239
  360   2HE   LYS  37          3HE       LYS  37  26.495   5.400 -10.208
  361   1HZ   LYS  37          1HZ       LYS  37  23.896   4.659  -9.097
  362   2HZ   LYS  37          2HZ       LYS  37  24.726   6.052  -8.903
  363   3HZ   LYS  37          3HZ       LYS  37  24.006   5.724 -10.331
  364    H    ASP  38           HN       ASP  38  24.863  -0.204 -15.001
  365    HA   ASP  38           HA       ASP  38  22.536  -1.923 -14.695
  366   1HB   ASP  38          2HB       ASP  38  22.537   0.366 -16.246
  367   2HB   ASP  38          3HB       ASP  38  23.066  -0.825 -17.419
  368    H    CYS  39           HN       CYS  39  25.503  -2.369 -14.482
  369    HA   CYS  39           HA       CYS  39  26.494  -3.410 -16.882
  370   1HB   CYS  39          2HB       CYS  39  27.908  -2.715 -14.964
  371   2HB   CYS  39          3HB       CYS  39  27.317  -4.082 -14.037
  372    HA   PRO  40           HA       PRO  40  24.200  -7.143 -16.828
  373   1HB   PRO  40          2HB       PRO  40  25.326  -8.338 -19.013
  374   2HB   PRO  40          3HB       PRO  40  24.030  -7.162 -19.124
  375   1HG   PRO  40          2HG       PRO  40  26.907  -6.814 -19.717
  376   2HG   PRO  40          3HG       PRO  40  25.555  -5.816 -20.213
  377   1HD   PRO  40          2HD       PRO  40  27.440  -5.239 -18.130
  378   2HD   PRO  40          3HD       PRO  40  26.022  -4.299 -18.550
  379    H    LYS  41           HN       LYS  41  27.258  -6.732 -15.850
  380    HA   LYS  41           HA       LYS  41  27.641  -9.612 -15.451
  381   1HB   LYS  41          2HB       LYS  41  29.390  -8.021 -16.593
  382   2HB   LYS  41          3HB       LYS  41  29.759  -7.539 -14.949
  383   1HG   LYS  41          2HG       LYS  41  29.717 -10.259 -14.631
  384   2HG   LYS  41          3HG       LYS  41  30.217 -10.168 -16.308
  385   1HD   LYS  41          2HD       LYS  41  32.306  -9.477 -15.736
  386   2HD   LYS  41          3HD       LYS  41  31.677  -8.197 -14.717
  387   1HE   LYS  41          2HE       LYS  41  33.028  -9.823 -13.400
  388   2HE   LYS  41          3HE       LYS  41  31.367  -9.777 -12.844
  389   1HZ   LYS  41          1HZ       LYS  41  32.064 -11.703 -14.899
  390   2HZ   LYS  41          2HZ       LYS  41  32.530 -12.011 -13.365
  391   3HZ   LYS  41          3HZ       LYS  41  30.948 -11.812 -13.712
  392    H    LYS  42           HN       LYS  42  26.651  -6.662 -13.946
  393    HA   LYS  42           HA       LYS  42  27.592  -7.089 -11.354
  394   1HB   LYS  42          2HB       LYS  42  25.679  -5.343 -12.722
  395   2HB   LYS  42          3HB       LYS  42  25.175  -5.745 -11.093
  396   1HG   LYS  42          2HG       LYS  42  27.305  -4.969 -10.167
  397   2HG   LYS  42          3HG       LYS  42  27.986  -4.766 -11.768
  398   1HD   LYS  42          2HD       LYS  42  27.339  -2.576 -11.424
  399   2HD   LYS  42          3HD       LYS  42  25.826  -3.170 -12.077
  400   1HE   LYS  42          2HE       LYS  42  24.817  -3.351  -9.920
  401   2HE   LYS  42          3HE       LYS  42  26.359  -3.328  -9.091
  402   1HZ   LYS  42          1HZ       LYS  42  26.474  -1.006 -10.273
  403   2HZ   LYS  42          2HZ       LYS  42  24.848  -1.125 -10.180
  404   3HZ   LYS  42          3HZ       LYS  42  25.751  -1.197  -8.822
  405    HA   PRO  43           HA       PRO  43  25.074 -10.285  -9.919
  406   1HB   PRO  43          2HB       PRO  43  25.008  -9.792  -7.233
  407   2HB   PRO  43          3HB       PRO  43  26.364 -10.561  -8.033
  408   1HG   PRO  43          2HG       PRO  43  26.140  -7.796  -7.015
  409   2HG   PRO  43          3HG       PRO  43  27.584  -8.703  -7.419
  410   1HD   PRO  43          2HD       PRO  43  26.359  -6.639  -8.989
  411   2HD   PRO  43          3HD       PRO  43  27.732  -7.626  -9.445
  412    H    ARG  44           HN       ARG  44  23.452  -8.803 -11.284
  413    HA   ARG  44           HA       ARG  44  21.419  -8.095 -11.469
  414   1HB   ARG  44          2HB       ARG  44  21.228 -10.129  -9.280
  415   2HB   ARG  44          3HB       ARG  44  19.844  -9.064  -9.421
  416   1HG   ARG  44          2HG       ARG  44  19.215  -9.915 -11.478
  417   2HG   ARG  44          3HG       ARG  44  20.867 -10.158 -12.007
  418   1HD   ARG  44          2HD       ARG  44  19.625 -11.891  -9.830
  419   2HD   ARG  44          3HD       ARG  44  19.438 -12.281 -11.529
  420    HE   ARG  44           HE       ARG  44  21.896 -12.505  -9.941
  421   1HH1  ARG  44          2HH2      ARG  44  20.560 -12.267 -13.187
  422   2HH1  ARG  44          1HH2      ARG  44  21.940 -12.990 -13.946
  423   1HH2  ARG  44          2HH1      ARG  44  23.717 -13.457 -10.940
  424   2HH2  ARG  44          1HH1      ARG  44  23.748 -13.670 -12.659
  425    H    GLY  45           HN       GLY  45  22.072  -5.856 -10.996
  426   1HA   GLY  45          1HA       GLY  45  21.537  -4.931  -8.257
  427   2HA   GLY  45          2HA       GLY  45  22.423  -4.076  -9.504
  428    HA   PRO  46           HA       PRO  46  21.905  -2.474  -8.347
  429   1HB   PRO  46          2HB       PRO  46  20.634  -0.600  -6.817
  430   2HB   PRO  46          3HB       PRO  46  21.332  -0.244  -8.383
  431   1HG   PRO  46          2HG       PRO  46  18.487  -0.573  -7.655
  432   2HG   PRO  46          3HG       PRO  46  19.175   0.186  -9.076
  433   1HD   PRO  46          2HD       PRO  46  17.972  -2.415  -8.931
  434   2HD   PRO  46          3HD       PRO  46  18.763  -1.702 -10.323
  435    H    ARG  47           HN       ARG  47  18.767  -2.980  -6.819
  436    HA   ARG  47           HA       ARG  47  18.290  -3.762  -4.832
  437   1HB   ARG  47          2HB       ARG  47  20.211  -5.870  -5.920
  438   2HB   ARG  47          3HB       ARG  47  19.282  -6.137  -4.459
  439   1HG   ARG  47          2HG       ARG  47  17.224  -5.390  -5.981
  440   2HG   ARG  47          3HG       ARG  47  18.292  -5.821  -7.302
  441   1HD   ARG  47          2HD       ARG  47  17.852  -8.024  -6.977
  442   2HD   ARG  47          3HD       ARG  47  18.446  -7.927  -5.332
  443    HE   ARG  47           HE       ARG  47  15.632  -7.774  -6.195
  444   1HH1  ARG  47          2HH2      ARG  47  17.928  -7.234  -3.584
  445   2HH1  ARG  47          1HH2      ARG  47  16.720  -7.279  -2.342
  446   1HH2  ARG  47          2HH1      ARG  47  14.039  -7.834  -4.557
  447   2HH2  ARG  47          1HH1      ARG  47  14.494  -7.623  -2.900
  448    H    GLY  48           HN       GLY  48  19.209  -2.161  -3.402
  449   1HA   GLY  48          1HA       GLY  48  20.507  -2.582  -1.267
  450   2HA   GLY  48          2HA       GLY  48  21.883  -2.809  -2.329
  451    HA   PRO  49           HA       PRO  49  20.552   1.770  -2.263
  452   1HB   PRO  49          2HB       PRO  49  19.391   2.633   0.056
  453   2HB   PRO  49          3HB       PRO  49  18.474   2.225  -1.380
  454   1HG   PRO  49          2HG       PRO  49  18.782   0.682   1.122
  455   2HG   PRO  49          3HG       PRO  49  17.564   0.515  -0.127
  456   1HD   PRO  49          2HD       PRO  49  19.834  -1.188   0.295
  457   2HD   PRO  49          3HD       PRO  49  18.682  -1.285  -1.022
  458    H    ARG  50           HN       ARG  50  21.103   3.766  -0.550
  459    HA   ARG  50           HA       ARG  50  23.611   2.788   0.562
  460   1HB   ARG  50          2HB       ARG  50  23.256   4.714  -1.442
  461   2HB   ARG  50          3HB       ARG  50  23.461   5.696  -0.005
  462   1HG   ARG  50          2HG       ARG  50  25.602   4.661   0.505
  463   2HG   ARG  50          3HG       ARG  50  25.360   3.414  -0.703
  464   1HD   ARG  50          2HD       ARG  50  25.284   5.297  -2.465
  465   2HD   ARG  50          3HD       ARG  50  25.818   6.389  -1.203
  466    HE   ARG  50           HE       ARG  50  27.962   5.430  -1.288
  467   1HH1  ARG  50          2HH2      ARG  50  25.683   3.388  -3.025
  468   2HH1  ARG  50          1HH2      ARG  50  26.911   2.367  -3.695
  469   1HH2  ARG  50          2HH1      ARG  50  29.583   4.083  -2.171
  470   2HH2  ARG  50          1HH1      ARG  50  29.145   2.765  -3.206
  471    HA   PRO  51           HA       PRO  51  21.377   4.394   4.095
  472   1HB   PRO  51          2HB       PRO  51  22.463   2.707   5.949
  473   2HB   PRO  51          3HB       PRO  51  21.000   2.337   5.058
  474   1HG   PRO  51          2HG       PRO  51  23.723   1.244   4.690
  475   2HG   PRO  51          3HG       PRO  51  22.195   0.601   4.120
  476   1HD   PRO  51          2HD       PRO  51  24.157   1.998   2.562
  477   2HD   PRO  51          3HD       PRO  51  22.580   1.457   2.021
  478    H    GLN  52           HN       GLN  52  24.795   3.536   4.174
  479    HA   GLN  52           HA       GLN  52  25.181   6.124   5.462
  480   1HB   GLN  52          2HB       GLN  52  25.765   3.581   6.550
  481   2HB   GLN  52          3HB       GLN  52  27.319   4.205   6.032
  482   1HG   GLN  52          2HG       GLN  52  27.033   6.238   7.347
  483   2HG   GLN  52          3HG       GLN  52  25.360   5.851   7.693
  484   1HE2  GLN  52          1HE2      GLN  52  24.935   3.816   8.854
  485   2HE2  GLN  52          2HE2      GLN  52  26.024   3.316  10.105
  486    H    THR  53           HN       THR  53  27.595   6.882   5.174
  487    HA   THR  53           HA       THR  53  28.097   6.896   2.363
  488    HB   THR  53           HB       THR  53  28.402   8.871   3.878
  489    HG1  THR  53           HG1      THR  53  29.760   8.283   1.878
  490   1HG2  THR  53          1HG2      THR  53  29.642   8.732   5.791
  491   2HG2  THR  53          2HG2      THR  53  29.835   6.987   5.501
  492   3HG2  THR  53          3HG2      THR  53  31.038   8.135   4.863
  493    H    SER  54           HN       SER  54  29.295   5.565   1.163
  494    HA   SER  54           HA       SER  54  31.198   3.914   2.634
  495   1HB   SER  54          2HB       SER  54  30.711   2.060   1.168
  496   2HB   SER  54          3HB       SER  54  29.178   2.670   1.760
  497    HG   SER  54           HG       SER  54  29.657   2.238  -0.720
  498    H    LEU  55           HN       LEU  55  33.215   4.730   2.165
  499    HA   LEU  55           HA       LEU  55  34.984   5.347   0.994
  500   1HB   LEU  55          2HB       LEU  55  33.961   3.391  -0.499
  501   2HB   LEU  55          3HB       LEU  55  33.763   4.703  -1.642
  502    HG   LEU  55           HG       LEU  55  35.838   3.510  -2.046
  503   1HD1  LEU  55          1HD1      LEU  55  35.554   6.241  -1.900
  504   2HD1  LEU  55          2HD1      LEU  55  37.047   5.956  -0.974
  505   3HD1  LEU  55          3HD1      LEU  55  36.914   5.371  -2.651
  506   1HD2  LEU  55          1HD2      LEU  55  36.163   2.726   0.301
  507   2HD2  LEU  55          2HD2      LEU  55  37.636   3.366  -0.468
  508   3HD2  LEU  55          3HD2      LEU  55  36.748   4.356   0.716
  509    H    LEU  56           HN       LEU  56  35.639   7.404   0.602
  510    HA   LEU  56           HA       LEU  56  35.584   9.530   0.009
  511   1HB   LEU  56          2HB       LEU  56  34.696   8.233  -2.196
  512   2HB   LEU  56          3HB       LEU  56  33.334   9.293  -1.893
  513    HG   LEU  56           HG       LEU  56  35.291  11.115  -1.693
  514   1HD1  LEU  56          1HD1      LEU  56  37.204  10.721  -2.886
  515   2HD1  LEU  56          2HD1      LEU  56  36.907   9.097  -2.221
  516   3HD1  LEU  56          3HD1      LEU  56  36.451   9.468  -3.901
  517   1HD2  LEU  56          1HD2      LEU  56  34.385  11.978  -3.558
  518   2HD2  LEU  56          2HD2      LEU  56  34.666  10.500  -4.510
  519   3HD2  LEU  56          3HD2      LEU  56  33.259  10.606  -3.425
  Start of MODEL    7
    1   1H5*    C 504          1H5*        C 504  34.170  -8.613  -2.003
    2   2H5*    C 504          2H5*        C 504  34.297  -7.554  -3.407
    3    H4*    C 504           H4*        C 504  35.478  -9.944  -3.268
    4    H3*    C 504           H3*        C 504  34.296  -8.672  -5.758
    5    H2*    C 504           H2*        C 504  35.439 -10.347  -6.973
    6   2HO*    C 504          2HO*        C 504  37.241 -11.272  -6.006
    7    H1*    C 504           H1*        C 504  34.749 -12.064  -4.610
    8   1H4     C 504          1H4         C 504  32.355 -15.705  -9.232
    9   2H4     C 504          2H4         C 504  31.707 -14.304 -10.056
   10    H5     C 504           H5         C 504  31.978 -12.087  -9.292
   11    H6     C 504           H6         C 504  32.949 -10.652  -7.532
   12   1H5*    C 505          1H5*        C 505  38.087  -8.532  -6.375
   13   2H5*    C 505          2H5*        C 505  38.989  -7.124  -6.934
   14    H4*    C 505           H4*        C 505  39.294  -8.607  -8.666
   15    H3*    C 505           H3*        C 505  36.933  -6.865  -9.342
   16    H2*    C 505           H2*        C 505  36.763  -7.931 -11.448
   17   2HO*    C 505          2HO*        C 505  39.015  -8.001 -11.797
   18    H1*    C 505           H1*        C 505  37.150 -10.515 -10.297
   19   1H4     C 505          1H4         C 505  30.871 -10.257 -11.377
   20   2H4     C 505          2H4         C 505  30.682  -9.144 -10.041
   21    H5     C 505           H5         C 505  32.485  -8.260  -8.798
   22    H6     C 505           H6         C 505  34.939  -8.226  -8.529
   23   1H5*    U 506          1H5*        U 506  39.510  -2.113  -9.694
   24   2H5*    U 506          2H5*        U 506  38.333  -2.979  -8.707
   25    H4*    U 506           H4*        U 506  37.726  -1.580 -10.938
   26    H3*    U 506           H3*        U 506  36.307  -3.958  -9.725
   27    H2*    U 506           H2*        U 506  34.696  -3.797 -11.401
   28   2HO*    U 506          2HO*        U 506  35.846  -1.177 -11.744
   29    H1*    U 506           H1*        U 506  36.729  -2.767 -13.273
   30    H3     U 506           H3         U 506  36.490  -6.223 -16.125
   31    H5     U 506           H5         U 506  34.709  -7.760 -12.659
   32    H6     U 506           H6         U 506  35.300  -5.658 -11.543
   33   1H5*    C 507          1H5*        C 507  34.670   0.315 -10.612
   34   2H5*    C 507          2H5*        C 507  34.300   0.607  -8.913
   35    H4*    C 507           H4*        C 507  33.039   1.793 -11.001
   36    H3*    C 507           H3*        C 507  32.231   1.342  -8.154
   37    H2*    C 507           H2*        C 507  30.064   2.220  -8.572
   38   2HO*    C 507          2HO*        C 507  29.746   3.295 -10.604
   39    H1*    C 507           H1*        C 507  29.661   0.669 -10.861
   40   1H4     C 507          1H4         C 507  27.097  -2.588  -5.967
   41   2H4     C 507          2H4         C 507  28.594  -3.488  -5.856
   42    H5     C 507           H5         C 507  30.530  -2.981  -7.109
   43    H6     C 507           H6         C 507  31.518  -1.470  -8.794
   44   1H5*    C 508          1H5*        C 508  34.687   5.532  -6.027
   45   2H5*    C 508          2H5*        C 508  32.938   5.488  -6.250
   46    H4*    C 508           H4*        C 508  33.343   7.743  -6.302
   47    H3*    C 508           H3*        C 508  32.976   6.641  -8.964
   48    H2*    C 508           H2*        C 508  34.119   8.250 -10.209
   49   2HO*    C 508          2HO*        C 508  34.049   9.702  -7.721
   50    H1*    C 508           H1*        C 508  36.366   8.496  -8.773
   51   1H4     C 508          1H4         C 508  37.383   2.208 -10.209
   52   2H4     C 508          2H4         C 508  36.689   2.693 -11.740
   53    H5     C 508           H5         C 508  35.684   4.797 -12.121
   54    H6     C 508           H6         C 508  35.092   6.974 -11.117
   55   1H5*    G 509          1H5*        G 509  31.555   9.910 -10.076
   56   2H5*    G 509          2H5*        G 509  29.992  10.277  -9.345
   57    H4*    G 509           H4*        G 509  29.993  11.226 -11.515
   58    H3*    G 509           H3*        G 509  28.282   8.780 -11.244
   59    H2*    G 509           H2*        G 509  27.578   8.978 -13.504
   60   2HO*    G 509          2HO*        G 509  29.151  11.390 -13.397
   61    H1*    G 509           H1*        G 509  30.146   9.243 -14.515
   62    H8     G 509           H8         G 509  29.319   6.999 -11.516
   63    H1     G 509           H1         G 509  30.011   3.943 -17.178
   64   1H2     G 509          1H2         G 509  30.339   5.326 -18.672
   65   2H2     G 509          2H2         G 509  30.414   7.056 -18.427
   66   1H5*    U 510          1H5*        U 510  24.932  10.646  -8.846
   67   2H5*    U 510          2H5*        U 510  26.322   9.788  -8.180
   68    H4*    U 510           H4*        U 510  24.569   8.698  -7.173
   69    H3*    U 510           H3*        U 510  25.320   7.169  -9.652
   70    H2*    U 510           H2*        U 510  23.681   5.535  -9.146
   71   2HO*    U 510          2HO*        U 510  23.118   7.009  -6.755
   72    H1*    U 510           H1*        U 510  21.762   7.554  -8.471
   73    H3     U 510           H3         U 510  20.042   5.098 -11.950
   74    H5     U 510           H5         U 510  22.634   7.870 -13.721
   75    H6     U 510           H6         U 510  23.401   8.445 -11.463
   76   1H    ALA   1           HN       ALA   1  29.526 -27.362   9.724
   77    HA   ALA   1           HA       ALA   1  30.771 -28.330   7.241
   78   1HB   ALA   1          1HB       ALA   1  28.363 -28.436   7.013
   79   2HB   ALA   1          2HB       ALA   1  28.180 -26.793   7.674
   80   3HB   ALA   1          3HB       ALA   1  28.944 -27.033   6.085
   81    H    THR   2           HN       THR   2  32.752 -27.252   7.556
   82    HA   THR   2           HA       THR   2  32.541 -24.344   7.307
   83    HB   THR   2           HB       THR   2  34.318 -24.098   9.050
   84    HG1  THR   2           HG1      THR   2  35.056 -26.392   8.570
   85   1HG2  THR   2          1HG2      THR   2  32.047 -23.999   9.980
   86   2HG2  THR   2          2HG2      THR   2  31.905 -25.772   9.919
   87   3HG2  THR   2          3HG2      THR   2  33.038 -25.008  11.060
   88    H    VAL   3           HN       VAL   3  34.009 -23.418   5.935
   89    HA   VAL   3           HA       VAL   3  36.201 -25.098   5.011
   90    HB   VAL   3           HB       VAL   3  35.627 -24.614   2.663
   91   1HG1  VAL   3          1HG1      VAL   3  34.982 -26.751   3.827
   92   2HG1  VAL   3          2HG1      VAL   3  33.360 -26.059   4.070
   93   3HG1  VAL   3          3HG1      VAL   3  33.973 -26.334   2.422
   94   1HG2  VAL   3          1HG2      VAL   3  34.284 -22.700   2.673
   95   2HG2  VAL   3          2HG2      VAL   3  33.138 -24.003   2.276
   96   3HG2  VAL   3          3HG2      VAL   3  33.199 -23.346   3.929
   97    H    VAL   4           HN       VAL   4  37.864 -23.813   5.687
   98    HA   VAL   4           HA       VAL   4  37.724 -21.003   4.838
   99    HB   VAL   4           HB       VAL   4  39.117 -20.504   6.831
  100   1HG1  VAL   4          1HG1      VAL   4  36.920 -21.476   8.340
  101   2HG1  VAL   4          2HG1      VAL   4  37.152 -19.848   7.658
  102   3HG1  VAL   4          3HG1      VAL   4  36.304 -21.097   6.714
  103   1HG2  VAL   4          1HG2      VAL   4  39.045 -22.204   8.705
  104   2HG2  VAL   4          2HG2      VAL   4  38.524 -23.401   7.495
  105   3HG2  VAL   4          3HG2      VAL   4  40.113 -22.611   7.341
  106    H    SER   5           HN       SER   5  39.689 -20.085   4.040
  107    HA   SER   5           HA       SER   5  42.054 -21.587   4.006
  108   1HB   SER   5          2HB       SER   5  40.223 -21.764   1.630
  109   2HB   SER   5          3HB       SER   5  41.936 -21.592   1.308
  110    HG   SER   5           HG       SER   5  40.577 -23.703   2.717
  111    H    GLY   6           HN       GLY   6  43.823 -20.255   3.350
  112   1HA   GLY   6          1HA       GLY   6  43.240 -17.733   2.010
  113   2HA   GLY   6          2HA       GLY   6  43.811 -17.624   3.662
  114    H    GLN   7           HN       GLN   7  44.960 -17.126   0.739
  115    HA   GLN   7           HA       GLN   7  47.407 -18.651   1.171
  116   1HB   GLN   7          2HB       GLN   7  47.863 -18.332  -1.228
  117   2HB   GLN   7          3HB       GLN   7  46.296 -19.082  -0.997
  118   1HG   GLN   7          2HG       GLN   7  46.079 -16.151  -0.988
  119   2HG   GLN   7          3HG       GLN   7  46.844 -16.723  -2.456
  120   1HE2  GLN   7          1HE2      GLN   7  44.631 -15.608  -2.990
  121   2HE2  GLN   7          2HE2      GLN   7  43.304 -16.688  -3.262
  122    H    LYS   8           HN       LYS   8  49.454 -17.409   0.314
  123    HA   LYS   8           HA       LYS   8  49.325 -14.754   1.514
  124   1HB   LYS   8          2HB       LYS   8  51.439 -16.831   1.157
  125   2HB   LYS   8          3HB       LYS   8  51.949 -15.155   1.162
  126   1HG   LYS   8          2HG       LYS   8  52.036 -15.813   3.453
  127   2HG   LYS   8          3HG       LYS   8  50.565 -14.871   3.323
  128   1HD   LYS   8          2HD       LYS   8  49.321 -17.101   2.930
  129   2HD   LYS   8          3HD       LYS   8  50.806 -17.909   3.392
  130   1HE   LYS   8          2HE       LYS   8  49.465 -15.816   5.162
  131   2HE   LYS   8          3HE       LYS   8  49.087 -17.524   5.273
  132   1HZ   LYS   8          1HZ       LYS   8  50.770 -17.350   6.752
  133   2HZ   LYS   8          2HZ       LYS   8  51.659 -17.702   5.428
  134   3HZ   LYS   8          3HZ       LYS   8  51.551 -16.159   5.953
  135    H    GLN   9           HN       GLN   9  49.285 -12.953   0.282
  136    HA   GLN   9           HA       GLN   9  50.792 -12.744  -2.054
  137   1HB   GLN   9          2HB       GLN   9  48.971 -12.562  -3.727
  138   2HB   GLN   9          3HB       GLN   9  49.054 -14.175  -3.045
  139   1HG   GLN   9          2HG       GLN   9  47.045 -13.954  -1.897
  140   2HG   GLN   9          3HG       GLN   9  47.258 -12.236  -1.626
  141   1HE2  GLN   9          1HE2      GLN   9  46.415 -14.704  -3.980
  142   2HE2  GLN   9          2HE2      GLN   9  45.494 -13.706  -5.056
  143    H    ASP  10           HN       ASP  10  50.885 -10.545  -2.779
  144    HA   ASP  10           HA       ASP  10  49.101  -8.742  -1.364
  145   1HB   ASP  10          2HB       ASP  10  52.121  -8.795  -1.353
  146   2HB   ASP  10          3HB       ASP  10  51.328  -7.233  -1.326
  147    H    ARG  11           HN       ARG  11  48.187  -7.348  -2.885
  148    HA   ARG  11           HA       ARG  11  49.127  -7.428  -5.533
  149   1HB   ARG  11          2HB       ARG  11  46.855  -6.212  -4.036
  150   2HB   ARG  11          3HB       ARG  11  47.353  -5.285  -5.437
  151   1HG   ARG  11          2HG       ARG  11  46.997  -7.154  -6.929
  152   2HG   ARG  11          3HG       ARG  11  46.867  -8.288  -5.599
  153   1HD   ARG  11          2HD       ARG  11  44.632  -7.912  -5.437
  154   2HD   ARG  11          3HD       ARG  11  44.900  -6.195  -5.206
  155    HE   ARG  11           HE       ARG  11  45.148  -7.111  -7.997
  156   1HH1  ARG  11          2HH2      ARG  11  43.021  -5.788  -5.526
  157   2HH1  ARG  11          1HH2      ARG  11  41.882  -5.151  -6.666
  158   1HH2  ARG  11          2HH1      ARG  11  43.647  -6.270  -9.502
  159   2HH2  ARG  11          1HH1      ARG  11  42.242  -5.427  -8.943
  160    H    GLN  12           HN       GLN  12  48.808  -4.749  -3.078
  161    HA   GLN  12           HA       GLN  12  49.821  -2.839  -2.858
  162   1HB   GLN  12          2HB       GLN  12  51.918  -4.790  -3.385
  163   2HB   GLN  12          3HB       GLN  12  52.415  -3.213  -3.967
  164   1HG   GLN  12          2HG       GLN  12  51.264  -3.674  -1.177
  165   2HG   GLN  12          3HG       GLN  12  52.982  -3.706  -1.521
  166   1HE2  GLN  12          1HE2      GLN  12  54.061  -1.840  -2.156
  167   2HE2  GLN  12          2HE2      GLN  12  53.423  -0.250  -1.898
  168    H    GLY  13           HN       GLY  13  48.711  -1.425  -4.220
  169   1HA   GLY  13          1HA       GLY  13  49.115   0.253  -5.853
  170   2HA   GLY  13          2HA       GLY  13  50.011  -0.905  -6.816
  171    H    GLY  14           HN       GLY  14  47.796   0.713  -7.771
  172   1HA   GLY  14          1HA       GLY  14  46.419  -0.490  -9.508
  173   2HA   GLY  14          2HA       GLY  14  45.693  -1.330  -8.152
  174    H    GLU  15           HN       GLU  15  45.942   1.737  -9.907
  175    HA   GLU  15           HA       GLU  15  43.461   2.531  -8.735
  176   1HB   GLU  15          2HB       GLU  15  44.227   4.726  -7.954
  177   2HB   GLU  15          3HB       GLU  15  45.103   3.460  -7.118
  178   1HG   GLU  15          2HG       GLU  15  46.997   4.552  -7.753
  179   2HG   GLU  15          3HG       GLU  15  46.711   3.889  -9.350
  180    H    ARG  16           HN       ARG  16  42.279   3.933 -10.115
  181    HA   ARG  16           HA       ARG  16  43.724   4.807 -12.473
  182   1HB   ARG  16          2HB       ARG  16  41.920   2.644 -12.468
  183   2HB   ARG  16          3HB       ARG  16  40.943   3.980 -13.043
  184   1HG   ARG  16          2HG       ARG  16  41.974   3.966 -15.066
  185   2HG   ARG  16          3HG       ARG  16  43.559   4.070 -14.323
  186   1HD   ARG  16          2HD       ARG  16  42.412   1.395 -13.944
  187   2HD   ARG  16          3HD       ARG  16  42.444   1.820 -15.644
  188    HE   ARG  16           HE       ARG  16  44.811   1.866 -15.593
  189   1HH1  ARG  16          2HH2      ARG  16  43.512   1.526 -12.341
  190   2HH1  ARG  16          1HH2      ARG  16  45.041   1.126 -11.633
  191   1HH2  ARG  16          2HH1      ARG  16  46.829   1.338 -14.661
  192   2HH2  ARG  16          1HH1      ARG  16  46.941   1.018 -12.963
  193    H    ARG  17           HN       ARG  17  43.183   6.910 -13.099
  194    HA   ARG  17           HA       ARG  17  41.210   8.190 -11.440
  195   1HB   ARG  17          2HB       ARG  17  42.174  10.311 -12.427
  196   2HB   ARG  17          3HB       ARG  17  43.369   9.322 -11.613
  197   1HG   ARG  17          2HG       ARG  17  43.028   8.663 -14.492
  198   2HG   ARG  17          3HG       ARG  17  43.600  10.294 -14.204
  199   1HD   ARG  17          2HD       ARG  17  44.889   7.969 -12.739
  200   2HD   ARG  17          3HD       ARG  17  45.345   8.312 -14.395
  201    HE   ARG  17           HE       ARG  17  45.548  10.792 -13.229
  202   1HH1  ARG  17          2HH2      ARG  17  46.802   7.631 -12.323
  203   2HH1  ARG  17          1HH2      ARG  17  48.199   8.273 -11.526
  204   1HH2  ARG  17          2HH1      ARG  17  47.390  11.639 -12.178
  205   2HH2  ARG  17          1HH1      ARG  17  48.536  10.568 -11.442
  206    H    ARG  18           HN       ARG  18  39.663   6.689 -12.905
  207    HA   ARG  18           HA       ARG  18  38.172   6.509 -14.465
  208   1HB   ARG  18          2HB       ARG  18  38.315   9.556 -14.303
  209   2HB   ARG  18          3HB       ARG  18  37.097   8.731 -15.255
  210   1HG   ARG  18          2HG       ARG  18  36.407   7.461 -13.163
  211   2HG   ARG  18          3HG       ARG  18  37.539   8.436 -12.246
  212   1HD   ARG  18          2HD       ARG  18  35.510   9.847 -13.989
  213   2HD   ARG  18          3HD       ARG  18  34.969   9.157 -12.472
  214    HE   ARG  18           HE       ARG  18  36.262  10.743 -11.282
  215   1HH1  ARG  18          2HH2      ARG  18  36.971  10.902 -14.726
  216   2HH1  ARG  18          1HH2      ARG  18  37.844  12.393 -14.607
  217   1HH2  ARG  18          2HH1      ARG  18  37.414  12.710 -11.125
  218   2HH2  ARG  18          1HH1      ARG  18  38.099  13.428 -12.545
  219    H    SER  19           HN       SER  19  40.576   5.961 -15.579
  220    HA   SER  19           HA       SER  19  41.654   7.478 -17.485
  221   1HB   SER  19          2HB       SER  19  41.499   4.645 -16.887
  222   2HB   SER  19          3HB       SER  19  41.457   4.859 -18.625
  223    HG   SER  19           HG       SER  19  43.644   4.690 -17.769
  224    H    GLN  20           HN       GLN  20  40.479   8.781 -18.882
  225    HA   GLN  20           HA       GLN  20  38.853   9.402 -20.235
  226   1HB   GLN  20          2HB       GLN  20  40.380   7.186 -21.474
  227   2HB   GLN  20          3HB       GLN  20  38.841   7.493 -22.256
  228   1HG   GLN  20          2HG       GLN  20  40.051  10.049 -21.699
  229   2HG   GLN  20          3HG       GLN  20  41.281   9.035 -22.426
  230   1HE2  GLN  20          1HE2      GLN  20  41.091   8.324 -24.508
  231   2HE2  GLN  20          2HE2      GLN  20  39.910   8.910 -25.632
  232    H    LEU  21           HN       LEU  21  37.508   8.379 -18.149
  233    HA   LEU  21           HA       LEU  21  35.882   6.153 -18.812
  234   1HB   LEU  21          2HB       LEU  21  36.580   7.276 -16.520
  235   2HB   LEU  21          3HB       LEU  21  35.096   8.176 -16.764
  236    HG   LEU  21           HG       LEU  21  35.479   5.240 -16.275
  237   1HD1  LEU  21          1HD1      LEU  21  34.089   7.529 -14.990
  238   2HD1  LEU  21          2HD1      LEU  21  33.292   5.941 -14.892
  239   3HD1  LEU  21          3HD1      LEU  21  34.946   6.145 -14.270
  240   1HD2  LEU  21          1HD2      LEU  21  34.114   4.884 -18.070
  241   2HD2  LEU  21          2HD2      LEU  21  32.887   5.187 -16.816
  242   3HD2  LEU  21          3HD2      LEU  21  33.342   6.483 -17.948
  243    H    ASP  22           HN       ASP  22  35.002   6.570 -20.897
  244    HA   ASP  22           HA       ASP  22  33.803   8.881 -21.665
  245   1HB   ASP  22          2HB       ASP  22  34.069   6.244 -22.644
  246   2HB   ASP  22          3HB       ASP  22  32.337   6.502 -22.594
  247    H    ARG  23           HN       ARG  23  31.500   9.542 -21.721
  248    HA   ARG  23           HA       ARG  23  30.190   9.011 -19.323
  249   1HB   ARG  23          2HB       ARG  23  29.448  10.453 -21.892
  250   2HB   ARG  23          3HB       ARG  23  28.233  10.226 -20.648
  251   1HG   ARG  23          2HG       ARG  23  30.961  11.495 -20.123
  252   2HG   ARG  23          3HG       ARG  23  29.522  12.421 -20.501
  253   1HD   ARG  23          2HD       ARG  23  29.212  10.420 -18.296
  254   2HD   ARG  23          3HD       ARG  23  30.283  11.763 -17.946
  255    HE   ARG  23           HE       ARG  23  27.919  12.825 -19.141
  256   1HH1  ARG  23          2HH2      ARG  23  28.921  11.218 -16.175
  257   2HH1  ARG  23          1HH2      ARG  23  27.682  11.948 -15.210
  258   1HH2  ARG  23          2HH1      ARG  23  26.284  13.788 -17.869
  259   2HH2  ARG  23          1HH1      ARG  23  26.171  13.420 -16.180
  260    H    ASP  24           HN       ASP  24  30.495   7.127 -22.116
  261    HA   ASP  24           HA       ASP  24  27.972   5.796 -21.513
  262   1HB   ASP  24          2HB       ASP  24  28.031   5.029 -23.947
  263   2HB   ASP  24          3HB       ASP  24  27.703   6.734 -23.706
  264    H    GLN  25           HN       GLN  25  30.823   5.479 -20.487
  265    HA   GLN  25           HA       GLN  25  31.325   2.809 -21.551
  266   1HB   GLN  25          2HB       GLN  25  33.098   4.713 -21.838
  267   2HB   GLN  25          3HB       GLN  25  33.406   4.497 -20.126
  268   1HG   GLN  25          2HG       GLN  25  33.543   1.906 -20.813
  269   2HG   GLN  25          3HG       GLN  25  33.886   2.567 -22.399
  270   1HE2  GLN  25          1HE2      GLN  25  35.977   1.833 -22.418
  271   2HE2  GLN  25          2HE2      GLN  25  37.250   2.519 -21.462
  272    H    CYS  26           HN       CYS  26  30.880   1.163 -20.154
  273    HA   CYS  26           HA       CYS  26  29.949   1.615 -17.597
  274   1HB   CYS  26          2HB       CYS  26  29.430  -0.407 -18.873
  275   2HB   CYS  26          3HB       CYS  26  31.102  -0.926 -18.793
  276    H    ALA  27           HN       ALA  27  30.962   1.756 -15.579
  277    HA   ALA  27           HA       ALA  27  33.887   1.773 -15.659
  278   1HB   ALA  27          1HB       ALA  27  31.979   2.878 -13.561
  279   2HB   ALA  27          2HB       ALA  27  33.729   3.176 -13.684
  280   3HB   ALA  27          3HB       ALA  27  32.627   3.819 -14.925
  281    H    TYR  28           HN       TYR  28  32.323  -0.730 -15.682
  282    HA   TYR  28           HA       TYR  28  33.229  -1.765 -13.083
  283   1HB   TYR  28          2HB       TYR  28  30.645  -1.452 -13.575
  284   2HB   TYR  28          3HB       TYR  28  30.842  -2.717 -14.771
  285    HD1  TYR  28           HD1      TYR  28  30.470  -1.961 -11.245
  286    HD2  TYR  28           HD2      TYR  28  31.524  -5.030 -14.032
  287    HE1  TYR  28           HE1      TYR  28  30.117  -3.724  -9.448
  288    HE2  TYR  28           HE2      TYR  28  31.168  -6.782 -12.225
  289    HH   TYR  28           HH       TYR  28  30.494  -7.172 -10.207
  290    H    CYS  29           HN       CYS  29  31.982  -2.918 -16.305
  291    HA   CYS  29           HA       CYS  29  33.955  -5.033 -16.200
  292   1HB   CYS  29          2HB       CYS  29  32.773  -5.916 -18.189
  293   2HB   CYS  29          3HB       CYS  29  31.712  -5.698 -16.811
  294    H    LYS  30           HN       LYS  30  33.142  -1.976 -17.852
  295    HA   LYS  30           HA       LYS  30  34.706  -0.615 -18.817
  296   1HB   LYS  30          2HB       LYS  30  36.473  -2.402 -18.063
  297   2HB   LYS  30          3HB       LYS  30  36.384  -2.937 -19.729
  298   1HG   LYS  30          2HG       LYS  30  37.754  -1.241 -20.340
  299   2HG   LYS  30          3HG       LYS  30  36.542  -0.084 -19.825
  300   1HD   LYS  30          2HD       LYS  30  38.343  -1.376 -17.757
  301   2HD   LYS  30          3HD       LYS  30  38.956  -0.050 -18.726
  302   1HE   LYS  30          2HE       LYS  30  37.972   1.356 -17.235
  303   2HE   LYS  30          3HE       LYS  30  36.431   0.873 -17.917
  304   1HZ   LYS  30          1HZ       LYS  30  37.588  -0.900 -15.953
  305   2HZ   LYS  30          2HZ       LYS  30  37.018   0.529 -15.402
  306   3HZ   LYS  30          3HZ       LYS  30  36.025  -0.495 -16.198
  307    H    GLU  31           HN       GLU  31  32.265  -2.071 -19.724
  308    HA   GLU  31           HA       GLU  31  32.877  -2.159 -22.572
  309   1HB   GLU  31          2HB       GLU  31  31.593  -4.053 -21.012
  310   2HB   GLU  31          3HB       GLU  31  30.233  -3.172 -21.681
  311   1HG   GLU  31          2HG       GLU  31  30.780  -4.980 -23.214
  312   2HG   GLU  31          3HG       GLU  31  31.215  -3.468 -23.987
  313    H    LYS  32           HN       LYS  32  31.986  -0.627 -23.920
  314    HA   LYS  32           HA       LYS  32  30.416   1.438 -22.655
  315   1HB   LYS  32          2HB       LYS  32  30.819   2.694 -24.677
  316   2HB   LYS  32          3HB       LYS  32  32.324   1.994 -24.113
  317   1HG   LYS  32          2HG       LYS  32  32.147   0.166 -25.763
  318   2HG   LYS  32          3HG       LYS  32  30.567   0.730 -26.268
  319   1HD   LYS  32          2HD       LYS  32  31.591   2.040 -27.809
  320   2HD   LYS  32          3HD       LYS  32  32.228   3.009 -26.495
  321   1HE   LYS  32          2HE       LYS  32  33.884   0.688 -26.607
  322   2HE   LYS  32          3HE       LYS  32  33.642   1.174 -28.273
  323   1HZ   LYS  32          1HZ       LYS  32  35.252   2.610 -27.801
  324   2HZ   LYS  32          2HZ       LYS  32  34.094   3.509 -27.082
  325   3HZ   LYS  32          3HZ       LYS  32  35.043   2.529 -26.184
  326    H    GLY  33           HN       GLY  33  28.301   2.080 -23.295
  327   1HA   GLY  33          1HA       GLY  33  26.517   1.700 -24.958
  328   2HA   GLY  33          2HA       GLY  33  26.840  -0.014 -24.793
  329    H    HIS  34           HN       HIS  34  27.414   0.305 -21.807
  330    HA   HIS  34           HA       HIS  34  24.727   0.965 -20.889
  331   1HB   HIS  34          2HB       HIS  34  24.486  -1.069 -19.673
  332   2HB   HIS  34          3HB       HIS  34  24.850  -1.480 -21.336
  333    HD1  HIS  34           HD1      HIS  34  27.033  -2.762 -21.816
  334    HD2  HIS  34           HD2      HIS  34  26.596  -1.622 -17.802
  335    HE1  HIS  34           HE1      HIS  34  28.848  -4.000 -20.519
  336    H    TRP  35           HN       TRP  35  24.663   1.213 -18.449
  337    HA   TRP  35           HA       TRP  35  27.154   2.487 -17.624
  338   1HB   TRP  35          2HB       TRP  35  24.273   2.817 -16.978
  339   2HB   TRP  35          3HB       TRP  35  25.416   3.127 -15.685
  340    HD1  TRP  35           HD1      TRP  35  25.990   4.089 -19.417
  341    HE1  TRP  35           HE1      TRP  35  26.320   6.695 -19.667
  342    HE3  TRP  35           HE3      TRP  35  25.048   5.204 -14.547
  343    HZ2  TRP  35           HZ2      TRP  35  26.153   8.882 -17.841
  344    HZ3  TRP  35           HZ3      TRP  35  25.153   7.599 -13.862
  345    HH2  TRP  35           HH2      TRP  35  25.683   9.407 -15.419
  346    H    ALA  36           HN       ALA  36  27.913   2.088 -15.354
  347    HA   ALA  36           HA       ALA  36  28.206  -0.634 -14.861
  348   1HB   ALA  36          1HB       ALA  36  29.221   0.149 -12.727
  349   2HB   ALA  36          2HB       ALA  36  29.805   1.074 -14.132
  350   3HB   ALA  36          3HB       ALA  36  28.586   1.781 -13.044
  351    H    LYS  37           HN       LYS  37  25.821   1.778 -13.738
  352    HA   LYS  37           HA       LYS  37  24.782   0.211 -11.645
  353   1HB   LYS  37          2HB       LYS  37  24.006   2.677 -13.121
  354   2HB   LYS  37          3HB       LYS  37  22.722   1.826 -12.287
  355   1HG   LYS  37          2HG       LYS  37  23.557   3.298 -10.630
  356   2HG   LYS  37          3HG       LYS  37  24.324   1.774 -10.231
  357   1HD   LYS  37          2HD       LYS  37  26.332   2.527 -11.639
  358   2HD   LYS  37          3HD       LYS  37  25.571   4.101 -11.761
  359   1HE   LYS  37          2HE       LYS  37  25.524   4.238  -9.237
  360   2HE   LYS  37          3HE       LYS  37  26.368   2.703  -9.162
  361   1HZ   LYS  37          1HZ       LYS  37  28.197   3.902  -9.312
  362   2HZ   LYS  37          2HZ       LYS  37  27.837   4.204 -10.875
  363   3HZ   LYS  37          3HZ       LYS  37  27.402   5.270  -9.718
  364    H    ASP  38           HN       ASP  38  24.777  -0.227 -15.030
  365    HA   ASP  38           HA       ASP  38  22.524  -2.046 -14.722
  366   1HB   ASP  38          2HB       ASP  38  22.466   0.211 -16.306
  367   2HB   ASP  38          3HB       ASP  38  23.077  -0.966 -17.451
  368    H    CYS  39           HN       CYS  39  25.522  -2.353 -14.470
  369    HA   CYS  39           HA       CYS  39  26.568  -3.426 -16.832
  370   1HB   CYS  39          2HB       CYS  39  27.933  -2.615 -14.916
  371   2HB   CYS  39          3HB       CYS  39  27.405  -3.990 -13.968
  372    HA   PRO  40           HA       PRO  40  24.468  -7.264 -16.691
  373   1HB   PRO  40          2HB       PRO  40  25.745  -8.512 -18.760
  374   2HB   PRO  40          3HB       PRO  40  24.411  -7.400 -18.988
  375   1HG   PRO  40          2HG       PRO  40  27.295  -6.959 -19.466
  376   2HG   PRO  40          3HG       PRO  40  25.929  -6.043 -20.073
  377   1HD   PRO  40          2HD       PRO  40  27.688  -5.289 -17.936
  378   2HD   PRO  40          3HD       PRO  40  26.255  -4.431 -18.466
  379    H    LYS  41           HN       LYS  41  27.460  -6.679 -15.600
  380    HA   LYS  41           HA       LYS  41  28.023  -9.505 -15.121
  381   1HB   LYS  41          2HB       LYS  41  29.636  -7.228 -15.698
  382   2HB   LYS  41          3HB       LYS  41  30.033  -7.747 -14.072
  383   1HG   LYS  41          2HG       LYS  41  29.940 -10.186 -15.278
  384   2HG   LYS  41          3HG       LYS  41  30.368  -9.212 -16.671
  385   1HD   LYS  41          2HD       LYS  41  32.520  -9.272 -15.956
  386   2HD   LYS  41          3HD       LYS  41  32.045  -8.232 -14.627
  387   1HE   LYS  41          2HE       LYS  41  33.160 -10.244 -13.746
  388   2HE   LYS  41          3HE       LYS  41  31.480 -10.239 -13.249
  389   1HZ   LYS  41          1HZ       LYS  41  30.963 -11.817 -14.872
  390   2HZ   LYS  41          2HZ       LYS  41  32.382 -11.641 -15.659
  391   3HZ   LYS  41          3HZ       LYS  41  32.346 -12.358 -14.192
  392    H    LYS  42           HN       LYS  42  26.665  -6.647 -13.673
  393    HA   LYS  42           HA       LYS  42  27.283  -7.343 -10.982
  394   1HB   LYS  42          2HB       LYS  42  25.741  -5.250 -12.409
  395   2HB   LYS  42          3HB       LYS  42  25.169  -5.642 -10.800
  396   1HG   LYS  42          2HG       LYS  42  27.849  -5.530 -10.292
  397   2HG   LYS  42          3HG       LYS  42  27.773  -4.419 -11.646
  398   1HD   LYS  42          2HD       LYS  42  25.677  -4.077  -9.525
  399   2HD   LYS  42          3HD       LYS  42  27.316  -3.657  -9.071
  400   1HE   LYS  42          2HE       LYS  42  27.452  -2.200 -11.155
  401   2HE   LYS  42          3HE       LYS  42  25.757  -2.536 -11.448
  402   1HZ   LYS  42          1HZ       LYS  42  26.605  -0.523  -9.985
  403   2HZ   LYS  42          2HZ       LYS  42  25.145  -1.221  -9.766
  404   3HZ   LYS  42          3HZ       LYS  42  26.398  -1.624  -8.798
  405    HA   PRO  43           HA       PRO  43  24.209 -10.455 -10.845
  406   1HB   PRO  43          2HB       PRO  43  24.938 -11.524  -8.437
  407   2HB   PRO  43          3HB       PRO  43  25.662 -12.007  -9.958
  408   1HG   PRO  43          2HG       PRO  43  26.790 -10.293  -7.830
  409   2HG   PRO  43          3HG       PRO  43  27.625 -11.124  -9.129
  410   1HD   PRO  43          2HD       PRO  43  27.013  -8.324  -8.997
  411   2HD   PRO  43          3HD       PRO  43  27.742  -9.176 -10.343
  412    H    ARG  44           HN       ARG  44  22.237  -9.530 -10.749
  413    HA   ARG  44           HA       ARG  44  21.672  -8.271  -8.202
  414   1HB   ARG  44          2HB       ARG  44  19.792  -7.180  -9.352
  415   2HB   ARG  44          3HB       ARG  44  21.245  -6.965 -10.307
  416   1HG   ARG  44          2HG       ARG  44  20.339  -9.318 -11.376
  417   2HG   ARG  44          3HG       ARG  44  18.811  -8.609 -10.892
  418   1HD   ARG  44          2HD       ARG  44  19.233  -6.598 -12.216
  419   2HD   ARG  44          3HD       ARG  44  20.888  -7.083 -12.531
  420    HE   ARG  44           HE       ARG  44  20.131  -8.593 -14.175
  421   1HH1  ARG  44          2HH2      ARG  44  17.407  -7.397 -12.297
  422   2HH1  ARG  44          1HH2      ARG  44  16.215  -8.059 -13.365
  423   1HH2  ARG  44          2HH1      ARG  44  18.559  -9.466 -15.586
  424   2HH2  ARG  44          1HH1      ARG  44  16.875  -9.244 -15.248
  425    H    GLY  45           HN       GLY  45  20.453  -9.391  -6.709
  426   1HA   GLY  45          1HA       GLY  45  18.416 -11.264  -7.682
  427   2HA   GLY  45          2HA       GLY  45  19.678 -11.879  -6.635
  428    HA   PRO  46           HA       PRO  46  18.060 -13.045  -6.045
  429   1HB   PRO  46          2HB       PRO  46  15.642 -14.009  -5.214
  430   2HB   PRO  46          3HB       PRO  46  17.101 -14.120  -4.249
  431   1HG   PRO  46          2HG       PRO  46  14.790 -12.307  -3.913
  432   2HG   PRO  46          3HG       PRO  46  16.032 -12.729  -2.751
  433   1HD   PRO  46          2HD       PRO  46  15.836 -10.285  -4.241
  434   2HD   PRO  46          3HD       PRO  46  17.138 -10.756  -3.167
  435    H    ARG  47           HN       ARG  47  15.203 -11.024  -6.290
  436    HA   ARG  47           HA       ARG  47  15.328 -11.039  -9.043
  437   1HB   ARG  47          2HB       ARG  47  14.246 -13.449  -8.130
  438   2HB   ARG  47          3HB       ARG  47  12.809 -12.491  -8.425
  439   1HG   ARG  47          2HG       ARG  47  13.436 -12.095 -10.739
  440   2HG   ARG  47          3HG       ARG  47  15.047 -12.734 -10.481
  441   1HD   ARG  47          2HD       ARG  47  12.813 -14.604  -9.798
  442   2HD   ARG  47          3HD       ARG  47  12.959 -14.206 -11.498
  443    HE   ARG  47           HE       ARG  47  15.499 -14.937 -10.196
  444   1HH1  ARG  47          2HH2      ARG  47  12.706 -16.081 -12.004
  445   2HH1  ARG  47          1HH2      ARG  47  13.498 -17.512 -12.571
  446   1HH2  ARG  47          2HH1      ARG  47  16.546 -16.825 -10.944
  447   2HH2  ARG  47          1HH1      ARG  47  15.698 -17.939 -11.964
  448    H    GLY  48           HN       GLY  48  14.803  -8.842  -8.970
  449   1HA   GLY  48          1HA       GLY  48  12.690  -7.549  -9.237
  450   2HA   GLY  48          2HA       GLY  48  12.254  -8.133  -7.643
  451    HA   PRO  49           HA       PRO  49  14.335  -4.289  -6.739
  452   1HB   PRO  49          2HB       PRO  49  12.766  -3.579  -4.616
  453   2HB   PRO  49          3HB       PRO  49  12.418  -3.103  -6.266
  454   1HG   PRO  49          2HG       PRO  49  11.096  -5.167  -4.613
  455   2HG   PRO  49          3HG       PRO  49  10.513  -4.388  -6.072
  456   1HD   PRO  49          2HD       PRO  49  11.598  -7.035  -5.855
  457   2HD   PRO  49          3HD       PRO  49  11.123  -6.215  -7.329
  458    H    ARG  50           HN       ARG  50  16.132  -3.935  -5.555
  459    HA   ARG  50           HA       ARG  50  16.573  -6.010  -3.602
  460   1HB   ARG  50          2HB       ARG  50  18.950  -5.203  -3.664
  461   2HB   ARG  50          3HB       ARG  50  18.358  -5.631  -5.257
  462   1HG   ARG  50          2HG       ARG  50  17.669  -2.892  -4.917
  463   2HG   ARG  50          3HG       ARG  50  19.294  -3.041  -4.275
  464   1HD   ARG  50          2HD       ARG  50  20.206  -3.704  -6.336
  465   2HD   ARG  50          3HD       ARG  50  18.698  -4.387  -6.911
  466    HE   ARG  50           HE       ARG  50  19.512  -1.557  -7.051
  467   1HH1  ARG  50          2HH2      ARG  50  16.863  -3.860  -7.307
  468   2HH1  ARG  50          1HH2      ARG  50  15.864  -2.800  -8.245
  469   1HH2  ARG  50          2HH1      ARG  50  18.194  -0.159  -8.289
  470   2HH2  ARG  50          1HH1      ARG  50  16.625  -0.681  -8.807
  471    HA   PRO  51           HA       PRO  51  16.101  -3.220  -0.282
  472   1HB   PRO  51          2HB       PRO  51  17.534  -4.467   1.683
  473   2HB   PRO  51          3HB       PRO  51  15.905  -4.936   1.239
  474   1HG   PRO  51          2HG       PRO  51  18.458  -6.288   0.615
  475   2HG   PRO  51          3HG       PRO  51  16.832  -6.936   0.560
  476   1HD   PRO  51          2HD       PRO  51  18.431  -6.123  -1.677
  477   2HD   PRO  51          3HD       PRO  51  16.765  -6.663  -1.721
  478    H    GLN  52           HN       GLN  52  19.451  -4.318  -0.526
  479    HA   GLN  52           HA       GLN  52  20.359  -1.748  -1.032
  480   1HB   GLN  52          2HB       GLN  52  19.719  -1.952   1.633
  481   2HB   GLN  52          3HB       GLN  52  21.396  -2.459   1.670
  482   1HG   GLN  52          2HG       GLN  52  22.136  -0.338   1.318
  483   2HG   GLN  52          3HG       GLN  52  21.090  -0.132  -0.073
  484   1HE2  GLN  52          1HE2      GLN  52  20.975   2.062   0.799
  485   2HE2  GLN  52          2HE2      GLN  52  19.773   2.450   1.984
  486    H    THR  53           HN       THR  53  22.849  -1.680  -0.981
  487    HA   THR  53           HA       THR  53  24.043  -4.343  -0.896
  488    HB   THR  53           HB       THR  53  23.223  -4.012  -3.234
  489    HG1  THR  53           HG1      THR  53  25.443  -4.902  -2.544
  490   1HG2  THR  53          1HG2      THR  53  23.597  -1.372  -3.020
  491   2HG2  THR  53          2HG2      THR  53  25.249  -1.781  -3.541
  492   3HG2  THR  53          3HG2      THR  53  23.862  -2.184  -4.581
  493    H    SER  54           HN       SER  54  24.624  -3.009   1.166
  494    HA   SER  54           HA       SER  54  27.302  -2.282   0.802
  495   1HB   SER  54          2HB       SER  54  25.337  -0.129   0.654
  496   2HB   SER  54          3HB       SER  54  26.379   0.101   2.044
  497    HG   SER  54           HG       SER  54  28.116   0.409   0.765
  498    H    LEU  55           HN       LEU  55  28.407  -2.421   2.806
  499    HA   LEU  55           HA       LEU  55  26.804  -3.438   4.969
  500   1HB   LEU  55          2HB       LEU  55  28.970  -4.427   4.181
  501   2HB   LEU  55          3HB       LEU  55  29.790  -3.016   4.822
  502    HG   LEU  55           HG       LEU  55  28.143  -4.053   6.905
  503   1HD1  LEU  55          1HD1      LEU  55  29.533  -6.149   5.275
  504   2HD1  LEU  55          2HD1      LEU  55  29.470  -6.312   7.047
  505   3HD1  LEU  55          3HD1      LEU  55  27.961  -6.202   6.109
  506   1HD2  LEU  55          1HD2      LEU  55  30.253  -4.286   8.082
  507   2HD2  LEU  55          2HD2      LEU  55  31.151  -4.158   6.551
  508   3HD2  LEU  55          3HD2      LEU  55  30.226  -2.764   7.159
  509    H    LEU  56           HN       LEU  56  29.336  -0.839   4.677
  510    HA   LEU  56           HA       LEU  56  27.926   0.536   6.851
  511   1HB   LEU  56          2HB       LEU  56  30.560  -0.233   6.664
  512   2HB   LEU  56          3HB       LEU  56  30.624   1.443   6.156
  513    HG   LEU  56           HG       LEU  56  31.054   1.229   8.541
  514   1HD1  LEU  56          1HD1      LEU  56  29.971   3.128   9.081
  515   2HD1  LEU  56          2HD1      LEU  56  29.463   3.080   7.376
  516   3HD1  LEU  56          3HD1      LEU  56  28.374   2.475   8.647
  517   1HD2  LEU  56          1HD2      LEU  56  30.039  -0.374   9.697
  518   2HD2  LEU  56          2HD2      LEU  56  28.578   0.643   9.701
  519   3HD2  LEU  56          3HD2      LEU  56  28.801  -0.590   8.436
  Start of MODEL    8
    1   1H5*    C 504          1H5*        C 504  37.070  -4.882  -2.702
    2   2H5*    C 504          2H5*        C 504  37.483  -5.516  -4.294
    3    H4*    C 504           H4*        C 504  35.716  -6.664  -2.605
    4    H3*    C 504           H3*        C 504  35.897  -6.783  -5.611
    5    H2*    C 504           H2*        C 504  33.940  -8.005  -5.701
    6   2HO*    C 504          2HO*        C 504  34.993  -9.486  -4.188
    7    H1*    C 504           H1*        C 504  33.096  -6.845  -3.088
    8   1H4     C 504          1H4         C 504  28.009  -5.479  -6.645
    9   2H4     C 504          2H4         C 504  29.024  -4.820  -7.907
   10    H5     C 504           H5         C 504  31.384  -4.799  -7.820
   11    H6     C 504           H6         C 504  33.371  -5.410  -6.487
   12   1H5*    C 505          1H5*        C 505  39.596  -7.676  -7.107
   13   2H5*    C 505          2H5*        C 505  38.563  -6.422  -7.793
   14    H4*    C 505           H4*        C 505  39.423  -8.646  -9.109
   15    H3*    C 505           H3*        C 505  37.118  -6.785  -9.592
   16    H2*    C 505           H2*        C 505  36.386  -8.125 -11.409
   17   2HO*    C 505          2HO*        C 505  38.647  -8.497 -11.989
   18    H1*    C 505           H1*        C 505  36.651 -10.524  -9.942
   19   1H4     C 505          1H4         C 505  30.446  -9.082  -9.522
   20   2H4     C 505          2H4         C 505  30.809  -7.923  -8.263
   21    H5     C 505           H5         C 505  32.999  -7.369  -7.576
   22    H6     C 505           H6         C 505  35.406  -7.795  -7.932
   23   1H5*    U 506          1H5*        U 506  39.258  -2.984  -9.758
   24   2H5*    U 506          2H5*        U 506  38.035  -2.952  -8.487
   25    H4*    U 506           H4*        U 506  37.271  -1.983 -10.633
   26    H3*    U 506           H3*        U 506  35.804  -4.398  -9.553
   27    H2*    U 506           H2*        U 506  34.196  -4.101 -11.226
   28   2HO*    U 506          2HO*        U 506  35.174  -1.676 -12.179
   29    H1*    U 506           H1*        U 506  36.240  -3.153 -13.090
   30    H3     U 506           H3         U 506  36.067  -6.727 -15.809
   31    H5     U 506           H5         U 506  34.179  -8.100 -12.332
   32    H6     U 506           H6         U 506  34.771  -5.964 -11.285
   33   1H5*    C 507          1H5*        C 507  34.317  -0.134 -10.457
   34   2H5*    C 507          2H5*        C 507  33.947   0.178  -8.761
   35    H4*    C 507           H4*        C 507  32.778   1.449 -10.834
   36    H3*    C 507           H3*        C 507  31.868   0.960  -8.025
   37    H2*    C 507           H2*        C 507  29.748   1.931  -8.480
   38   2HO*    C 507          2HO*        C 507  30.994   2.477 -11.019
   39    H1*    C 507           H1*        C 507  29.360   0.447 -10.820
   40   1H4     C 507          1H4         C 507  26.463  -2.839  -6.148
   41   2H4     C 507          2H4         C 507  27.948  -3.734  -5.915
   42    H5     C 507           H5         C 507  29.975  -3.228  -7.016
   43    H6     C 507           H6         C 507  31.087  -1.724  -8.629
   44   1H5*    C 508          1H5*        C 508  32.614   5.259  -5.500
   45   2H5*    C 508          2H5*        C 508  31.718   6.496  -6.381
   46    H4*    C 508           H4*        C 508  33.968   7.236  -5.738
   47    H3*    C 508           H3*        C 508  33.317   7.052  -8.676
   48    H2*    C 508           H2*        C 508  35.396   8.036  -9.180
   49   2HO*    C 508          2HO*        C 508  36.275   9.365  -7.634
   50    H1*    C 508           H1*        C 508  36.680   6.514  -7.071
   51   1H4     C 508          1H4         C 508  38.993   3.413 -12.108
   52   2H4     C 508          2H4         C 508  37.478   3.587 -12.965
   53    H5     C 508           H5         C 508  35.575   4.662 -12.070
   54    H6     C 508           H6         C 508  34.650   5.846 -10.110
   55   1H5*    G 509          1H5*        G 509  33.376  10.492 -10.883
   56   2H5*    G 509          2H5*        G 509  32.115  11.185  -9.864
   57    H4*    G 509           H4*        G 509  31.414  11.390 -12.125
   58    H3*    G 509           H3*        G 509  29.928   9.227 -10.630
   59    H2*    G 509           H2*        G 509  28.475   9.015 -12.487
   60   2HO*    G 509          2HO*        G 509  28.479  10.725 -14.025
   61    H1*    G 509           H1*        G 509  30.675   9.191 -14.325
   62    H8     G 509           H8         G 509  30.091   6.930 -11.270
   63    H1     G 509           H1         G 509  29.866   3.984 -17.027
   64   1H2     G 509          1H2         G 509  30.162   5.371 -18.523
   65   2H2     G 509          2H2         G 509  30.432   7.080 -18.257
   66   1H5*    U 510          1H5*        U 510  26.453   8.512 -11.308
   67   2H5*    U 510          2H5*        U 510  26.292  10.269 -11.324
   68    H4*    U 510           H4*        U 510  25.608   9.344  -8.711
   69    H3*    U 510           H3*        U 510  24.605   7.562 -10.865
   70    H2*    U 510           H2*        U 510  22.359   7.664 -10.097
   71   2HO*    U 510          2HO*        U 510  22.002   8.632  -8.029
   72    H1*    U 510           H1*        U 510  22.242  10.410 -10.007
   73    H3     U 510           H3         U 510  20.067   9.061 -13.812
   74    H5     U 510           H5         U 510  24.090   9.421 -14.916
   75    H6     U 510           H6         U 510  24.613   9.721 -12.539
   76   1H    ALA   1           HN       ALA   1  -2.192  26.439  -0.913
   77    HA   ALA   1           HA       ALA   1  -0.658  25.103   1.147
   78   1HB   ALA   1          1HB       ALA   1  -1.514  23.350  -1.115
   79   2HB   ALA   1          2HB       ALA   1  -1.171  22.941   0.582
   80   3HB   ALA   1          3HB       ALA   1  -2.726  23.687   0.144
   81    H    THR   2           HN       THR   2   1.498  25.021   0.591
   82    HA   THR   2           HA       THR   2   2.259  25.155  -2.191
   83    HB   THR   2           HB       THR   2   2.605  27.470  -0.233
   84    HG1  THR   2           HG1      THR   2   1.002  28.041  -1.654
   85   1HG2  THR   2          1HG2      THR   2   4.231  28.463  -1.682
   86   2HG2  THR   2          2HG2      THR   2   4.804  26.788  -1.499
   87   3HG2  THR   2          3HG2      THR   2   3.929  27.272  -2.971
   88    H    VAL   3           HN       VAL   3   3.423  23.295  -2.096
   89    HA   VAL   3           HA       VAL   3   5.819  23.440  -0.465
   90    HB   VAL   3           HB       VAL   3   4.055  22.296   0.883
   91   1HG1  VAL   3          1HG1      VAL   3   3.244  21.125  -1.407
   92   2HG1  VAL   3          2HG1      VAL   3   4.291  19.834  -0.769
   93   3HG1  VAL   3          3HG1      VAL   3   2.930  20.440   0.206
   94   1HG2  VAL   3          1HG2      VAL   3   6.571  20.850   0.041
   95   2HG2  VAL   3          2HG2      VAL   3   6.267  21.809   1.510
   96   3HG2  VAL   3          3HG2      VAL   3   5.507  20.212   1.317
   97    H    VAL   4           HN       VAL   4   7.543  22.890  -1.704
   98    HA   VAL   4           HA       VAL   4   7.526  20.728  -3.475
   99    HB   VAL   4           HB       VAL   4   6.025  22.255  -4.737
  100   1HG1  VAL   4          1HG1      VAL   4   6.532  24.386  -5.269
  101   2HG1  VAL   4          2HG1      VAL   4   7.715  24.262  -3.943
  102   3HG1  VAL   4          3HG1      VAL   4   8.233  23.999  -5.625
  103   1HG2  VAL   4          1HG2      VAL   4   7.591  20.521  -5.771
  104   2HG2  VAL   4          2HG2      VAL   4   6.987  21.801  -6.850
  105   3HG2  VAL   4          3HG2      VAL   4   8.645  21.888  -6.207
  106    H    SER   5           HN       SER   5   9.583  20.067  -3.156
  107    HA   SER   5           HA       SER   5  11.644  22.079  -3.438
  108   1HB   SER   5          2HB       SER   5  12.861  21.126  -1.449
  109   2HB   SER   5          3HB       SER   5  11.378  21.962  -1.033
  110    HG   SER   5           HG       SER   5  11.939  19.633  -0.161
  111    H    GLY   6           HN       GLY   6  13.184  21.336  -4.860
  112   1HA   GLY   6          1HA       GLY   6  13.033  18.625  -5.808
  113   2HA   GLY   6          2HA       GLY   6  14.101  19.900  -6.360
  114    H    GLN   7           HN       GLN   7  15.801  18.197  -6.388
  115    HA   GLN   7           HA       GLN   7  17.265  18.304  -3.972
  116   1HB   GLN   7          2HB       GLN   7  15.505  16.249  -3.929
  117   2HB   GLN   7          3HB       GLN   7  16.794  15.463  -4.821
  118   1HG   GLN   7          2HG       GLN   7  18.154  16.771  -2.738
  119   2HG   GLN   7          3HG       GLN   7  16.680  16.214  -1.969
  120   1HE2  GLN   7          1HE2      GLN   7  18.014  14.808  -0.741
  121   2HE2  GLN   7          2HE2      GLN   7  18.561  13.293  -1.378
  122    H    LYS   8           HN       LYS   8  19.342  18.620  -4.641
  123    HA   LYS   8           HA       LYS   8  20.134  17.298  -7.141
  124   1HB   LYS   8          2HB       LYS   8  21.390  19.239  -7.776
  125   2HB   LYS   8          3HB       LYS   8  19.742  19.732  -7.441
  126   1HG   LYS   8          2HG       LYS   8  20.646  20.200  -4.997
  127   2HG   LYS   8          3HG       LYS   8  22.224  20.183  -5.759
  128   1HD   LYS   8          2HD       LYS   8  21.909  22.303  -6.494
  129   2HD   LYS   8          3HD       LYS   8  20.513  21.788  -7.419
  130   1HE   LYS   8          2HE       LYS   8  19.672  23.466  -5.942
  131   2HE   LYS   8          3HE       LYS   8  19.156  21.951  -5.228
  132   1HZ   LYS   8          1HZ       LYS   8  21.479  22.228  -4.056
  133   2HZ   LYS   8          2HZ       LYS   8  21.156  23.810  -4.303
  134   3HZ   LYS   8          3HZ       LYS   8  20.114  22.888  -3.447
  135    H    GLN   9           HN       GLN   9  22.453  16.766  -7.285
  136    HA   GLN   9           HA       GLN   9  23.757  16.735  -4.696
  137   1HB   GLN   9          2HB       GLN   9  22.786  14.378  -6.210
  138   2HB   GLN   9          3HB       GLN   9  24.467  14.260  -5.728
  139   1HG   GLN   9          2HG       GLN   9  23.817  13.740  -3.622
  140   2HG   GLN   9          3HG       GLN   9  23.071  15.318  -3.468
  141   1HE2  GLN   9          1HE2      GLN   9  22.614  11.956  -3.882
  142   2HE2  GLN   9          2HE2      GLN   9  20.883  11.913  -3.936
  143    H    ASP  10           HN       ASP  10  25.345  18.220  -5.316
  144    HA   ASP  10           HA       ASP  10  27.135  17.218  -7.362
  145   1HB   ASP  10          2HB       ASP  10  25.471  19.569  -7.592
  146   2HB   ASP  10          3HB       ASP  10  27.133  20.105  -7.445
  147    H    ARG  11           HN       ARG  11  29.384  17.979  -7.010
  148    HA   ARG  11           HA       ARG  11  30.014  19.826  -5.049
  149   1HB   ARG  11          2HB       ARG  11  30.959  18.330  -3.296
  150   2HB   ARG  11          3HB       ARG  11  29.231  18.086  -3.461
  151   1HG   ARG  11          2HG       ARG  11  29.483  15.929  -4.180
  152   2HG   ARG  11          3HG       ARG  11  30.783  16.349  -5.278
  153   1HD   ARG  11          2HD       ARG  11  31.874  14.973  -3.694
  154   2HD   ARG  11          3HD       ARG  11  32.264  16.584  -3.127
  155    HE   ARG  11           HE       ARG  11  29.853  15.913  -1.846
  156   1HH1  ARG  11          2HH2      ARG  11  33.120  14.612  -1.979
  157   2HH1  ARG  11          1HH2      ARG  11  33.053  13.937  -0.385
  158   1HH2  ARG  11          2HH1      ARG  11  29.764  15.023   0.257
  159   2HH2  ARG  11          1HH1      ARG  11  31.132  14.173   0.896
  160    H    GLN  12           HN       GLN  12  32.494  19.753  -4.577
  161    HA   GLN  12           HA       GLN  12  33.873  18.237  -6.633
  162   1HB   GLN  12          2HB       GLN  12  33.326  20.890  -7.030
  163   2HB   GLN  12          3HB       GLN  12  34.858  21.022  -6.189
  164   1HG   GLN  12          2HG       GLN  12  35.511  20.850  -8.455
  165   2HG   GLN  12          3HG       GLN  12  35.728  19.215  -7.860
  166   1HE2  GLN  12          1HE2      GLN  12  35.535  18.432  -9.970
  167   2HE2  GLN  12          2HE2      GLN  12  34.005  18.263 -10.766
  168    H    GLY  13           HN       GLY  13  35.258  16.944  -5.501
  169   1HA   GLY  13          1HA       GLY  13  37.107  18.172  -3.638
  170   2HA   GLY  13          2HA       GLY  13  35.978  17.041  -2.918
  171    H    GLY  14           HN       GLY  14  38.966  17.379  -4.557
  172   1HA   GLY  14          1HA       GLY  14  40.533  15.853  -5.103
  173   2HA   GLY  14          2HA       GLY  14  39.522  14.599  -4.415
  174    H    GLU  15           HN       GLU  15  40.936  13.955  -6.679
  175    HA   GLU  15           HA       GLU  15  38.938  13.095  -8.373
  176   1HB   GLU  15          2HB       GLU  15  39.037  15.612  -8.985
  177   2HB   GLU  15          3HB       GLU  15  40.599  15.270  -9.702
  178   1HG   GLU  15          2HG       GLU  15  39.245  13.284 -10.900
  179   2HG   GLU  15          3HG       GLU  15  37.866  14.311 -10.559
  180    H    ARG  16           HN       ARG  16  39.741  11.438  -9.714
  181    HA   ARG  16           HA       ARG  16  42.627  11.320  -9.943
  182   1HB   ARG  16          2HB       ARG  16  40.855   9.440  -8.470
  183   2HB   ARG  16          3HB       ARG  16  41.922   8.640  -9.607
  184   1HG   ARG  16          2HG       ARG  16  43.423  10.680  -8.182
  185   2HG   ARG  16          3HG       ARG  16  42.578   9.678  -7.019
  186   1HD   ARG  16          2HD       ARG  16  43.904   8.185  -9.245
  187   2HD   ARG  16          3HD       ARG  16  44.996   9.012  -8.152
  188    HE   ARG  16           HE       ARG  16  43.231   6.744  -7.493
  189   1HH1  ARG  16          2HH2      ARG  16  45.247   9.346  -6.247
  190   2HH1  ARG  16          1HH2      ARG  16  45.463   8.606  -4.695
  191   1HH2  ARG  16          2HH1      ARG  16  43.516   5.769  -5.446
  192   2HH2  ARG  16          1HH1      ARG  16  44.473   6.559  -4.237
  193    H    ARG  17           HN       ARG  17  43.369  10.154 -11.843
  194    HA   ARG  17           HA       ARG  17  41.780  10.395 -14.029
  195   1HB   ARG  17          2HB       ARG  17  44.357   9.078 -13.366
  196   2HB   ARG  17          3HB       ARG  17  43.545   8.342 -14.733
  197   1HG   ARG  17          2HG       ARG  17  43.238  10.782 -15.622
  198   2HG   ARG  17          3HG       ARG  17  44.433  11.234 -14.423
  199   1HD   ARG  17          2HD       ARG  17  46.007   9.505 -15.409
  200   2HD   ARG  17          3HD       ARG  17  44.823   9.189 -16.662
  201    HE   ARG  17           HE       ARG  17  46.507  11.593 -16.403
  202   1HH1  ARG  17          2HH2      ARG  17  43.692  10.143 -17.936
  203   2HH1  ARG  17          1HH2      ARG  17  43.681  11.257 -19.262
  204   1HH2  ARG  17          2HH1      ARG  17  46.494  13.064 -18.151
  205   2HH2  ARG  17          1HH1      ARG  17  45.285  12.931 -19.385
  206    H    ARG  18           HN       ARG  18  40.244   9.096 -15.063
  207    HA   ARG  18           HA       ARG  18  39.870   6.463 -13.875
  208   1HB   ARG  18          2HB       ARG  18  37.421   6.738 -14.314
  209   2HB   ARG  18          3HB       ARG  18  38.024   7.967 -13.220
  210   1HG   ARG  18          2HG       ARG  18  38.414   9.137 -15.733
  211   2HG   ARG  18          3HG       ARG  18  36.911   8.261 -15.945
  212   1HD   ARG  18          2HD       ARG  18  35.774   9.526 -14.330
  213   2HD   ARG  18          3HD       ARG  18  37.228   9.882 -13.422
  214    HE   ARG  18           HE       ARG  18  37.680  11.708 -14.854
  215   1HH1  ARG  18          2HH2      ARG  18  35.022   9.784 -16.122
  216   2HH1  ARG  18          1HH2      ARG  18  34.565  10.963 -17.307
  217   1HH2  ARG  18          2HH1      ARG  18  37.079  13.263 -16.418
  218   2HH2  ARG  18          1HH1      ARG  18  35.743  12.955 -17.476
  219    H    SER  19           HN       SER  19  41.594   6.402 -15.898
  220    HA   SER  19           HA       SER  19  42.008   5.972 -18.016
  221   1HB   SER  19          2HB       SER  19  40.693   3.888 -16.823
  222   2HB   SER  19          3HB       SER  19  39.665   4.128 -18.221
  223    HG   SER  19           HG       SER  19  41.943   4.193 -19.375
  224    H    GLN  20           HN       GLN  20  39.955   4.882 -19.995
  225    HA   GLN  20           HA       GLN  20  39.043   7.479 -20.842
  226   1HB   GLN  20          2HB       GLN  20  39.698   4.900 -22.131
  227   2HB   GLN  20          3HB       GLN  20  38.261   5.652 -22.795
  228   1HG   GLN  20          2HG       GLN  20  40.201   6.461 -24.038
  229   2HG   GLN  20          3HG       GLN  20  39.545   7.792 -23.106
  230   1HE2  GLN  20          1HE2      GLN  20  42.235   5.833 -23.755
  231   2HE2  GLN  20          2HE2      GLN  20  43.336   6.441 -22.565
  232    H    LEU  21           HN       LEU  21  37.726   6.441 -18.514
  233    HA   LEU  21           HA       LEU  21  35.384   5.047 -19.111
  234   1HB   LEU  21          2HB       LEU  21  36.579   5.570 -16.871
  235   2HB   LEU  21          3HB       LEU  21  35.631   7.043 -16.882
  236    HG   LEU  21           HG       LEU  21  34.752   4.209 -16.523
  237   1HD1  LEU  21          1HD1      LEU  21  34.162   6.862 -15.204
  238   2HD1  LEU  21          2HD1      LEU  21  33.228   5.385 -14.861
  239   3HD1  LEU  21          3HD1      LEU  21  34.975   5.432 -14.522
  240   1HD2  LEU  21          1HD2      LEU  21  32.364   5.013 -16.945
  241   2HD2  LEU  21          2HD2      LEU  21  33.099   6.356 -17.853
  242   3HD2  LEU  21          3HD2      LEU  21  33.378   4.675 -18.369
  243    H    ASP  22           HN       ASP  22  34.580   5.949 -21.103
  244    HA   ASP  22           HA       ASP  22  34.020   8.629 -21.409
  245   1HB   ASP  22          2HB       ASP  22  33.211   6.061 -22.696
  246   2HB   ASP  22          3HB       ASP  22  32.086   7.381 -22.942
  247    H    ARG  23           HN       ARG  23  31.686   9.558 -21.605
  248    HA   ARG  23           HA       ARG  23  30.392   9.193 -19.177
  249   1HB   ARG  23          2HB       ARG  23  30.412  11.224 -20.873
  250   2HB   ARG  23          3HB       ARG  23  29.048  10.414 -21.616
  251   1HG   ARG  23          2HG       ARG  23  28.317  12.096 -19.922
  252   2HG   ARG  23          3HG       ARG  23  27.785  10.479 -19.505
  253   1HD   ARG  23          2HD       ARG  23  29.068  10.412 -17.606
  254   2HD   ARG  23          3HD       ARG  23  30.460  11.114 -18.406
  255    HE   ARG  23           HE       ARG  23  28.704  13.250 -18.215
  256   1HH1  ARG  23          2HH2      ARG  23  30.032  10.965 -15.891
  257   2HH1  ARG  23          1HH2      ARG  23  29.964  12.078 -14.566
  258   1HH2  ARG  23          2HH1      ARG  23  28.615  14.718 -16.467
  259   2HH2  ARG  23          1HH1      ARG  23  29.153  14.228 -14.895
  260    H    ASP  24           HN       ASP  24  30.425   7.240 -21.941
  261    HA   ASP  24           HA       ASP  24  27.846   6.121 -21.184
  262   1HB   ASP  24          2HB       ASP  24  28.945   6.818 -23.896
  263   2HB   ASP  24          3HB       ASP  24  28.026   5.330 -23.779
  264    H    GLN  25           HN       GLN  25  30.665   5.526 -20.336
  265    HA   GLN  25           HA       GLN  25  30.908   2.876 -21.533
  266   1HB   GLN  25          2HB       GLN  25  32.898   4.988 -21.049
  267   2HB   GLN  25          3HB       GLN  25  33.379   3.462 -20.334
  268   1HG   GLN  25          2HG       GLN  25  32.252   3.185 -23.068
  269   2HG   GLN  25          3HG       GLN  25  33.710   4.155 -23.007
  270   1HE2  GLN  25          1HE2      GLN  25  35.438   3.034 -23.431
  271   2HE2  GLN  25          2HE2      GLN  25  35.794   1.412 -22.937
  272    H    CYS  26           HN       CYS  26  30.657   1.154 -20.157
  273    HA   CYS  26           HA       CYS  26  29.785   1.533 -17.571
  274   1HB   CYS  26          2HB       CYS  26  29.302  -0.487 -18.863
  275   2HB   CYS  26          3HB       CYS  26  30.992  -0.947 -18.839
  276    H    ALA  27           HN       ALA  27  30.850   1.759 -15.599
  277    HA   ALA  27           HA       ALA  27  33.771   1.821 -15.747
  278   1HB   ALA  27          1HB       ALA  27  33.691   3.466 -14.132
  279   2HB   ALA  27          2HB       ALA  27  32.105   3.734 -14.895
  280   3HB   ALA  27          3HB       ALA  27  32.219   2.808 -13.379
  281    H    TYR  28           HN       TYR  28  32.277  -0.715 -15.713
  282    HA   TYR  28           HA       TYR  28  33.241  -1.699 -13.116
  283   1HB   TYR  28          2HB       TYR  28  30.647  -1.463 -13.576
  284   2HB   TYR  28          3HB       TYR  28  30.863  -2.726 -14.771
  285    HD1  TYR  28           HD1      TYR  28  30.455  -1.978 -11.259
  286    HD2  TYR  28           HD2      TYR  28  31.674  -5.011 -14.020
  287    HE1  TYR  28           HE1      TYR  28  30.173  -3.746  -9.454
  288    HE2  TYR  28           HE2      TYR  28  31.387  -6.768 -12.205
  289    HH   TYR  28           HH       TYR  28  29.864  -6.010  -9.188
  290    H    CYS  29           HN       CYS  29  31.998  -2.913 -16.317
  291    HA   CYS  29           HA       CYS  29  34.075  -4.938 -16.220
  292   1HB   CYS  29          2HB       CYS  29  32.859  -5.995 -18.071
  293   2HB   CYS  29          3HB       CYS  29  31.810  -5.711 -16.696
  294    H    LYS  30           HN       LYS  30  33.149  -1.891 -17.731
  295    HA   LYS  30           HA       LYS  30  34.548  -0.511 -18.855
  296   1HB   LYS  30          2HB       LYS  30  36.398  -2.329 -18.214
  297   2HB   LYS  30          3HB       LYS  30  36.290  -2.690 -19.925
  298   1HG   LYS  30          2HG       LYS  30  37.564  -0.875 -20.387
  299   2HG   LYS  30          3HG       LYS  30  36.326   0.164 -19.714
  300   1HD   LYS  30          2HD       LYS  30  37.928  -1.192 -17.629
  301   2HD   LYS  30          3HD       LYS  30  38.905  -0.191 -18.685
  302   1HE   LYS  30          2HE       LYS  30  36.343   1.053 -17.777
  303   2HE   LYS  30          3HE       LYS  30  37.516   0.763 -16.509
  304   1HZ   LYS  30          1HZ       LYS  30  39.130   1.979 -17.766
  305   2HZ   LYS  30          2HZ       LYS  30  38.098   2.186 -19.014
  306   3HZ   LYS  30          3HZ       LYS  30  37.798   2.905 -17.579
  307    H    GLU  31           HN       GLU  31  32.146  -2.165 -19.620
  308    HA   GLU  31           HA       GLU  31  32.599  -2.471 -22.456
  309   1HB   GLU  31          2HB       GLU  31  30.274  -3.191 -20.628
  310   2HB   GLU  31          3HB       GLU  31  30.177  -3.346 -22.371
  311   1HG   GLU  31          2HG       GLU  31  32.542  -4.579 -20.948
  312   2HG   GLU  31          3HG       GLU  31  30.991  -5.389 -20.842
  313    H    LYS  32           HN       LYS  32  32.045  -0.913 -23.923
  314    HA   LYS  32           HA       LYS  32  30.754   1.460 -22.925
  315   1HB   LYS  32          2HB       LYS  32  32.692   1.720 -24.336
  316   2HB   LYS  32          3HB       LYS  32  31.983   0.731 -25.596
  317   1HG   LYS  32          2HG       LYS  32  30.003   2.541 -25.434
  318   2HG   LYS  32          3HG       LYS  32  31.274   3.545 -24.766
  319   1HD   LYS  32          2HD       LYS  32  32.343   3.762 -26.782
  320   2HD   LYS  32          3HD       LYS  32  32.119   2.074 -27.195
  321   1HE   LYS  32          2HE       LYS  32  30.606   2.852 -28.722
  322   2HE   LYS  32          3HE       LYS  32  29.518   2.986 -27.354
  323   1HZ   LYS  32          1HZ       LYS  32  29.692   5.038 -28.592
  324   2HZ   LYS  32          2HZ       LYS  32  30.227   5.248 -27.063
  325   3HZ   LYS  32          3HZ       LYS  32  31.295   5.131 -28.293
  326    H    GLY  33           HN       GLY  33  28.617   1.899 -23.043
  327   1HA   GLY  33          1HA       GLY  33  26.802   1.804 -24.861
  328   2HA   GLY  33          2HA       GLY  33  26.960   0.071 -24.650
  329    H    HIS  34           HN       HIS  34  27.343  -0.218 -21.888
  330    HA   HIS  34           HA       HIS  34  24.835   0.905 -20.870
  331   1HB   HIS  34          2HB       HIS  34  24.529  -1.089 -19.582
  332   2HB   HIS  34          3HB       HIS  34  24.806  -1.541 -21.253
  333    HD1  HIS  34           HD1      HIS  34  26.679  -3.175 -21.710
  334    HD2  HIS  34           HD2      HIS  34  26.892  -1.506 -17.867
  335    HE1  HIS  34           HE1      HIS  34  28.531  -4.433 -20.486
  336    H    TRP  35           HN       TRP  35  24.814   1.131 -18.401
  337    HA   TRP  35           HA       TRP  35  27.364   2.332 -17.633
  338   1HB   TRP  35          2HB       TRP  35  24.509   2.817 -16.985
  339   2HB   TRP  35          3HB       TRP  35  25.660   3.073 -15.688
  340    HD1  TRP  35           HD1      TRP  35  26.119   4.012 -19.456
  341    HE1  TRP  35           HE1      TRP  35  26.657   6.583 -19.707
  342    HE3  TRP  35           HE3      TRP  35  25.652   5.128 -14.518
  343    HZ2  TRP  35           HZ2      TRP  35  26.822   8.747 -17.855
  344    HZ3  TRP  35           HZ3      TRP  35  26.018   7.494 -13.822
  345    HH2  TRP  35           HH2      TRP  35  26.585   9.273 -15.400
  346    H    ALA  36           HN       ALA  36  28.075   1.963 -15.321
  347    HA   ALA  36           HA       ALA  36  28.300  -0.758 -14.794
  348   1HB   ALA  36          1HB       ALA  36  28.649   1.588 -12.884
  349   2HB   ALA  36          2HB       ALA  36  29.387  -0.025 -12.738
  350   3HB   ALA  36          3HB       ALA  36  29.865   1.055 -14.069
  351    H    LYS  37           HN       LYS  37  25.996   1.741 -13.645
  352    HA   LYS  37           HA       LYS  37  24.863   0.141 -11.621
  353   1HB   LYS  37          2HB       LYS  37  24.191   2.700 -13.007
  354   2HB   LYS  37          3HB       LYS  37  22.905   1.887 -12.138
  355   1HG   LYS  37          2HG       LYS  37  23.724   2.817 -10.237
  356   2HG   LYS  37          3HG       LYS  37  25.086   1.724 -10.372
  357   1HD   LYS  37          2HD       LYS  37  25.431   4.007 -12.171
  358   2HD   LYS  37          3HD       LYS  37  25.142   4.559 -10.533
  359   1HE   LYS  37          2HE       LYS  37  27.206   3.886  -9.844
  360   2HE   LYS  37          3HE       LYS  37  26.997   2.291 -10.538
  361   1HZ   LYS  37          1HZ       LYS  37  28.685   3.187 -11.768
  362   2HZ   LYS  37          2HZ       LYS  37  27.407   3.512 -12.731
  363   3HZ   LYS  37          3HZ       LYS  37  28.052   4.692 -11.806
  364    H    ASP  38           HN       ASP  38  24.882  -0.178 -15.007
  365    HA   ASP  38           HA       ASP  38  22.495  -1.836 -14.804
  366   1HB   ASP  38          2HB       ASP  38  22.607   0.454 -16.305
  367   2HB   ASP  38          3HB       ASP  38  23.233  -0.692 -17.475
  368    H    CYS  39           HN       CYS  39  25.462  -2.363 -14.490
  369    HA   CYS  39           HA       CYS  39  26.388  -3.532 -16.894
  370   1HB   CYS  39          2HB       CYS  39  27.886  -2.658 -15.108
  371   2HB   CYS  39          3HB       CYS  39  27.371  -3.958 -14.052
  372    HA   PRO  40           HA       PRO  40  24.173  -7.275 -16.404
  373   1HB   PRO  40          2HB       PRO  40  25.270  -8.678 -18.478
  374   2HB   PRO  40          3HB       PRO  40  23.959  -7.532 -18.682
  375   1HG   PRO  40          2HG       PRO  40  26.818  -7.220 -19.367
  376   2HG   PRO  40          3HG       PRO  40  25.445  -6.291 -19.936
  377   1HD   PRO  40          2HD       PRO  40  27.363  -5.485 -17.962
  378   2HD   PRO  40          3HD       PRO  40  25.927  -4.607 -18.446
  379    H    LYS  41           HN       LYS  41  27.246  -6.738 -15.539
  380    HA   LYS  41           HA       LYS  41  27.828  -9.539 -15.017
  381   1HB   LYS  41          2HB       LYS  41  29.620  -8.204 -15.950
  382   2HB   LYS  41          3HB       LYS  41  29.458  -7.006 -14.681
  383   1HG   LYS  41          2HG       LYS  41  30.530  -8.316 -13.106
  384   2HG   LYS  41          3HG       LYS  41  29.855  -9.809 -13.726
  385   1HD   LYS  41          2HD       LYS  41  31.416  -9.451 -15.788
  386   2HD   LYS  41          3HD       LYS  41  32.229  -8.243 -14.812
  387   1HE   LYS  41          2HE       LYS  41  33.397  -9.868 -13.745
  388   2HE   LYS  41          3HE       LYS  41  31.904 -10.576 -13.160
  389   1HZ   LYS  41          1HZ       LYS  41  33.226 -12.077 -14.532
  390   2HZ   LYS  41          2HZ       LYS  41  31.736 -11.838 -15.153
  391   3HZ   LYS  41          3HZ       LYS  41  33.028 -11.098 -15.824
  392    H    LYS  42           HN       LYS  42  26.422  -6.722 -13.526
  393    HA   LYS  42           HA       LYS  42  27.098  -7.227 -10.865
  394   1HB   LYS  42          2HB       LYS  42  25.161  -5.570 -12.351
  395   2HB   LYS  42          3HB       LYS  42  24.638  -6.019 -10.741
  396   1HG   LYS  42          2HG       LYS  42  27.281  -5.342 -10.271
  397   2HG   LYS  42          3HG       LYS  42  26.881  -4.246 -11.578
  398   1HD   LYS  42          2HD       LYS  42  24.780  -4.435  -9.482
  399   2HD   LYS  42          3HD       LYS  42  26.308  -3.804  -8.899
  400   1HE   LYS  42          2HE       LYS  42  26.128  -2.356 -11.189
  401   2HE   LYS  42          3HE       LYS  42  24.419  -2.637 -10.928
  402   1HZ   LYS  42          1HZ       LYS  42  25.980  -0.790  -9.670
  403   2HZ   LYS  42          2HZ       LYS  42  24.438  -1.176  -9.298
  404   3HZ   LYS  42          3HZ       LYS  42  25.673  -1.910  -8.522
  405    HA   PRO  43           HA       PRO  43  24.760 -10.918 -10.490
  406   1HB   PRO  43          2HB       PRO  43  25.844 -11.741  -8.121
  407   2HB   PRO  43          3HB       PRO  43  26.551 -12.116  -9.680
  408   1HG   PRO  43          2HG       PRO  43  27.443 -10.143  -7.666
  409   2HG   PRO  43          3HG       PRO  43  28.343 -10.830  -9.004
  410   1HD   PRO  43          2HD       PRO  43  27.185  -8.209  -8.881
  411   2HD   PRO  43          3HD       PRO  43  27.983  -8.939 -10.260
  412    H    ARG  44           HN       ARG  44  23.368 -12.000  -8.720
  413    HA   ARG  44           HA       ARG  44  21.402 -10.254  -8.137
  414   1HB   ARG  44          2HB       ARG  44  20.607 -11.964  -6.487
  415   2HB   ARG  44          3HB       ARG  44  21.132 -12.702  -7.987
  416   1HG   ARG  44          2HG       ARG  44  23.465 -12.539  -6.356
  417   2HG   ARG  44          3HG       ARG  44  22.182 -13.080  -5.290
  418   1HD   ARG  44          2HD       ARG  44  22.868 -14.358  -7.983
  419   2HD   ARG  44          3HD       ARG  44  23.358 -14.988  -6.423
  420    HE   ARG  44           HE       ARG  44  20.744 -15.262  -7.636
  421   1HH1  ARG  44          2HH2      ARG  44  22.346 -14.919  -4.522
  422   2HH1  ARG  44          1HH2      ARG  44  21.083 -15.712  -3.641
  423   1HH2  ARG  44          2HH1      ARG  44  19.077 -16.308  -6.474
  424   2HH2  ARG  44          1HH1      ARG  44  19.212 -16.507  -4.759
  425    H    GLY  45           HN       GLY  45  21.144  -8.593  -6.663
  426   1HA   GLY  45          1HA       GLY  45  21.712  -8.492  -4.042
  427   2HA   GLY  45          2HA       GLY  45  23.266  -8.100  -4.752
  428    HA   PRO  46           HA       PRO  46  23.434  -6.848  -3.194
  429   1HB   PRO  46          2HB       PRO  46  23.056  -5.004  -1.212
  430   2HB   PRO  46          3HB       PRO  46  24.249  -4.815  -2.481
  431   1HG   PRO  46          2HG       PRO  46  21.644  -3.453  -2.169
  432   2HG   PRO  46          3HG       PRO  46  23.013  -2.990  -3.161
  433   1HD   PRO  46          2HD       PRO  46  20.580  -4.217  -4.058
  434   2HD   PRO  46          3HD       PRO  46  21.995  -3.860  -5.029
  435    H    ARG  47           HN       ARG  47  23.322  -7.625  -0.865
  436    HA   ARG  47           HA       ARG  47  20.535  -8.202  -0.297
  437   1HB   ARG  47          2HB       ARG  47  22.488 -10.100  -1.198
  438   2HB   ARG  47          3HB       ARG  47  22.234 -10.432   0.504
  439   1HG   ARG  47          2HG       ARG  47  19.873 -10.024  -1.368
  440   2HG   ARG  47          3HG       ARG  47  20.658 -11.586  -1.246
  441   1HD   ARG  47          2HD       ARG  47  19.286 -11.981   0.532
  442   2HD   ARG  47          3HD       ARG  47  20.317 -10.890   1.436
  443    HE   ARG  47           HE       ARG  47  18.210  -9.557  -0.133
  444   1HH1  ARG  47          2HH2      ARG  47  19.114 -10.937   2.975
  445   2HH1  ARG  47          1HH2      ARG  47  17.912 -10.057   3.859
  446   1HH2  ARG  47          2HH1      ARG  47  16.623  -8.397   1.032
  447   2HH2  ARG  47          1HH1      ARG  47  16.485  -8.603   2.747
  448    H    GLY  48           HN       GLY  48  20.660  -6.575   1.395
  449   1HA   GLY  48          1HA       GLY  48  21.294  -7.458   3.928
  450   2HA   GLY  48          2HA       GLY  48  22.718  -6.608   3.365
  451    HA   PRO  49           HA       PRO  49  19.038  -3.607   3.813
  452   1HB   PRO  49          2HB       PRO  49  17.202  -4.264   5.727
  453   2HB   PRO  49          3HB       PRO  49  16.952  -4.562   4.019
  454   1HG   PRO  49          2HG       PRO  49  17.629  -6.489   6.156
  455   2HG   PRO  49          3HG       PRO  49  16.968  -6.803   4.563
  456   1HD   PRO  49          2HD       PRO  49  19.683  -7.195   5.403
  457   2HD   PRO  49          3HD       PRO  49  19.047  -7.398   3.782
  458    H    ARG  50           HN       ARG  50  21.437  -3.329   4.726
  459    HA   ARG  50           HA       ARG  50  22.636  -2.278   6.182
  460   1HB   ARG  50          2HB       ARG  50  20.136  -0.989   6.336
  461   2HB   ARG  50          3HB       ARG  50  20.539  -1.285   8.014
  462   1HG   ARG  50          2HG       ARG  50  21.680   0.707   7.765
  463   2HG   ARG  50          3HG       ARG  50  22.950  -0.365   7.212
  464   1HD   ARG  50          2HD       ARG  50  20.937   0.617   5.183
  465   2HD   ARG  50          3HD       ARG  50  22.162   1.739   5.740
  466    HE   ARG  50           HE       ARG  50  23.433  -0.742   5.073
  467   1HH1  ARG  50          2HH2      ARG  50  21.836   1.985   3.524
  468   2HH1  ARG  50          1HH2      ARG  50  22.712   1.818   2.039
  469   1HH2  ARG  50          2HH1      ARG  50  24.588  -0.962   3.114
  470   2HH2  ARG  50          1HH1      ARG  50  24.287   0.131   1.804
  471    HA   PRO  51           HA       PRO  51  22.825  -5.164   9.475
  472   1HB   PRO  51          2HB       PRO  51  25.232  -4.425  10.539
  473   2HB   PRO  51          3HB       PRO  51  25.082  -5.491   9.157
  474   1HG   PRO  51          2HG       PRO  51  25.889  -2.648   9.225
  475   2HG   PRO  51          3HG       PRO  51  26.136  -3.829   7.954
  476   1HD   PRO  51          2HD       PRO  51  24.180  -1.732   7.991
  477   2HD   PRO  51          3HD       PRO  51  24.353  -2.984   6.777
  478    H    GLN  52           HN       GLN  52  23.569  -1.802  10.195
  479    HA   GLN  52           HA       GLN  52  23.202  -0.605  11.983
  480   1HB   GLN  52          2HB       GLN  52  20.885  -0.888  11.006
  481   2HB   GLN  52          3HB       GLN  52  20.595  -2.177  12.156
  482   1HG   GLN  52          2HG       GLN  52  20.255  -0.720  13.883
  483   2HG   GLN  52          3HG       GLN  52  21.651   0.250  13.459
  484   1HE2  GLN  52          1HE2      GLN  52  18.457   0.367  13.864
  485   2HE2  GLN  52          2HE2      GLN  52  17.992   1.625  12.767
  486    H    THR  53           HN       THR  53  24.811  -1.250  13.457
  487    HA   THR  53           HA       THR  53  24.709  -3.621  14.946
  488    HB   THR  53           HB       THR  53  26.116  -0.933  15.366
  489    HG1  THR  53           HG1      THR  53  26.921  -1.968  13.524
  490   1HG2  THR  53          1HG2      THR  53  27.753  -2.853  16.447
  491   2HG2  THR  53          2HG2      THR  53  26.641  -1.866  17.425
  492   3HG2  THR  53          3HG2      THR  53  26.163  -3.502  16.912
  493    H    SER  54           HN       SER  54  23.005  -4.195  16.167
  494    HA   SER  54           HA       SER  54  21.465  -2.242  17.489
  495   1HB   SER  54          2HB       SER  54  21.013  -4.809  16.675
  496   2HB   SER  54          3HB       SER  54  21.317  -5.097  18.376
  497    HG   SER  54           HG       SER  54  19.146  -3.811  17.127
  498    H    LEU  55           HN       LEU  55  22.903  -1.072  18.888
  499    HA   LEU  55           HA       LEU  55  24.094  -2.676  21.034
  500   1HB   LEU  55          2HB       LEU  55  25.550  -0.759  21.414
  501   2HB   LEU  55          3HB       LEU  55  25.708  -1.418  19.798
  502    HG   LEU  55           HG       LEU  55  23.773   0.788  19.964
  503   1HD1  LEU  55          1HD1      LEU  55  26.076   2.286  19.949
  504   2HD1  LEU  55          2HD1      LEU  55  24.952   2.120  21.318
  505   3HD1  LEU  55          3HD1      LEU  55  26.402   1.092  21.228
  506   1HD2  LEU  55          1HD2      LEU  55  25.346  -0.464  18.028
  507   2HD2  LEU  55          2HD2      LEU  55  24.325   0.979  17.821
  508   3HD2  LEU  55          3HD2      LEU  55  26.052   1.159  18.209
  509    H    LEU  56           HN       LEU  56  22.308  -2.968  22.390
  510    HA   LEU  56           HA       LEU  56  21.688  -0.726  24.019
  511   1HB   LEU  56          2HB       LEU  56  20.196  -0.050  22.345
  512   2HB   LEU  56          3HB       LEU  56  19.660  -1.687  22.022
  513    HG   LEU  56           HG       LEU  56  18.964  -1.316  24.685
  514   1HD1  LEU  56          1HD1      LEU  56  17.696   1.067  23.572
  515   2HD1  LEU  56          2HD1      LEU  56  18.454   0.801  25.160
  516   3HD1  LEU  56          3HD1      LEU  56  19.458   1.243  23.758
  517   1HD2  LEU  56          1HD2      LEU  56  16.686  -1.354  23.886
  518   2HD2  LEU  56          2HD2      LEU  56  17.209  -0.862  22.257
  519   3HD2  LEU  56          3HD2      LEU  56  17.679  -2.454  22.900
  Start of MODEL    9
    1   1H5*    C 504          1H5*        C 504  36.556  -4.045  -1.928
    2   2H5*    C 504          2H5*        C 504  37.118  -3.486  -3.503
    3    H4*    C 504           H4*        C 504  37.311  -6.009  -2.799
    4    H3*    C 504           H3*        C 504  36.232  -5.523  -5.587
    5    H2*    C 504           H2*        C 504  37.615  -7.400  -6.008
    6   2HO*    C 504          2HO*        C 504  39.531  -7.257  -4.999
    7    H1*    C 504           H1*        C 504  36.976  -8.072  -3.155
    8   1H4     C 504          1H4         C 504  35.238 -13.520  -5.926
    9   2H4     C 504          2H4         C 504  34.426 -12.652  -7.211
   10    H5     C 504           H5         C 504  34.382 -10.297  -7.385
   11    H6     C 504           H6         C 504  35.112  -8.173  -6.357
   12   1H5*    C 505          1H5*        C 505  40.609  -6.236  -7.493
   13   2H5*    C 505          2H5*        C 505  40.156  -4.931  -8.588
   14    H4*    C 505           H4*        C 505  40.556  -7.196  -9.632
   15    H3*    C 505           H3*        C 505  38.104  -5.548 -10.116
   16    H2*    C 505           H2*        C 505  37.224  -7.187 -11.587
   17   2HO*    C 505          2HO*        C 505  39.022  -9.129 -11.547
   18    H1*    C 505           H1*        C 505  37.797  -9.306  -9.805
   19   1H4     C 505          1H4         C 505  31.608  -8.039  -8.876
   20   2H4     C 505          2H4         C 505  32.049  -6.701  -7.838
   21    H5     C 505           H5         C 505  34.272  -5.978  -7.499
   22    H6     C 505           H6         C 505  36.641  -6.364  -8.077
   23   1H5*    U 506          1H5*        U 506  39.991  -1.711 -10.561
   24   2H5*    U 506          2H5*        U 506  38.780  -1.804  -9.283
   25    H4*    U 506           H4*        U 506  37.947  -0.877 -11.438
   26    H3*    U 506           H3*        U 506  36.647  -3.354 -10.295
   27    H2*    U 506           H2*        U 506  34.968  -3.160 -11.935
   28   2HO*    U 506          2HO*        U 506  35.974  -0.762 -12.986
   29    H1*    U 506           H1*        U 506  36.939  -2.339 -13.904
   30    H3     U 506           H3         U 506  36.940  -6.207 -16.206
   31    H5     U 506           H5         U 506  35.112  -7.256 -12.588
   32    H6     U 506           H6         U 506  35.617  -4.993 -11.789
   33   1H5*    C 507          1H5*        C 507  34.718   1.012 -10.996
   34   2H5*    C 507          2H5*        C 507  34.429   1.061  -9.257
   35    H4*    C 507           H4*        C 507  32.966   2.404 -11.089
   36    H3*    C 507           H3*        C 507  32.325   1.473  -8.316
   37    H2*    C 507           H2*        C 507  30.082   2.234  -8.527
   38   2HO*    C 507          2HO*        C 507  31.067   3.197 -11.059
   39    H1*    C 507           H1*        C 507  29.684   0.976 -10.985
   40   1H4     C 507          1H4         C 507  27.637  -3.243  -6.641
   41   2H4     C 507          2H4         C 507  29.274  -3.842  -6.483
   42    H5     C 507           H5         C 507  31.141  -2.862  -7.548
   43    H6     C 507           H6         C 507  31.906  -1.049  -9.039
   44   1H5*    C 508          1H5*        C 508  34.563   5.616  -5.871
   45   2H5*    C 508          2H5*        C 508  32.989   6.163  -6.446
   46    H4*    C 508           H4*        C 508  34.486   8.039  -6.264
   47    H3*    C 508           H3*        C 508  33.645   7.251  -9.032
   48    H2*    C 508           H2*        C 508  34.866   9.060  -9.960
   49   2HO*    C 508          2HO*        C 508  34.805  10.744  -8.592
   50    H1*    C 508           H1*        C 508  37.145   8.485  -8.354
   51   1H4     C 508          1H4         C 508  38.957   5.663 -13.748
   52   2H4     C 508          2H4         C 508  37.362   4.980 -13.977
   53    H5     C 508           H5         C 508  35.561   5.315 -12.487
   54    H6     C 508           H6         C 508  34.839   6.398 -10.389
   55   1H5*    G 509          1H5*        G 509  32.846   9.916 -10.815
   56   2H5*    G 509          2H5*        G 509  31.691  10.677  -9.721
   57    H4*    G 509           H4*        G 509  30.925  11.353 -11.783
   58    H3*    G 509           H3*        G 509  29.394   8.945 -10.886
   59    H2*    G 509           H2*        G 509  28.118   8.935 -12.894
   60   2HO*    G 509          2HO*        G 509  28.148  11.298 -12.883
   61    H1*    G 509           H1*        G 509  30.406   9.165 -14.518
   62    H8     G 509           H8         G 509  29.982   6.948 -11.410
   63    H1     G 509           H1         G 509  29.832   3.862 -17.097
   64   1H2     G 509          1H2         G 509  30.006   5.232 -18.628
   65   2H2     G 509          2H2         G 509  30.168   6.959 -18.405
   66   1H5*    U 510          1H5*        U 510  26.736  13.302 -12.169
   67   2H5*    U 510          2H5*        U 510  26.202  13.070 -10.505
   68    H4*    U 510           H4*        U 510  24.489  14.060 -12.014
   69    H3*    U 510           H3*        U 510  23.901  11.462 -10.590
   70    H2*    U 510           H2*        U 510  21.661  11.623 -11.331
   71   2HO*    U 510          2HO*        U 510  21.731  13.941 -10.881
   72    H1*    U 510           H1*        U 510  22.513  12.490 -13.939
   73    H3     U 510           H3         U 510  20.404   8.722 -15.184
   74    H5     U 510           H5         U 510  23.477   7.304 -12.716
   75    H6     U 510           H6         U 510  24.035   9.643 -12.233
   76   1H    ALA   1           HN       ALA   1  73.618 -10.939  17.532
   77    HA   ALA   1           HA       ALA   1  74.068 -11.516  15.060
   78   1HB   ALA   1          1HB       ALA   1  71.758 -13.285  15.105
   79   2HB   ALA   1          2HB       ALA   1  73.368 -13.547  14.393
   80   3HB   ALA   1          3HB       ALA   1  73.077 -13.939  16.105
   81    H    THR   2           HN       THR   2  72.515 -10.588  13.532
   82    HA   THR   2           HA       THR   2  69.927  -9.828  14.280
   83    HB   THR   2           HB       THR   2  71.127  -8.390  15.929
   84    HG1  THR   2           HG1      THR   2  69.206  -7.731  14.472
   85   1HG2  THR   2          1HG2      THR   2  72.950  -7.979  13.733
   86   2HG2  THR   2          2HG2      THR   2  72.152  -6.423  14.066
   87   3HG2  THR   2          3HG2      THR   2  73.032  -7.266  15.363
   88    H    VAL   3           HN       VAL   3  68.872  -9.684  12.409
   89    HA   VAL   3           HA       VAL   3  70.045  -8.201  10.244
   90    HB   VAL   3           HB       VAL   3  69.638 -11.189  10.098
   91   1HG1  VAL   3          1HG1      VAL   3  70.253  -9.365   7.756
   92   2HG1  VAL   3          2HG1      VAL   3  69.890 -11.108   7.728
   93   3HG1  VAL   3          3HG1      VAL   3  68.614  -9.939   8.146
   94   1HG2  VAL   3          1HG2      VAL   3  72.007  -9.341   9.829
   95   2HG2  VAL   3          2HG2      VAL   3  71.823 -10.804  10.827
   96   3HG2  VAL   3          3HG2      VAL   3  72.007 -10.948   9.062
   97    H    VAL   4           HN       VAL   4  68.456  -7.660   8.615
   98    HA   VAL   4           HA       VAL   4  65.818  -8.691   8.803
   99    HB   VAL   4           HB       VAL   4  65.939  -7.242  10.825
  100   1HG1  VAL   4          1HG1      VAL   4  65.716  -4.703  10.216
  101   2HG1  VAL   4          2HG1      VAL   4  67.328  -5.446  10.353
  102   3HG1  VAL   4          3HG1      VAL   4  66.607  -5.172   8.749
  103   1HG2  VAL   4          1HG2      VAL   4  63.847  -7.714   9.374
  104   2HG2  VAL   4          2HG2      VAL   4  63.773  -6.396  10.568
  105   3HG2  VAL   4          3HG2      VAL   4  64.017  -6.023   8.844
  106    H    SER   5           HN       SER   5  64.390  -7.660   7.151
  107    HA   SER   5           HA       SER   5  65.595  -5.793   5.395
  108   1HB   SER   5          2HB       SER   5  66.675  -8.009   4.739
  109   2HB   SER   5          3HB       SER   5  65.082  -8.589   4.294
  110    HG   SER   5           HG       SER   5  66.034  -6.108   3.207
  111    H    GLY   6           HN       GLY   6  64.038  -5.110   3.676
  112   1HA   GLY   6          1HA       GLY   6  61.431  -6.252   3.544
  113   2HA   GLY   6          2HA       GLY   6  61.444  -4.832   4.572
  114    H    GLN   7           HN       GLN   7  60.790  -5.789   1.491
  115    HA   GLN   7           HA       GLN   7  62.186  -3.927  -0.040
  116   1HB   GLN   7          2HB       GLN   7  60.573  -4.487  -1.808
  117   2HB   GLN   7          3HB       GLN   7  61.089  -5.942  -0.978
  118   1HG   GLN   7          2HG       GLN   7  58.971  -5.542   0.545
  119   2HG   GLN   7          3HG       GLN   7  58.438  -4.481  -0.744
  120   1HE2  GLN   7          1HE2      GLN   7  56.961  -6.643  -0.105
  121   2HE2  GLN   7          2HE2      GLN   7  57.025  -7.853  -1.343
  122    H    LYS   8           HN       LYS   8  61.397  -1.934  -1.055
  123    HA   LYS   8           HA       LYS   8  59.091  -0.746   0.289
  124   1HB   LYS   8          2HB       LYS   8  61.903   0.349   0.245
  125   2HB   LYS   8          3HB       LYS   8  60.517   1.411   0.393
  126   1HG   LYS   8          2HG       LYS   8  60.801  -1.009   2.209
  127   2HG   LYS   8          3HG       LYS   8  61.645   0.482   2.578
  128   1HD   LYS   8          2HD       LYS   8  59.646   1.697   2.919
  129   2HD   LYS   8          3HD       LYS   8  58.689   0.600   1.944
  130   1HE   LYS   8          2HE       LYS   8  58.142  -0.625   3.773
  131   2HE   LYS   8          3HE       LYS   8  59.833  -0.903   4.141
  132   1HZ   LYS   8          1HZ       LYS   8  58.033   0.977   5.287
  133   2HZ   LYS   8          2HZ       LYS   8  59.421   0.365   5.891
  134   3HZ   LYS   8          3HZ       LYS   8  59.466   1.648   4.881
  135    H    GLN   9           HN       GLN   9  57.801   0.466  -1.063
  136    HA   GLN   9           HA       GLN   9  58.880   1.446  -3.506
  137   1HB   GLN   9          2HB       GLN   9  57.395  -1.109  -3.434
  138   2HB   GLN   9          3HB       GLN   9  56.697   0.052  -4.546
  139   1HG   GLN   9          2HG       GLN   9  58.461  -0.088  -5.997
  140   2HG   GLN   9          3HG       GLN   9  59.649  -0.040  -4.709
  141   1HE2  GLN   9          1HE2      GLN   9  58.989  -1.779  -7.181
  142   2HE2  GLN   9          2HE2      GLN   9  59.192  -3.407  -6.627
  143    H    ASP  10           HN       ASP  10  57.030   2.569  -4.824
  144    HA   ASP  10           HA       ASP  10  54.912   3.369  -3.003
  145   1HB   ASP  10          2HB       ASP  10  56.647   5.224  -4.700
  146   2HB   ASP  10          3HB       ASP  10  55.198   5.737  -3.858
  147    H    ARG  11           HN       ARG  11  56.294   3.880  -6.346
  148    HA   ARG  11           HA       ARG  11  55.412   3.876  -8.319
  149   1HB   ARG  11          2HB       ARG  11  53.863   1.713  -6.920
  150   2HB   ARG  11          3HB       ARG  11  53.227   2.238  -8.467
  151   1HG   ARG  11          2HG       ARG  11  55.384   1.773  -9.568
  152   2HG   ARG  11          3HG       ARG  11  56.130   1.392  -8.029
  153   1HD   ARG  11          2HD       ARG  11  54.047  -0.355  -7.914
  154   2HD   ARG  11          3HD       ARG  11  54.194  -0.234  -9.657
  155    HE   ARG  11           HE       ARG  11  56.742  -0.673  -8.245
  156   1HH1  ARG  11          2HH2      ARG  11  53.999  -2.167  -9.865
  157   2HH1  ARG  11          1HH2      ARG  11  54.837  -3.647 -10.195
  158   1HH2  ARG  11          2HH1      ARG  11  57.848  -2.624  -8.680
  159   2HH2  ARG  11          1HH1      ARG  11  57.041  -3.908  -9.516
  160    H    GLN  12           HN       GLN  12  54.535   5.874  -8.842
  161    HA   GLN  12           HA       GLN  12  51.857   6.394  -7.812
  162   1HB   GLN  12          2HB       GLN  12  53.738   7.976  -7.135
  163   2HB   GLN  12          3HB       GLN  12  53.878   8.441  -8.819
  164   1HG   GLN  12          2HG       GLN  12  51.756   9.483  -8.856
  165   2HG   GLN  12          3HG       GLN  12  51.157   8.548  -7.500
  166   1HE2  GLN  12          1HE2      GLN  12  50.559  10.145  -6.171
  167   2HE2  GLN  12          2HE2      GLN  12  51.620  11.317  -5.461
  168    H    GLY  13           HN       GLY  13  53.996   7.194 -10.652
  169   1HA   GLY  13          1HA       GLY  13  53.434   6.578 -12.856
  170   2HA   GLY  13          2HA       GLY  13  51.736   6.549 -12.423
  171    H    GLY  14           HN       GLY  14  52.317   7.938 -14.677
  172   1HA   GLY  14          1HA       GLY  14  52.310  10.772 -13.822
  173   2HA   GLY  14          2HA       GLY  14  53.006  10.193 -15.323
  174    H    GLU  15           HN       GLU  15  49.872   9.538 -13.588
  175    HA   GLU  15           HA       GLU  15  48.336  10.978 -15.381
  176   1HB   GLU  15          2HB       GLU  15  49.081   9.163 -16.967
  177   2HB   GLU  15          3HB       GLU  15  48.303   7.979 -15.936
  178   1HG   GLU  15          2HG       GLU  15  46.308   9.925 -16.327
  179   2HG   GLU  15          3HG       GLU  15  47.102   9.835 -17.885
  180    H    ARG  16           HN       ARG  16  46.201  11.145 -14.597
  181    HA   ARG  16           HA       ARG  16  45.084   9.149 -12.994
  182   1HB   ARG  16          2HB       ARG  16  46.718  10.076 -11.330
  183   2HB   ARG  16          3HB       ARG  16  46.029  11.673 -11.540
  184   1HG   ARG  16          2HG       ARG  16  44.671  11.113  -9.793
  185   2HG   ARG  16          3HG       ARG  16  43.760  10.201 -10.980
  186   1HD   ARG  16          2HD       ARG  16  44.853   8.136 -10.402
  187   2HD   ARG  16          3HD       ARG  16  46.137   8.958  -9.540
  188    HE   ARG  16           HE       ARG  16  43.439   9.435  -8.455
  189   1HH1  ARG  16          2HH2      ARG  16  46.347   7.459  -8.305
  190   2HH1  ARG  16          1HH2      ARG  16  46.034   6.893  -6.698
  191   1HH2  ARG  16          2HH1      ARG  16  43.027   8.690  -6.335
  192   2HH2  ARG  16          1HH1      ARG  16  44.132   7.599  -5.569
  193    H    ARG  17           HN       ARG  17  43.379   9.568 -14.559
  194    HA   ARG  17           HA       ARG  17  41.628  11.606 -13.696
  195   1HB   ARG  17          2HB       ARG  17  43.403  12.537 -15.547
  196   2HB   ARG  17          3HB       ARG  17  42.215  11.853 -16.638
  197   1HG   ARG  17          2HG       ARG  17  40.418  13.191 -15.552
  198   2HG   ARG  17          3HG       ARG  17  41.575  13.843 -14.409
  199   1HD   ARG  17          2HD       ARG  17  42.862  14.875 -16.293
  200   2HD   ARG  17          3HD       ARG  17  41.715  14.214 -17.441
  201    HE   ARG  17           HE       ARG  17  40.059  15.600 -15.759
  202   1HH1  ARG  17          2HH2      ARG  17  43.052  16.502 -17.373
  203   2HH1  ARG  17          1HH2      ARG  17  42.637  18.181 -17.484
  204   1HH2  ARG  17          2HH1      ARG  17  39.509  17.813 -15.905
  205   2HH2  ARG  17          1HH1      ARG  17  40.607  18.931 -16.644
  206    H    ARG  18           HN       ARG  18  40.898   9.150 -13.429
  207    HA   ARG  18           HA       ARG  18  39.810   7.382 -14.130
  208   1HB   ARG  18          2HB       ARG  18  37.554   7.914 -15.021
  209   2HB   ARG  18          3HB       ARG  18  38.008   9.064 -13.779
  210   1HG   ARG  18          2HG       ARG  18  38.737  10.682 -15.547
  211   2HG   ARG  18          3HG       ARG  18  38.279   9.533 -16.787
  212   1HD   ARG  18          2HD       ARG  18  36.068  10.080 -16.624
  213   2HD   ARG  18          3HD       ARG  18  36.085   9.967 -14.875
  214    HE   ARG  18           HE       ARG  18  36.464  12.283 -14.735
  215   1HH1  ARG  18          2HH2      ARG  18  37.000  11.193 -18.038
  216   2HH1  ARG  18          1HH2      ARG  18  37.125  12.796 -18.682
  217   1HH2  ARG  18          2HH1      ARG  18  36.628  14.398 -15.585
  218   2HH2  ARG  18          1HH1      ARG  18  36.912  14.631 -17.278
  219    H    SER  19           HN       SER  19  42.035   7.892 -15.878
  220    HA   SER  19           HA       SER  19  42.813   7.599 -17.902
  221   1HB   SER  19          2HB       SER  19  42.431   5.288 -17.376
  222   2HB   SER  19          3HB       SER  19  40.713   5.413 -17.695
  223    HG   SER  19           HG       SER  19  42.450   4.523 -19.396
  224    H    GLN  20           HN       GLN  20  39.704   6.347 -19.104
  225    HA   GLN  20           HA       GLN  20  39.104   8.891 -20.321
  226   1HB   GLN  20          2HB       GLN  20  40.591   7.059 -21.765
  227   2HB   GLN  20          3HB       GLN  20  38.960   6.641 -22.253
  228   1HG   GLN  20          2HG       GLN  20  39.609   8.321 -23.806
  229   2HG   GLN  20          3HG       GLN  20  38.589   9.174 -22.663
  230   1HE2  GLN  20          1HE2      GLN  20  39.426  10.674 -21.286
  231   2HE2  GLN  20          2HE2      GLN  20  41.043  11.289 -21.379
  232    H    LEU  21           HN       LEU  21  37.638   7.970 -18.283
  233    HA   LEU  21           HA       LEU  21  35.707   6.044 -18.893
  234   1HB   LEU  21          2HB       LEU  21  36.478   7.467 -16.694
  235   2HB   LEU  21          3HB       LEU  21  34.932   8.208 -17.057
  236    HG   LEU  21           HG       LEU  21  35.463   5.283 -16.487
  237   1HD1  LEU  21          1HD1      LEU  21  33.697   7.206 -14.966
  238   2HD1  LEU  21          2HD1      LEU  21  34.260   5.590 -14.475
  239   3HD1  LEU  21          3HD1      LEU  21  35.413   6.942 -14.574
  240   1HD2  LEU  21          1HD2      LEU  21  33.490   4.671 -17.333
  241   2HD2  LEU  21          2HD2      LEU  21  32.659   6.101 -16.676
  242   3HD2  LEU  21          3HD2      LEU  21  33.535   6.212 -18.222
  243    H    ASP  22           HN       ASP  22  34.310   6.107 -20.568
  244    HA   ASP  22           HA       ASP  22  33.601   8.623 -21.684
  245   1HB   ASP  22          2HB       ASP  22  33.517   5.818 -22.437
  246   2HB   ASP  22          3HB       ASP  22  31.932   6.516 -22.696
  247    H    ARG  23           HN       ARG  23  31.461   9.574 -21.634
  248    HA   ARG  23           HA       ARG  23  30.029   9.104 -19.311
  249   1HB   ARG  23          2HB       ARG  23  29.446  10.650 -21.869
  250   2HB   ARG  23          3HB       ARG  23  28.249  10.566 -20.592
  251   1HG   ARG  23          2HG       ARG  23  31.114  11.567 -20.239
  252   2HG   ARG  23          3HG       ARG  23  29.707  12.596 -20.405
  253   1HD   ARG  23          2HD       ARG  23  29.210  10.629 -18.316
  254   2HD   ARG  23          3HD       ARG  23  30.739  11.426 -18.005
  255    HE   ARG  23           HE       ARG  23  28.824  13.422 -18.735
  256   1HH1  ARG  23          2HH2      ARG  23  29.522  11.199 -16.098
  257   2HH1  ARG  23          1HH2      ARG  23  28.778  12.194 -14.893
  258   1HH2  ARG  23          2HH1      ARG  23  27.841  14.735 -17.144
  259   2HH2  ARG  23          1HH1      ARG  23  27.815  14.219 -15.491
  260    H    ASP  24           HN       ASP  24  30.173   7.305 -22.193
  261    HA   ASP  24           HA       ASP  24  27.533   6.199 -21.639
  262   1HB   ASP  24          2HB       ASP  24  27.761   7.449 -23.859
  263   2HB   ASP  24          3HB       ASP  24  28.947   6.253 -24.343
  264    H    GLN  25           HN       GLN  25  30.182   5.487 -20.492
  265    HA   GLN  25           HA       GLN  25  30.525   2.875 -21.751
  266   1HB   GLN  25          2HB       GLN  25  32.470   4.924 -21.013
  267   2HB   GLN  25          3HB       GLN  25  32.818   3.425 -20.173
  268   1HG   GLN  25          2HG       GLN  25  32.259   2.464 -22.693
  269   2HG   GLN  25          3HG       GLN  25  32.926   4.033 -23.096
  270   1HE2  GLN  25          1HE2      GLN  25  34.918   3.708 -23.744
  271   2HE2  GLN  25          2HE2      GLN  25  36.152   2.817 -22.917
  272    H    CYS  26           HN       CYS  26  31.693   1.321 -19.966
  273    HA   CYS  26           HA       CYS  26  29.987   1.566 -17.600
  274   1HB   CYS  26          2HB       CYS  26  29.513  -0.407 -18.999
  275   2HB   CYS  26          3HB       CYS  26  31.178  -0.931 -18.850
  276    H    ALA  27           HN       ALA  27  31.000   1.710 -15.593
  277    HA   ALA  27           HA       ALA  27  33.924   1.696 -15.655
  278   1HB   ALA  27          1HB       ALA  27  33.750   3.039 -13.626
  279   2HB   ALA  27          2HB       ALA  27  32.705   3.739 -14.885
  280   3HB   ALA  27          3HB       ALA  27  31.991   2.780 -13.567
  281    H    TYR  28           HN       TYR  28  32.270  -0.783 -15.709
  282    HA   TYR  28           HA       TYR  28  33.180  -1.883 -13.138
  283   1HB   TYR  28          2HB       TYR  28  30.609  -1.544 -13.609
  284   2HB   TYR  28          3HB       TYR  28  30.789  -2.747 -14.871
  285    HD1  TYR  28           HD1      TYR  28  30.784  -2.172 -11.231
  286    HD2  TYR  28           HD2      TYR  28  31.085  -5.104 -14.333
  287    HE1  TYR  28           HE1      TYR  28  30.409  -4.024  -9.529
  288    HE2  TYR  28           HE2      TYR  28  30.710  -6.945 -12.620
  289    HH   TYR  28           HH       TYR  28  30.751  -6.280  -9.222
  290    H    CYS  29           HN       CYS  29  31.911  -3.012 -16.358
  291    HA   CYS  29           HA       CYS  29  33.910  -5.105 -16.294
  292   1HB   CYS  29          2HB       CYS  29  32.701  -6.016 -18.242
  293   2HB   CYS  29          3HB       CYS  29  31.648  -5.777 -16.861
  294    H    LYS  30           HN       LYS  30  33.476  -1.884 -17.403
  295    HA   LYS  30           HA       LYS  30  34.861  -0.570 -18.546
  296   1HB   LYS  30          2HB       LYS  30  36.468  -2.945 -18.252
  297   2HB   LYS  30          3HB       LYS  30  36.719  -2.270 -19.849
  298   1HG   LYS  30          2HG       LYS  30  36.747  -0.501 -17.374
  299   2HG   LYS  30          3HG       LYS  30  38.184  -1.364 -17.883
  300   1HD   LYS  30          2HD       LYS  30  38.529   0.002 -19.699
  301   2HD   LYS  30          3HD       LYS  30  36.822   0.098 -20.085
  302   1HE   LYS  30          2HE       LYS  30  36.445   1.910 -18.637
  303   2HE   LYS  30          3HE       LYS  30  37.779   1.487 -17.582
  304   1HZ   LYS  30          1HZ       LYS  30  37.882   3.377 -19.441
  305   2HZ   LYS  30          2HZ       LYS  30  39.199   2.620 -18.841
  306   3HZ   LYS  30          3HZ       LYS  30  38.554   2.133 -20.259
  307    H    GLU  31           HN       GLU  31  32.448  -2.151 -19.507
  308    HA   GLU  31           HA       GLU  31  32.992  -2.522 -22.282
  309   1HB   GLU  31          2HB       GLU  31  30.553  -2.785 -20.510
  310   2HB   GLU  31          3HB       GLU  31  30.359  -2.780 -22.253
  311   1HG   GLU  31          2HG       GLU  31  32.419  -4.600 -20.965
  312   2HG   GLU  31          3HG       GLU  31  30.731  -5.071 -20.990
  313    H    LYS  32           HN       LYS  32  30.848  -1.498 -23.660
  314    HA   LYS  32           HA       LYS  32  30.665   1.321 -22.953
  315   1HB   LYS  32          2HB       LYS  32  32.671   1.013 -24.433
  316   2HB   LYS  32          3HB       LYS  32  31.606   0.408 -25.686
  317   1HG   LYS  32          2HG       LYS  32  30.261   2.600 -25.419
  318   2HG   LYS  32          3HG       LYS  32  31.584   3.185 -24.430
  319   1HD   LYS  32          2HD       LYS  32  33.038   3.377 -26.226
  320   2HD   LYS  32          3HD       LYS  32  32.369   1.987 -27.059
  321   1HE   LYS  32          2HE       LYS  32  30.232   3.500 -27.385
  322   2HE   LYS  32          3HE       LYS  32  31.302   4.830 -26.988
  323   1HZ   LYS  32          1HZ       LYS  32  32.275   4.671 -28.954
  324   2HZ   LYS  32          2HZ       LYS  32  32.429   3.047 -28.889
  325   3HZ   LYS  32          3HZ       LYS  32  31.035   3.714 -29.416
  326    H    GLY  33           HN       GLY  33  28.585   1.972 -23.109
  327   1HA   GLY  33          1HA       GLY  33  26.739   2.041 -24.826
  328   2HA   GLY  33          2HA       GLY  33  26.775   0.291 -24.731
  329    H    HIS  34           HN       HIS  34  27.218  -0.117 -21.950
  330    HA   HIS  34           HA       HIS  34  24.722   0.995 -20.892
  331   1HB   HIS  34          2HB       HIS  34  24.455  -1.009 -19.613
  332   2HB   HIS  34          3HB       HIS  34  24.725  -1.450 -21.287
  333    HD1  HIS  34           HD1      HIS  34  26.795  -2.864 -21.841
  334    HD2  HIS  34           HD2      HIS  34  26.662  -1.591 -17.846
  335    HE1  HIS  34           HE1      HIS  34  28.626  -4.153 -20.619
  336    H    TRP  35           HN       TRP  35  24.723   1.178 -18.408
  337    HA   TRP  35           HA       TRP  35  27.254   2.431 -17.658
  338   1HB   TRP  35          2HB       TRP  35  24.396   2.838 -16.959
  339   2HB   TRP  35          3HB       TRP  35  25.568   3.123 -15.688
  340    HD1  TRP  35           HD1      TRP  35  25.814   4.100 -19.472
  341    HE1  TRP  35           HE1      TRP  35  26.313   6.680 -19.724
  342    HE3  TRP  35           HE3      TRP  35  25.673   5.149 -14.498
  343    HZ2  TRP  35           HZ2      TRP  35  26.587   8.821 -17.858
  344    HZ3  TRP  35           HZ3      TRP  35  26.066   7.509 -13.798
  345    HH2  TRP  35           HH2      TRP  35  26.512   9.313 -15.385
  346    H    ALA  36           HN       ALA  36  28.027   2.038 -15.382
  347    HA   ALA  36           HA       ALA  36  28.285  -0.687 -14.882
  348   1HB   ALA  36          1HB       ALA  36  29.298   0.108 -12.731
  349   2HB   ALA  36          2HB       ALA  36  29.929   0.957 -14.164
  350   3HB   ALA  36          3HB       ALA  36  28.731   1.752 -13.115
  351    H    LYS  37           HN       LYS  37  25.971   1.777 -13.701
  352    HA   LYS  37           HA       LYS  37  24.916   0.181 -11.630
  353   1HB   LYS  37          2HB       LYS  37  24.084   2.685 -13.065
  354   2HB   LYS  37          3HB       LYS  37  22.931   1.870 -12.026
  355   1HG   LYS  37          2HG       LYS  37  23.993   3.346 -10.528
  356   2HG   LYS  37          3HG       LYS  37  24.857   1.847 -10.245
  357   1HD   LYS  37          2HD       LYS  37  26.818   2.655 -11.126
  358   2HD   LYS  37          3HD       LYS  37  26.008   3.480 -12.443
  359   1HE   LYS  37          2HE       LYS  37  26.893   5.249 -11.122
  360   2HE   LYS  37          3HE       LYS  37  25.201   5.197 -10.672
  361   1HZ   LYS  37          1HZ       LYS  37  26.656   3.430  -9.066
  362   2HZ   LYS  37          2HZ       LYS  37  27.366   4.900  -9.017
  363   3HZ   LYS  37          3HZ       LYS  37  25.790   4.739  -8.617
  364    H    ASP  38           HN       ASP  38  24.862  -0.173 -15.011
  365    HA   ASP  38           HA       ASP  38  22.500  -1.857 -14.742
  366   1HB   ASP  38          2HB       ASP  38  22.536   0.400 -16.269
  367   2HB   ASP  38          3HB       ASP  38  23.211  -0.724 -17.432
  368    H    CYS  39           HN       CYS  39  25.565  -2.222 -14.555
  369    HA   CYS  39           HA       CYS  39  26.502  -3.410 -16.888
  370   1HB   CYS  39          2HB       CYS  39  27.921  -2.635 -14.989
  371   2HB   CYS  39          3HB       CYS  39  27.356  -3.990 -14.033
  372    HA   PRO  40           HA       PRO  40  24.215  -7.137 -16.660
  373   1HB   PRO  40          2HB       PRO  40  25.364  -8.452 -18.762
  374   2HB   PRO  40          3HB       PRO  40  24.077  -7.280 -18.954
  375   1HG   PRO  40          2HG       PRO  40  26.961  -6.975 -19.526
  376   2HG   PRO  40          3HG       PRO  40  25.620  -6.000 -20.094
  377   1HD   PRO  40          2HD       PRO  40  27.480  -5.319 -18.019
  378   2HD   PRO  40          3HD       PRO  40  26.072  -4.397 -18.508
  379    H    LYS  41           HN       LYS  41  27.273  -6.689 -15.681
  380    HA   LYS  41           HA       LYS  41  27.749  -9.529 -15.232
  381   1HB   LYS  41          2HB       LYS  41  29.420  -7.424 -15.925
  382   2HB   LYS  41          3HB       LYS  41  29.743  -7.638 -14.216
  383   1HG   LYS  41          2HG       LYS  41  29.765 -10.242 -14.906
  384   2HG   LYS  41          3HG       LYS  41  30.150  -9.583 -16.484
  385   1HD   LYS  41          2HD       LYS  41  32.311  -9.516 -15.768
  386   2HD   LYS  41          3HD       LYS  41  31.838  -8.117 -14.826
  387   1HE   LYS  41          2HE       LYS  41  31.403 -10.898 -13.695
  388   2HE   LYS  41          3HE       LYS  41  32.999 -10.176 -13.629
  389   1HZ   LYS  41          1HZ       LYS  41  31.665  -9.695 -11.678
  390   2HZ   LYS  41          2HZ       LYS  41  32.079  -8.321 -12.458
  391   3HZ   LYS  41          3HZ       LYS  41  30.561  -8.907 -12.588
  392    H    LYS  42           HN       LYS  42  26.488  -6.662 -13.704
  393    HA   LYS  42           HA       LYS  42  27.114  -7.386 -11.038
  394   1HB   LYS  42          2HB       LYS  42  25.316  -5.391 -12.377
  395   2HB   LYS  42          3HB       LYS  42  25.099  -5.719 -10.669
  396   1HG   LYS  42          2HG       LYS  42  27.884  -5.471 -10.923
  397   2HG   LYS  42          3HG       LYS  42  27.274  -4.262 -12.034
  398   1HD   LYS  42          2HD       LYS  42  26.239  -4.510  -9.176
  399   2HD   LYS  42          3HD       LYS  42  27.625  -3.517  -9.583
  400   1HE   LYS  42          2HE       LYS  42  25.902  -2.587 -11.466
  401   2HE   LYS  42          3HE       LYS  42  24.727  -3.111 -10.277
  402   1HZ   LYS  42          1HZ       LYS  42  26.705  -1.019 -10.077
  403   2HZ   LYS  42          2HZ       LYS  42  25.179  -1.067  -9.500
  404   3HZ   LYS  42          3HZ       LYS  42  26.377  -1.844  -8.708
  405    HA   PRO  43           HA       PRO  43  24.121 -10.578 -10.882
  406   1HB   PRO  43          2HB       PRO  43  24.925 -11.657  -8.503
  407   2HB   PRO  43          3HB       PRO  43  25.628 -12.105 -10.045
  408   1HG   PRO  43          2HG       PRO  43  26.760 -10.390  -7.920
  409   2HG   PRO  43          3HG       PRO  43  27.587 -11.185  -9.245
  410   1HD   PRO  43          2HD       PRO  43  26.912  -8.403  -9.066
  411   2HD   PRO  43          3HD       PRO  43  27.633  -9.221 -10.438
  412    H    ARG  44           HN       ARG  44  22.561 -11.489  -9.083
  413    HA   ARG  44           HA       ARG  44  21.048  -9.231  -8.420
  414   1HB   ARG  44          2HB       ARG  44  20.557 -11.952  -8.707
  415   2HB   ARG  44          3HB       ARG  44  20.435 -11.762  -6.969
  416   1HG   ARG  44          2HG       ARG  44  19.057  -9.576  -8.360
  417   2HG   ARG  44          3HG       ARG  44  18.452 -11.133  -8.890
  418   1HD   ARG  44          2HD       ARG  44  18.577 -11.556  -6.171
  419   2HD   ARG  44          3HD       ARG  44  18.251  -9.835  -6.204
  420    HE   ARG  44           HE       ARG  44  16.407 -10.757  -7.999
  421   1HH1  ARG  44          2HH2      ARG  44  17.256 -11.838  -4.760
  422   2HH1  ARG  44          1HH2      ARG  44  15.668 -12.432  -4.404
  423   1HH2  ARG  44          2HH1      ARG  44  14.313 -11.540  -7.530
  424   2HH2  ARG  44          1HH1      ARG  44  13.982 -12.261  -5.991
  425    H    GLY  45           HN       GLY  45  21.182  -7.945  -6.600
  426   1HA   GLY  45          1HA       GLY  45  21.647  -8.918  -4.007
  427   2HA   GLY  45          2HA       GLY  45  23.163  -8.321  -4.652
  428    HA   PRO  46           HA       PRO  46  23.346  -7.728  -2.683
  429   1HB   PRO  46          2HB       PRO  46  23.006  -6.706  -0.171
  430   2HB   PRO  46          3HB       PRO  46  24.202  -6.099  -1.297
  431   1HG   PRO  46          2HG       PRO  46  21.626  -4.889  -0.502
  432   2HG   PRO  46          3HG       PRO  46  23.004  -4.129  -1.272
  433   1HD   PRO  46          2HD       PRO  46  20.548  -4.907  -2.531
  434   2HD   PRO  46          3HD       PRO  46  21.970  -4.254  -3.321
  435    H    ARG  47           HN       ARG  47  20.220  -6.859  -1.297
  436    HA   ARG  47           HA       ARG  47  19.734  -9.699  -1.110
  437   1HB   ARG  47          2HB       ARG  47  20.195  -7.937   1.170
  438   2HB   ARG  47          3HB       ARG  47  18.551  -8.539   1.227
  439   1HG   ARG  47          2HG       ARG  47  19.838 -10.861   0.597
  440   2HG   ARG  47          3HG       ARG  47  21.136 -10.046   1.446
  441   1HD   ARG  47          2HD       ARG  47  19.098  -9.537   3.189
  442   2HD   ARG  47          3HD       ARG  47  18.504 -11.033   2.498
  443    HE   ARG  47           HE       ARG  47  20.241 -12.199   3.561
  444   1HH1  ARG  47          2HH2      ARG  47  20.954  -8.753   3.595
  445   2HH1  ARG  47          1HH2      ARG  47  22.317  -8.916   4.652
  446   1HH2  ARG  47          2HH1      ARG  47  22.038 -12.414   4.956
  447   2HH2  ARG  47          1HH1      ARG  47  22.937 -11.012   5.432
  448    H    GLY  48           HN       GLY  48  17.452 -10.241  -1.230
  449   1HA   GLY  48          1HA       GLY  48  15.831  -8.891  -2.859
  450   2HA   GLY  48          2HA       GLY  48  15.230  -9.864  -1.531
  451    HA   PRO  49           HA       PRO  49  15.162  -5.233  -0.396
  452   1HB   PRO  49          2HB       PRO  49  14.776  -3.517  -2.489
  453   2HB   PRO  49          3HB       PRO  49  16.348  -3.821  -1.777
  454   1HG   PRO  49          2HG       PRO  49  15.255  -4.799  -4.344
  455   2HG   PRO  49          3HG       PRO  49  16.925  -4.730  -3.816
  456   1HD   PRO  49          2HD       PRO  49  15.255  -7.059  -3.928
  457   2HD   PRO  49          3HD       PRO  49  16.886  -6.968  -3.292
  458    H    ARG  50           HN       ARG  50  13.328  -4.860   0.667
  459    HA   ARG  50           HA       ARG  50  10.987  -4.688  -0.995
  460   1HB   ARG  50          2HB       ARG  50  11.237  -7.114  -0.188
  461   2HB   ARG  50          3HB       ARG  50  11.045  -6.524   1.451
  462   1HG   ARG  50          2HG       ARG  50   8.853  -7.209   0.770
  463   2HG   ARG  50          3HG       ARG  50   8.831  -5.458   0.693
  464   1HD   ARG  50          2HD       ARG  50   9.478  -5.712  -1.812
  465   2HD   ARG  50          3HD       ARG  50   9.097  -7.413  -1.631
  466    HE   ARG  50           HE       ARG  50   7.183  -5.172  -1.608
  467   1HH1  ARG  50          2HH2      ARG  50   7.717  -8.573  -0.884
  468   2HH1  ARG  50          1HH2      ARG  50   6.034  -8.978  -0.921
  469   1HH2  ARG  50          2HH1      ARG  50   4.961  -5.705  -1.657
  470   2HH2  ARG  50          1HH1      ARG  50   4.454  -7.334  -1.363
  471    HA   PRO  51           HA       PRO  51  10.302  -1.585   2.016
  472   1HB   PRO  51          2HB       PRO  51   7.840  -0.725   1.202
  473   2HB   PRO  51          3HB       PRO  51   9.335  -0.189   0.461
  474   1HG   PRO  51          2HG       PRO  51   7.336  -2.107  -0.574
  475   2HG   PRO  51          3HG       PRO  51   8.587  -1.245  -1.448
  476   1HD   PRO  51          2HD       PRO  51   8.632  -4.003  -0.662
  477   2HD   PRO  51          3HD       PRO  51   9.929  -3.112  -1.433
  478    H    GLN  52           HN       GLN  52   9.051  -0.966   3.893
  479    HA   GLN  52           HA       GLN  52   8.228  -1.696   5.795
  480   1HB   GLN  52          2HB       GLN  52   5.991  -2.447   3.866
  481   2HB   GLN  52          3HB       GLN  52   5.788  -2.412   5.606
  482   1HG   GLN  52          2HG       GLN  52   6.328  -0.023   5.689
  483   2HG   GLN  52          3HG       GLN  52   6.781  -0.016   3.996
  484   1HE2  GLN  52          1HE2      GLN  52   4.299   0.342   6.261
  485   2HE2  GLN  52          2HE2      GLN  52   2.939   0.474   5.195
  486    H    THR  53           HN       THR  53  10.003  -3.416   5.834
  487    HA   THR  53           HA       THR  53   8.722  -6.007   6.217
  488    HB   THR  53           HB       THR  53  10.950  -5.360   4.244
  489    HG1  THR  53           HG1      THR  53   8.630  -5.601   3.658
  490   1HG2  THR  53          1HG2      THR  53  10.871  -8.046   4.119
  491   2HG2  THR  53          2HG2      THR  53  12.015  -7.222   5.206
  492   3HG2  THR  53          3HG2      THR  53  10.493  -7.881   5.850
  493    H    SER  54           HN       SER  54   8.923  -5.379   8.461
  494    HA   SER  54           HA       SER  54  11.455  -6.230   9.448
  495   1HB   SER  54          2HB       SER  54  10.568  -3.360   9.636
  496   2HB   SER  54          3HB       SER  54  11.361  -4.057  11.036
  497    HG   SER  54           HG       SER  54  12.524  -3.088   8.828
  498    H    LEU  55           HN       LEU  55  11.290  -6.983  11.650
  499    HA   LEU  55           HA       LEU  55   8.733  -6.579  12.969
  500   1HB   LEU  55          2HB       LEU  55   9.205  -8.850  11.423
  501   2HB   LEU  55          3HB       LEU  55   9.517  -9.373  13.067
  502    HG   LEU  55           HG       LEU  55   6.977  -7.948  12.243
  503   1HD1  LEU  55          1HD1      LEU  55   7.256 -10.056  10.971
  504   2HD1  LEU  55          2HD1      LEU  55   7.389 -10.938  12.512
  505   3HD1  LEU  55          3HD1      LEU  55   5.879 -10.092  12.097
  506   1HD2  LEU  55          1HD2      LEU  55   7.461  -9.710  14.651
  507   2HD2  LEU  55          2HD2      LEU  55   7.694  -7.946  14.671
  508   3HD2  LEU  55          3HD2      LEU  55   6.085  -8.627  14.328
  509    H    LEU  56           HN       LEU  56  11.765  -8.580  13.177
  510    HA   LEU  56           HA       LEU  56  13.066  -9.007  14.932
  511   1HB   LEU  56          2HB       LEU  56  13.899  -6.866  14.083
  512   2HB   LEU  56          3HB       LEU  56  12.850  -6.004  15.191
  513    HG   LEU  56           HG       LEU  56  14.674  -7.965  16.456
  514   1HD1  LEU  56          1HD1      LEU  56  16.687  -6.848  16.146
  515   2HD1  LEU  56          2HD1      LEU  56  15.967  -6.843  14.518
  516   3HD1  LEU  56          3HD1      LEU  56  15.897  -5.378  15.525
  517   1HD2  LEU  56          1HD2      LEU  56  13.211  -5.573  17.140
  518   2HD2  LEU  56          2HD2      LEU  56  13.971  -6.786  18.198
  519   3HD2  LEU  56          3HD2      LEU  56  14.925  -5.409  17.594
  Start of MODEL   10
    1   1H5*    C 504          1H5*        C 504  37.614  -6.239  -3.441
    2   2H5*    C 504          2H5*        C 504  36.749  -5.865  -1.950
    3    H4*    C 504           H4*        C 504  36.143  -8.561  -2.677
    4    H3*    C 504           H3*        C 504  36.143  -6.666  -5.001
    5    H2*    C 504           H2*        C 504  34.053  -7.469  -5.732
    6   2HO*    C 504          2HO*        C 504  33.872  -9.602  -5.388
    7    H1*    C 504           H1*        C 504  32.650  -7.003  -3.685
    8   1H4     C 504          1H4         C 504  35.523  -1.261  -2.567
    9   2H4     C 504          2H4         C 504  35.729  -1.276  -4.305
   10    H5     C 504           H5         C 504  35.268  -3.147  -5.669
   11    H6     C 504           H6         C 504  34.490  -5.491  -5.701
   12   1H5*    C 505          1H5*        C 505  39.985  -7.005  -7.007
   13   2H5*    C 505          2H5*        C 505  38.941  -5.829  -7.805
   14    H4*    C 505           H4*        C 505  39.853  -8.132  -8.929
   15    H3*    C 505           H3*        C 505  37.509  -6.373  -9.578
   16    H2*    C 505           H2*        C 505  36.831  -7.872 -11.288
   17   2HO*    C 505          2HO*        C 505  38.541  -9.833 -11.276
   18    H1*    C 505           H1*        C 505  37.157 -10.140  -9.627
   19   1H4     C 505          1H4         C 505  30.898  -8.879  -9.463
   20   2H4     C 505          2H4         C 505  31.191  -7.653  -8.251
   21    H5     C 505           H5         C 505  33.344  -6.995  -7.539
   22    H6     C 505           H6         C 505  35.771  -7.358  -7.817
   23   1H5*    U 506          1H5*        U 506  39.492  -2.544 -10.059
   24   2H5*    U 506          2H5*        U 506  38.355  -2.454  -8.713
   25    H4*    U 506           H4*        U 506  37.362  -1.620 -10.772
   26    H3*    U 506           H3*        U 506  36.166  -4.171  -9.671
   27    H2*    U 506           H2*        U 506  34.447  -3.980 -11.257
   28   2HO*    U 506          2HO*        U 506  35.216  -1.503 -12.259
   29    H1*    U 506           H1*        U 506  36.322  -2.919 -13.222
   30    H3     U 506           H3         U 506  36.376  -6.580 -15.841
   31    H5     U 506           H5         U 506  34.665  -7.982 -12.285
   32    H6     U 506           H6         U 506  35.128  -5.779 -11.311
   33   1H5*    C 507          1H5*        C 507  34.599  -0.079 -10.316
   34   2H5*    C 507          2H5*        C 507  34.181   0.314  -8.648
   35    H4*    C 507           H4*        C 507  33.154   1.543 -10.840
   36    H3*    C 507           H3*        C 507  32.184   1.301  -8.021
   37    H2*    C 507           H2*        C 507  30.132   2.365  -8.568
   38   2HO*    C 507          2HO*        C 507  31.427   2.658 -11.125
   39    H1*    C 507           H1*        C 507  29.665   0.752 -10.801
   40   1H4     C 507          1H4         C 507  26.617  -2.008  -5.879
   41   2H4     C 507          2H4         C 507  28.012  -3.043  -5.669
   42    H5     C 507           H5         C 507  30.033  -2.784  -6.862
   43    H6     C 507           H6         C 507  31.226  -1.457  -8.569
   44   1H5*    C 508          1H5*        C 508  35.245   5.098  -5.917
   45   2H5*    C 508          2H5*        C 508  33.963   6.165  -6.490
   46    H4*    C 508           H4*        C 508  36.273   7.114  -6.615
   47    H3*    C 508           H3*        C 508  34.537   6.936  -9.072
   48    H2*    C 508           H2*        C 508  36.170   8.147 -10.287
   49   2HO*    C 508          2HO*        C 508  37.397   9.516  -9.100
   50    H1*    C 508           H1*        C 508  38.291   6.610  -9.118
   51   1H4     C 508          1H4         C 508  37.966   3.645 -14.729
   52   2H4     C 508          2H4         C 508  36.237   3.906 -14.810
   53    H5     C 508           H5         C 508  34.987   4.977 -13.118
   54    H6     C 508           H6         C 508  35.088   6.072 -10.907
   55   1H5*    G 509          1H5*        G 509  33.976   9.776 -11.048
   56   2H5*    G 509          2H5*        G 509  33.185  10.772  -9.826
   57    H4*    G 509           H4*        G 509  31.801  11.076 -11.628
   58    H3*    G 509           H3*        G 509  30.673   8.751 -10.065
   59    H2*    G 509           H2*        G 509  28.806   8.753 -11.516
   60   2HO*    G 509          2HO*        G 509  28.781  11.098 -11.475
   61    H1*    G 509           H1*        G 509  30.467   9.147 -13.815
   62    H8     G 509           H8         G 509  30.059   6.681 -10.912
   63    H1     G 509           H1         G 509  30.012   4.048 -16.823
   64   1H2     G 509          1H2         G 509  30.375   5.510 -18.232
   65   2H2     G 509          2H2         G 509  30.651   7.198 -17.865
   66   1H5*    U 510          1H5*        U 510  27.223  12.367  -7.451
   67   2H5*    U 510          2H5*        U 510  27.605  10.900  -6.552
   68    H4*    U 510           H4*        U 510  25.269  10.986  -6.616
   69    H3*    U 510           H3*        U 510  26.290   9.072  -8.719
   70    H2*    U 510           H2*        U 510  24.058   8.409  -9.119
   71   2HO*    U 510          2HO*        U 510  22.702   9.879  -7.320
   72    H1*    U 510           H1*        U 510  23.137  11.132  -8.917
   73    H3     U 510           H3         U 510  21.818  10.264 -13.132
   74    H5     U 510           H5         U 510  25.988   9.957 -13.361
   75    H6     U 510           H6         U 510  26.046  10.254 -10.927
   76   1H    ALA   1           HN       ALA   1  81.246 -18.473 -11.131
   77    HA   ALA   1           HA       ALA   1  80.377 -16.554 -12.007
   78   1HB   ALA   1          1HB       ALA   1  78.689 -16.537 -13.562
   79   2HB   ALA   1          2HB       ALA   1  79.106 -18.265 -13.662
   80   3HB   ALA   1          3HB       ALA   1  77.718 -17.740 -12.680
   81    H    THR   2           HN       THR   2  78.328 -15.139 -11.343
   82    HA   THR   2           HA       THR   2  77.106 -16.130  -8.896
   83    HB   THR   2           HB       THR   2  79.391 -15.077  -8.342
   84    HG1  THR   2           HG1      THR   2  76.804 -13.945  -7.561
   85   1HG2  THR   2          1HG2      THR   2  77.999 -12.419  -8.699
   86   2HG2  THR   2          2HG2      THR   2  79.741 -12.772  -8.614
   87   3HG2  THR   2          3HG2      THR   2  78.835 -13.116 -10.107
   88    H    VAL   3           HN       VAL   3  75.003 -15.683  -8.965
   89    HA   VAL   3           HA       VAL   3  74.223 -13.319 -10.530
   90    HB   VAL   3           HB       VAL   3  73.647 -15.515 -11.534
   91   1HG1  VAL   3          1HG1      VAL   3  71.996 -15.826  -9.008
   92   2HG1  VAL   3          2HG1      VAL   3  71.767 -16.803 -10.478
   93   3HG1  VAL   3          3HG1      VAL   3  73.305 -16.882  -9.587
   94   1HG2  VAL   3          1HG2      VAL   3  72.307 -13.398 -11.868
   95   2HG2  VAL   3          2HG2      VAL   3  71.418 -14.913 -12.152
   96   3HG2  VAL   3          3HG2      VAL   3  71.173 -14.007 -10.639
   97    H    VAL   4           HN       VAL   4  72.088 -12.348  -9.773
   98    HA   VAL   4           HA       VAL   4  71.662 -12.781  -6.916
   99    HB   VAL   4           HB       VAL   4  71.646 -10.356  -6.543
  100   1HG1  VAL   4          1HG1      VAL   4  73.864 -10.288  -6.059
  101   2HG1  VAL   4          2HG1      VAL   4  73.786 -12.000  -6.540
  102   3HG1  VAL   4          3HG1      VAL   4  74.352 -10.775  -7.701
  103   1HG2  VAL   4          1HG2      VAL   4  72.745  -8.882  -8.264
  104   2HG2  VAL   4          2HG2      VAL   4  72.600 -10.228  -9.419
  105   3HG2  VAL   4          3HG2      VAL   4  71.137  -9.493  -8.720
  106    H    SER   5           HN       SER   5  69.549 -11.868  -6.183
  107    HA   SER   5           HA       SER   5  67.733 -10.870  -8.031
  108   1HB   SER   5          2HB       SER   5  68.082 -13.536  -8.516
  109   2HB   SER   5          3HB       SER   5  66.822 -13.624  -7.301
  110    HG   SER   5           HG       SER   5  66.659 -11.943  -9.654
  111    H    GLY   6           HN       GLY   6  66.009  -9.963  -6.879
  112   1HA   GLY   6          1HA       GLY   6  65.632 -10.905  -4.102
  113   2HA   GLY   6          2HA       GLY   6  65.821  -9.204  -4.481
  114    H    GLN   7           HN       GLN   7  64.233  -8.231  -6.097
  115    HA   GLN   7           HA       GLN   7  61.933  -9.583  -6.809
  116   1HB   GLN   7          2HB       GLN   7  61.889  -9.041  -4.077
  117   2HB   GLN   7          3HB       GLN   7  61.006  -7.682  -4.741
  118   1HG   GLN   7          2HG       GLN   7  59.232  -8.982  -5.403
  119   2HG   GLN   7          3HG       GLN   7  60.263 -10.288  -5.956
  120   1HE2  GLN   7          1HE2      GLN   7  61.381 -11.559  -4.249
  121   2HE2  GLN   7          2HE2      GLN   7  60.509 -11.952  -2.804
  122    H    LYS   8           HN       LYS   8  60.722  -8.314  -8.266
  123    HA   LYS   8           HA       LYS   8  60.785  -5.495  -8.211
  124   1HB   LYS   8          2HB       LYS   8  63.093  -6.647  -9.336
  125   2HB   LYS   8          3HB       LYS   8  62.117  -6.150 -10.704
  126   1HG   LYS   8          2HG       LYS   8  62.513  -4.270  -8.352
  127   2HG   LYS   8          3HG       LYS   8  63.750  -4.408  -9.586
  128   1HD   LYS   8          2HD       LYS   8  61.518  -4.130 -11.168
  129   2HD   LYS   8          3HD       LYS   8  61.018  -3.210  -9.763
  130   1HE   LYS   8          2HE       LYS   8  62.146  -1.697 -11.315
  131   2HE   LYS   8          3HE       LYS   8  63.153  -1.883  -9.894
  132   1HZ   LYS   8          1HZ       LYS   8  63.890  -2.357 -12.459
  133   2HZ   LYS   8          2HZ       LYS   8  64.733  -2.775 -11.124
  134   3HZ   LYS   8          3HZ       LYS   8  63.729  -3.855 -11.828
  135    H    GLN   9           HN       GLN   9  58.719  -5.133  -8.797
  136    HA   GLN   9           HA       GLN   9  57.805  -5.771 -11.313
  137   1HB   GLN   9          2HB       GLN   9  57.771  -8.086  -9.934
  138   2HB   GLN   9          3HB       GLN   9  56.241  -7.449  -9.366
  139   1HG   GLN   9          2HG       GLN   9  55.455  -7.165 -11.702
  140   2HG   GLN   9          3HG       GLN   9  57.008  -7.700 -12.314
  141   1HE2  GLN   9          1HE2      GLN   9  57.414  -9.793 -12.569
  142   2HE2  GLN   9          2HE2      GLN   9  56.376 -11.099 -12.099
  143    H    ASP  10           HN       ASP  10  55.447  -5.129 -11.586
  144    HA   ASP  10           HA       ASP  10  53.811  -3.746 -11.256
  145   1HB   ASP  10          2HB       ASP  10  54.404  -4.537  -8.395
  146   2HB   ASP  10          3HB       ASP  10  53.237  -3.264  -8.693
  147    H    ARG  11           HN       ARG  11  53.344  -1.423 -10.687
  148    HA   ARG  11           HA       ARG  11  54.992   0.087  -9.104
  149   1HB   ARG  11          2HB       ARG  11  56.602  -0.567 -11.085
  150   2HB   ARG  11          3HB       ARG  11  55.674   0.581 -12.030
  151   1HG   ARG  11          2HG       ARG  11  56.979   2.229 -11.183
  152   2HG   ARG  11          3HG       ARG  11  56.219   1.959  -9.627
  153   1HD   ARG  11          2HD       ARG  11  58.655   0.398 -10.615
  154   2HD   ARG  11          3HD       ARG  11  58.759   1.817  -9.590
  155    HE   ARG  11           HE       ARG  11  57.024   0.255  -8.166
  156   1HH1  ARG  11          2HH2      ARG  11  60.129  -0.462  -9.657
  157   2HH1  ARG  11          1HH2      ARG  11  60.545  -1.686  -8.505
  158   1HH2  ARG  11          2HH1      ARG  11  57.570  -1.362  -6.646
  159   2HH2  ARG  11          1HH1      ARG  11  59.079  -2.201  -6.781
  160    H    GLN  12           HN       GLN  12  53.199   1.324  -8.537
  161    HA   GLN  12           HA       GLN  12  52.009   2.835 -10.716
  162   1HB   GLN  12          2HB       GLN  12  50.538   1.278  -8.557
  163   2HB   GLN  12          3HB       GLN  12  49.774   2.593  -9.429
  164   1HG   GLN  12          2HG       GLN  12  51.055   0.907 -11.380
  165   2HG   GLN  12          3HG       GLN  12  50.174  -0.141 -10.287
  166   1HE2  GLN  12          1HE2      GLN  12  49.947   1.436 -13.086
  167   2HE2  GLN  12          2HE2      GLN  12  48.251   1.770 -13.184
  168    H    GLY  13           HN       GLY  13  51.234   4.961 -10.107
  169   1HA   GLY  13          1HA       GLY  13  51.579   5.818  -7.355
  170   2HA   GLY  13          2HA       GLY  13  52.740   6.475  -8.493
  171    H    GLY  14           HN       GLY  14  49.155   5.857  -8.303
  172   1HA   GLY  14          1HA       GLY  14  47.793   7.916  -8.198
  173   2HA   GLY  14          2HA       GLY  14  48.762   8.525  -9.525
  174    H    GLU  15           HN       GLU  15  45.805   7.232  -8.839
  175    HA   GLU  15           HA       GLU  15  45.673   5.448 -11.082
  176   1HB   GLU  15          2HB       GLU  15  43.672   6.360  -8.985
  177   2HB   GLU  15          3HB       GLU  15  43.179   5.388 -10.357
  178   1HG   GLU  15          2HG       GLU  15  44.286   3.493  -9.601
  179   2HG   GLU  15          3HG       GLU  15  45.584   4.409  -8.862
  180    H    ARG  16           HN       ARG  16  44.988   5.987 -13.126
  181    HA   ARG  16           HA       ARG  16  44.811   8.591 -13.877
  182   1HB   ARG  16          2HB       ARG  16  43.627   6.095 -15.188
  183   2HB   ARG  16          3HB       ARG  16  43.721   7.646 -15.996
  184   1HG   ARG  16          2HG       ARG  16  46.302   7.478 -15.217
  185   2HG   ARG  16          3HG       ARG  16  45.944   5.762 -15.233
  186   1HD   ARG  16          2HD       ARG  16  45.577   5.711 -17.549
  187   2HD   ARG  16          3HD       ARG  16  45.062   7.385 -17.618
  188    HE   ARG  16           HE       ARG  16  47.837   6.396 -17.694
  189   1HH1  ARG  16          2HH2      ARG  16  45.732   9.180 -17.249
  190   2HH1  ARG  16          1HH2      ARG  16  46.967  10.336 -17.621
  191   1HH2  ARG  16          2HH1      ARG  16  49.468   7.920 -18.185
  192   2HH2  ARG  16          1HH1      ARG  16  49.107   9.613 -18.157
  193    H    ARG  17           HN       ARG  17  42.819   9.668 -14.988
  194    HA   ARG  17           HA       ARG  17  40.577   9.285 -13.190
  195   1HB   ARG  17          2HB       ARG  17  41.929  11.594 -13.924
  196   2HB   ARG  17          3HB       ARG  17  40.571  11.634 -15.031
  197   1HG   ARG  17          2HG       ARG  17  39.642  12.730 -13.191
  198   2HG   ARG  17          3HG       ARG  17  39.136  11.084 -12.864
  199   1HD   ARG  17          2HD       ARG  17  40.325  11.045 -10.927
  200   2HD   ARG  17          3HD       ARG  17  41.800  11.473 -11.770
  201    HE   ARG  17           HE       ARG  17  39.985  13.313 -10.361
  202   1HH1  ARG  17          2HH2      ARG  17  42.606  13.015 -12.691
  203   2HH1  ARG  17          1HH2      ARG  17  43.133  14.654 -12.499
  204   1HH2  ARG  17          2HH1      ARG  17  40.682  15.475 -10.108
  205   2HH2  ARG  17          1HH1      ARG  17  42.032  16.062 -11.020
  206    H    ARG  18           HN       ARG  18  39.318   7.662 -14.177
  207    HA   ARG  18           HA       ARG  18  38.106   6.640 -15.654
  208   1HB   ARG  18          2HB       ARG  18  37.503   9.472 -16.649
  209   2HB   ARG  18          3HB       ARG  18  36.524   8.060 -16.995
  210   1HG   ARG  18          2HG       ARG  18  35.868   7.809 -14.698
  211   2HG   ARG  18          3HG       ARG  18  37.143   8.867 -14.128
  212   1HD   ARG  18          2HD       ARG  18  35.268  10.129 -16.077
  213   2HD   ARG  18          3HD       ARG  18  34.530   9.660 -14.558
  214    HE   ARG  18           HE       ARG  18  36.920  10.947 -13.840
  215   1HH1  ARG  18          2HH2      ARG  18  34.009  11.801 -15.623
  216   2HH1  ARG  18          1HH2      ARG  18  34.094  13.481 -15.209
  217   1HH2  ARG  18          2HH1      ARG  18  37.033  13.162 -13.294
  218   2HH2  ARG  18          1HH1      ARG  18  35.827  14.261 -13.875
  219    H    SER  19           HN       SER  19  40.843   6.796 -16.421
  220    HA   SER  19           HA       SER  19  41.606   7.803 -18.716
  221   1HB   SER  19          2HB       SER  19  42.525   5.788 -17.110
  222   2HB   SER  19          3HB       SER  19  42.111   4.862 -18.539
  223    HG   SER  19           HG       SER  19  43.793   5.685 -19.584
  224    H    GLN  20           HN       GLN  20  40.135   4.468 -18.672
  225    HA   GLN  20           HA       GLN  20  39.131   5.067 -21.340
  226   1HB   GLN  20          2HB       GLN  20  40.743   3.018 -20.677
  227   2HB   GLN  20          3HB       GLN  20  39.219   2.258 -20.263
  228   1HG   GLN  20          2HG       GLN  20  38.344   2.771 -22.554
  229   2HG   GLN  20          3HG       GLN  20  39.870   3.526 -22.967
  230   1HE2  GLN  20          1HE2      GLN  20  41.371   2.340 -23.873
  231   2HE2  GLN  20          2HE2      GLN  20  41.470   0.610 -23.889
  232    H    LEU  21           HN       LEU  21  37.619   6.247 -19.421
  233    HA   LEU  21           HA       LEU  21  35.255   4.529 -19.384
  234   1HB   LEU  21          2HB       LEU  21  36.323   4.329 -17.195
  235   2HB   LEU  21          3HB       LEU  21  36.316   6.072 -17.013
  236    HG   LEU  21           HG       LEU  21  34.473   4.521 -15.902
  237   1HD1  LEU  21          1HD1      LEU  21  32.860   6.620 -16.389
  238   2HD1  LEU  21          2HD1      LEU  21  34.232   6.672 -15.256
  239   3HD1  LEU  21          3HD1      LEU  21  34.417   7.311 -16.908
  240   1HD2  LEU  21          1HD2      LEU  21  33.009   5.259 -18.429
  241   2HD2  LEU  21          2HD2      LEU  21  33.835   3.692 -18.255
  242   3HD2  LEU  21          3HD2      LEU  21  32.529   4.140 -17.132
  243    H    ASP  22           HN       ASP  22  34.116   5.612 -20.949
  244    HA   ASP  22           HA       ASP  22  34.190   8.469 -20.957
  245   1HB   ASP  22          2HB       ASP  22  33.082   6.286 -22.692
  246   2HB   ASP  22          3HB       ASP  22  32.246   7.824 -22.767
  247    H    ARG  23           HN       ARG  23  31.826   9.544 -21.302
  248    HA   ARG  23           HA       ARG  23  30.449   9.068 -18.921
  249   1HB   ARG  23          2HB       ARG  23  30.651  11.240 -20.417
  250   2HB   ARG  23          3HB       ARG  23  29.272  10.588 -21.278
  251   1HG   ARG  23          2HG       ARG  23  28.600  12.158 -19.444
  252   2HG   ARG  23          3HG       ARG  23  27.922  10.556 -19.236
  253   1HD   ARG  23          2HD       ARG  23  29.110  10.163 -17.310
  254   2HD   ARG  23          3HD       ARG  23  30.581  10.864 -17.957
  255    HE   ARG  23           HE       ARG  23  29.040  13.095 -17.592
  256   1HH1  ARG  23          2HH2      ARG  23  29.756  10.376 -15.476
  257   2HH1  ARG  23          1HH2      ARG  23  29.604  11.305 -14.021
  258   1HH2  ARG  23          2HH1      ARG  23  28.839  14.320 -15.674
  259   2HH2  ARG  23          1HH1      ARG  23  29.079  13.563 -14.135
  260    H    ASP  24           HN       ASP  24  30.517   7.268 -21.735
  261    HA   ASP  24           HA       ASP  24  27.806   6.329 -21.240
  262   1HB   ASP  24          2HB       ASP  24  27.643   5.803 -23.692
  263   2HB   ASP  24          3HB       ASP  24  27.751   7.521 -23.364
  264    H    GLN  25           HN       GLN  25  30.627   5.541 -20.336
  265    HA   GLN  25           HA       GLN  25  30.660   2.885 -21.544
  266   1HB   GLN  25          2HB       GLN  25  32.684   4.525 -21.883
  267   2HB   GLN  25          3HB       GLN  25  33.074   4.149 -20.215
  268   1HG   GLN  25          2HG       GLN  25  32.688   1.617 -21.123
  269   2HG   GLN  25          3HG       GLN  25  33.154   2.368 -22.635
  270   1HE2  GLN  25          1HE2      GLN  25  35.180   3.349 -22.852
  271   2HE2  GLN  25          2HE2      GLN  25  36.513   2.970 -21.813
  272    H    CYS  26           HN       CYS  26  30.873   1.068 -20.137
  273    HA   CYS  26           HA       CYS  26  29.796   1.492 -17.563
  274   1HB   CYS  26          2HB       CYS  26  29.274  -0.520 -18.845
  275   2HB   CYS  26          3HB       CYS  26  30.959  -1.002 -18.846
  276    H    ALA  27           HN       ALA  27  30.876   1.789 -15.622
  277    HA   ALA  27           HA       ALA  27  33.793   1.783 -15.765
  278   1HB   ALA  27          1HB       ALA  27  33.543   3.064 -13.597
  279   2HB   ALA  27          2HB       ALA  27  32.816   3.856 -15.015
  280   3HB   ALA  27          3HB       ALA  27  31.782   3.007 -13.841
  281    H    TYR  28           HN       TYR  28  32.303  -0.744 -15.736
  282    HA   TYR  28           HA       TYR  28  33.263  -1.735 -13.140
  283   1HB   TYR  28          2HB       TYR  28  30.655  -1.459 -13.631
  284   2HB   TYR  28          3HB       TYR  28  30.873  -2.786 -14.754
  285    HD1  TYR  28           HD1      TYR  28  30.765  -1.819 -11.216
  286    HD2  TYR  28           HD2      TYR  28  31.351  -5.057 -13.949
  287    HE1  TYR  28           HE1      TYR  28  30.464  -3.484  -9.319
  288    HE2  TYR  28           HE2      TYR  28  31.048  -6.711 -12.043
  289    HH   TYR  28           HH       TYR  28  30.414  -6.960  -9.963
  290    H    CYS  29           HN       CYS  29  31.964  -2.945 -16.321
  291    HA   CYS  29           HA       CYS  29  34.007  -5.001 -16.244
  292   1HB   CYS  29          2HB       CYS  29  32.768  -6.017 -18.106
  293   2HB   CYS  29          3HB       CYS  29  31.731  -5.729 -16.723
  294    H    LYS  30           HN       LYS  30  33.283  -1.869 -17.592
  295    HA   LYS  30           HA       LYS  30  34.647  -0.534 -18.766
  296   1HB   LYS  30          2HB       LYS  30  36.405  -2.613 -18.219
  297   2HB   LYS  30          3HB       LYS  30  36.443  -2.512 -19.967
  298   1HG   LYS  30          2HG       LYS  30  37.761  -0.677 -19.825
  299   2HG   LYS  30          3HG       LYS  30  36.460   0.186 -19.026
  300   1HD   LYS  30          2HD       LYS  30  37.617  -1.566 -17.067
  301   2HD   LYS  30          3HD       LYS  30  38.949  -0.785 -17.895
  302   1HE   LYS  30          2HE       LYS  30  38.477   1.259 -16.980
  303   2HE   LYS  30          3HE       LYS  30  36.758   1.100 -17.281
  304   1HZ   LYS  30          1HZ       LYS  30  37.043  -0.656 -15.360
  305   2HZ   LYS  30          2HZ       LYS  30  38.277   0.336 -14.954
  306   3HZ   LYS  30          3HZ       LYS  30  36.757   0.923 -15.060
  307    H    GLU  31           HN       GLU  31  32.242  -2.161 -19.578
  308    HA   GLU  31           HA       GLU  31  32.755  -2.384 -22.422
  309   1HB   GLU  31          2HB       GLU  31  30.405  -3.282 -20.699
  310   2HB   GLU  31          3HB       GLU  31  30.444  -3.450 -22.443
  311   1HG   GLU  31          2HG       GLU  31  32.365  -4.933 -22.349
  312   2HG   GLU  31          3HG       GLU  31  32.639  -4.581 -20.655
  313    H    LYS  32           HN       LYS  32  31.973  -0.904 -23.893
  314    HA   LYS  32           HA       LYS  32  30.617   1.399 -22.791
  315   1HB   LYS  32          2HB       LYS  32  31.207   2.501 -24.797
  316   2HB   LYS  32          3HB       LYS  32  32.596   1.531 -24.352
  317   1HG   LYS  32          2HG       LYS  32  30.504   0.366 -26.209
  318   2HG   LYS  32          3HG       LYS  32  31.688   1.490 -26.847
  319   1HD   LYS  32          2HD       LYS  32  33.209  -0.297 -25.271
  320   2HD   LYS  32          3HD       LYS  32  32.029  -1.322 -26.063
  321   1HE   LYS  32          2HE       LYS  32  33.254  -1.222 -27.967
  322   2HE   LYS  32          3HE       LYS  32  32.925   0.496 -28.068
  323   1HZ   LYS  32          1HZ       LYS  32  34.959  -0.211 -26.182
  324   2HZ   LYS  32          2HZ       LYS  32  35.340  -0.544 -27.734
  325   3HZ   LYS  32          3HZ       LYS  32  34.942   0.978 -27.300
  326    H    GLY  33           HN       GLY  33  28.519   2.058 -23.265
  327   1HA   GLY  33          1HA       GLY  33  26.682   1.779 -24.923
  328   2HA   GLY  33          2HA       GLY  33  26.893   0.052 -24.710
  329    H    HIS  34           HN       HIS  34  27.418   0.024 -21.851
  330    HA   HIS  34           HA       HIS  34  24.853   1.026 -20.853
  331   1HB   HIS  34          2HB       HIS  34  24.532  -0.978 -19.588
  332   2HB   HIS  34          3HB       HIS  34  24.798  -1.418 -21.263
  333    HD1  HIS  34           HD1      HIS  34  26.795  -2.921 -21.802
  334    HD2  HIS  34           HD2      HIS  34  26.756  -1.579 -17.828
  335    HE1  HIS  34           HE1      HIS  34  28.601  -4.247 -20.582
  336    H    TRP  35           HN       TRP  35  24.853   1.235 -18.385
  337    HA   TRP  35           HA       TRP  35  27.431   2.383 -17.623
  338   1HB   TRP  35          2HB       TRP  35  24.591   2.936 -16.975
  339   2HB   TRP  35          3HB       TRP  35  25.742   3.150 -15.670
  340    HD1  TRP  35           HD1      TRP  35  26.022   4.164 -19.448
  341    HE1  TRP  35           HE1      TRP  35  26.710   6.702 -19.668
  342    HE3  TRP  35           HE3      TRP  35  26.092   5.119 -14.455
  343    HZ2  TRP  35           HZ2      TRP  35  27.196   8.777 -17.771
  344    HZ3  TRP  35           HZ3      TRP  35  26.683   7.427 -13.722
  345    HH2  TRP  35           HH2      TRP  35  27.223   9.225 -15.289
  346    H    ALA  36           HN       ALA  36  28.103   2.009 -15.285
  347    HA   ALA  36           HA       ALA  36  28.306  -0.716 -14.775
  348   1HB   ALA  36          1HB       ALA  36  28.671   1.683 -12.935
  349   2HB   ALA  36          2HB       ALA  36  29.272   0.039 -12.616
  350   3HB   ALA  36          3HB       ALA  36  29.912   0.969 -13.992
  351    H    LYS  37           HN       LYS  37  25.969   1.772 -13.689
  352    HA   LYS  37           HA       LYS  37  24.807   0.211 -11.661
  353   1HB   LYS  37          2HB       LYS  37  24.040   2.676 -13.191
  354   2HB   LYS  37          3HB       LYS  37  22.835   1.879 -12.201
  355   1HG   LYS  37          2HG       LYS  37  23.711   3.075 -10.468
  356   2HG   LYS  37          3HG       LYS  37  25.012   1.902 -10.486
  357   1HD   LYS  37          2HD       LYS  37  26.041   3.481 -12.361
  358   2HD   LYS  37          3HD       LYS  37  24.955   4.681 -11.688
  359   1HE   LYS  37          2HE       LYS  37  26.538   3.149  -9.671
  360   2HE   LYS  37          3HE       LYS  37  27.488   4.174 -10.729
  361   1HZ   LYS  37          1HZ       LYS  37  26.563   5.213  -8.663
  362   2HZ   LYS  37          2HZ       LYS  37  26.307   6.040 -10.048
  363   3HZ   LYS  37          3HZ       LYS  37  25.094   5.178  -9.374
  364    H    ASP  38           HN       ASP  38  24.864  -0.141 -15.069
  365    HA   ASP  38           HA       ASP  38  22.556  -1.904 -14.849
  366   1HB   ASP  38          2HB       ASP  38  22.543   0.372 -16.356
  367   2HB   ASP  38          3HB       ASP  38  23.256  -0.727 -17.521
  368    H    CYS  39           HN       CYS  39  25.502  -2.360 -14.495
  369    HA   CYS  39           HA       CYS  39  26.581  -3.416 -16.862
  370   1HB   CYS  39          2HB       CYS  39  27.932  -2.667 -14.912
  371   2HB   CYS  39          3HB       CYS  39  27.339  -4.033 -13.987
  372    HA   PRO  40           HA       PRO  40  24.261  -7.141 -16.762
  373   1HB   PRO  40          2HB       PRO  40  25.306  -8.299 -19.006
  374   2HB   PRO  40          3HB       PRO  40  23.997  -7.136 -19.050
  375   1HG   PRO  40          2HG       PRO  40  26.841  -6.751 -19.757
  376   2HG   PRO  40          3HG       PRO  40  25.460  -5.762 -20.186
  377   1HD   PRO  40          2HD       PRO  40  27.424  -5.189 -18.176
  378   2HD   PRO  40          3HD       PRO  40  25.981  -4.259 -18.525
  379    H    LYS  41           HN       LYS  41  27.368  -6.713 -15.932
  380    HA   LYS  41           HA       LYS  41  27.771  -9.592 -15.550
  381   1HB   LYS  41          2HB       LYS  41  29.477  -8.258 -16.855
  382   2HB   LYS  41          3HB       LYS  41  29.838  -7.384 -15.379
  383   1HG   LYS  41          2HG       LYS  41  29.892 -10.085 -14.579
  384   2HG   LYS  41          3HG       LYS  41  30.623 -10.112 -16.172
  385   1HD   LYS  41          2HD       LYS  41  32.529  -9.563 -15.009
  386   2HD   LYS  41          3HD       LYS  41  31.904  -7.933 -15.164
  387   1HE   LYS  41          2HE       LYS  41  32.328  -8.067 -12.853
  388   2HE   LYS  41          3HE       LYS  41  30.619  -8.446 -12.926
  389   1HZ   LYS  41          1HZ       LYS  41  31.512 -10.112 -11.648
  390   2HZ   LYS  41          2HZ       LYS  41  31.424 -10.835 -13.110
  391   3HZ   LYS  41          3HZ       LYS  41  32.858 -10.281 -12.558
  392    H    LYS  42           HN       LYS  42  26.847  -6.651 -14.011
  393    HA   LYS  42           HA       LYS  42  27.960  -6.922 -11.502
  394   1HB   LYS  42          2HB       LYS  42  25.751  -5.467 -12.748
  395   2HB   LYS  42          3HB       LYS  42  25.414  -5.881 -11.080
  396   1HG   LYS  42          2HG       LYS  42  27.686  -4.938 -10.445
  397   2HG   LYS  42          3HG       LYS  42  27.891  -4.417 -12.106
  398   1HD   LYS  42          2HD       LYS  42  25.781  -3.053 -11.914
  399   2HD   LYS  42          3HD       LYS  42  25.638  -3.539 -10.237
  400   1HE   LYS  42          2HE       LYS  42  27.995  -2.558  -9.873
  401   2HE   LYS  42          3HE       LYS  42  27.875  -1.881 -11.485
  402   1HZ   LYS  42          1HZ       LYS  42  26.944  -0.208 -10.364
  403   2HZ   LYS  42          2HZ       LYS  42  25.579  -1.100 -10.449
  404   3HZ   LYS  42          3HZ       LYS  42  26.485  -1.121  -9.090
  405    HA   PRO  43           HA       PRO  43  25.996 -10.361  -9.790
  406   1HB   PRO  43          2HB       PRO  43  26.137  -9.807  -7.117
  407   2HB   PRO  43          3HB       PRO  43  27.488 -10.437  -8.037
  408   1HG   PRO  43          2HG       PRO  43  27.043  -7.690  -7.043
  409   2HG   PRO  43          3HG       PRO  43  28.536  -8.435  -7.577
  410   1HD   PRO  43          2HD       PRO  43  26.929  -6.568  -9.046
  411   2HD   PRO  43          3HD       PRO  43  28.359  -7.401  -9.623
  412    H    ARG  44           HN       ARG  44  24.856  -7.350  -8.349
  413    HA   ARG  44           HA       ARG  44  22.193  -8.413  -8.759
  414   1HB   ARG  44          2HB       ARG  44  21.473  -7.551  -6.534
  415   2HB   ARG  44          3HB       ARG  44  22.723  -8.766  -6.361
  416   1HG   ARG  44          2HG       ARG  44  24.442  -7.041  -6.040
  417   2HG   ARG  44          3HG       ARG  44  23.294  -5.768  -6.401
  418   1HD   ARG  44          2HD       ARG  44  22.662  -5.695  -4.223
  419   2HD   ARG  44          3HD       ARG  44  22.149  -7.368  -4.299
  420    HE   ARG  44           HE       ARG  44  24.865  -7.638  -4.043
  421   1HH1  ARG  44          2HH2      ARG  44  22.508  -5.729  -2.258
  422   2HH1  ARG  44          1HH2      ARG  44  23.401  -5.778  -0.776
  423   1HH2  ARG  44          2HH1      ARG  44  26.044  -7.702  -2.087
  424   2HH2  ARG  44          1HH1      ARG  44  25.426  -6.908  -0.677
  425    H    GLY  45           HN       GLY  45  20.557  -6.735  -9.102
  426   1HA   GLY  45          1HA       GLY  45  20.544  -4.116  -8.778
  427   2HA   GLY  45          2HA       GLY  45  21.724  -4.236 -10.067
  428    HA   PRO  46           HA       PRO  46  20.756  -2.455 -10.553
  429   1HB   PRO  46          2HB       PRO  46  18.961  -0.478 -11.133
  430   2HB   PRO  46          3HB       PRO  46  20.090  -1.122 -12.309
  431   1HG   PRO  46          2HG       PRO  46  17.184  -1.610 -12.070
  432   2HG   PRO  46          3HG       PRO  46  18.234  -1.885 -13.446
  433   1HD   PRO  46          2HD       PRO  46  17.205  -3.870 -11.650
  434   2HD   PRO  46          3HD       PRO  46  18.346  -4.127 -12.954
  435    H    ARG  47           HN       ARG  47  17.330  -2.566  -9.717
  436    HA   ARG  47           HA       ARG  47  18.198  -1.760  -7.056
  437   1HB   ARG  47          2HB       ARG  47  16.603  -0.226  -8.602
  438   2HB   ARG  47          3HB       ARG  47  15.358  -1.290  -7.977
  439   1HG   ARG  47          2HG       ARG  47  17.272  -0.229  -5.938
  440   2HG   ARG  47          3HG       ARG  47  16.236   0.970  -6.686
  441   1HD   ARG  47          2HD       ARG  47  14.483  -1.168  -6.142
  442   2HD   ARG  47          3HD       ARG  47  15.545  -1.144  -4.750
  443    HE   ARG  47           HE       ARG  47  13.611   0.927  -5.510
  444   1HH1  ARG  47          2HH2      ARG  47  16.511   0.225  -3.643
  445   2HH1  ARG  47          1HH2      ARG  47  16.282   1.548  -2.549
  446   1HH2  ARG  47          2HH1      ARG  47  13.308   2.672  -4.068
  447   2HH2  ARG  47          1HH1      ARG  47  14.448   2.949  -2.792
  448    H    GLY  48           HN       GLY  48  18.020  -3.483  -5.658
  449   1HA   GLY  48          1HA       GLY  48  16.866  -5.906  -6.167
  450   2HA   GLY  48          2HA       GLY  48  17.125  -5.238  -4.566
  451    HA   PRO  49           HA       PRO  49  12.587  -5.405  -5.677
  452   1HB   PRO  49          2HB       PRO  49  11.826  -7.907  -4.883
  453   2HB   PRO  49          3HB       PRO  49  12.163  -7.492  -6.552
  454   1HG   PRO  49          2HG       PRO  49  13.822  -9.040  -4.656
  455   2HG   PRO  49          3HG       PRO  49  13.924  -8.974  -6.405
  456   1HD   PRO  49          2HD       PRO  49  15.656  -7.660  -4.534
  457   2HD   PRO  49          3HD       PRO  49  15.686  -7.503  -6.279
  458    H    ARG  50           HN       ARG  50  11.798  -4.002  -4.241
  459    HA   ARG  50           HA       ARG  50  11.303  -3.159  -2.306
  460   1HB   ARG  50          2HB       ARG  50   9.898  -5.491  -2.531
  461   2HB   ARG  50          3HB       ARG  50  10.749  -5.828  -1.037
  462   1HG   ARG  50          2HG       ARG  50   9.941  -3.529  -0.197
  463   2HG   ARG  50          3HG       ARG  50   8.909  -3.465  -1.612
  464   1HD   ARG  50          2HD       ARG  50   8.689  -6.037  -0.164
  465   2HD   ARG  50          3HD       ARG  50   8.258  -4.663   0.836
  466    HE   ARG  50           HE       ARG  50   7.059  -4.615  -1.851
  467   1HH1  ARG  50          2HH2      ARG  50   6.675  -5.639   1.494
  468   2HH1  ARG  50          1HH2      ARG  50   4.950  -5.752   1.395
  469   1HH2  ARG  50          2HH1      ARG  50   4.783  -4.765  -1.982
  470   2HH2  ARG  50          1HH1      ARG  50   3.866  -5.252  -0.596
  471    HA   PRO  51           HA       PRO  51  15.148  -4.049  -0.182
  472   1HB   PRO  51          2HB       PRO  51  15.818  -1.456   0.362
  473   2HB   PRO  51          3HB       PRO  51  16.317  -2.289  -1.097
  474   1HG   PRO  51          2HG       PRO  51  14.221  -0.230  -0.762
  475   2HG   PRO  51          3HG       PRO  51  15.018  -0.757  -2.232
  476   1HD   PRO  51          2HD       PRO  51  12.374  -1.458  -1.366
  477   2HD   PRO  51          3HD       PRO  51  13.215  -2.074  -2.776
  478    H    GLN  52           HN       GLN  52  12.952  -1.516   0.936
  479    HA   GLN  52           HA       GLN  52  12.119  -1.102   2.897
  480   1HB   GLN  52          2HB       GLN  52  12.387  -4.112   3.066
  481   2HB   GLN  52          3HB       GLN  52  11.804  -3.217   4.455
  482   1HG   GLN  52          2HG       GLN  52  10.539  -2.489   1.844
  483   2HG   GLN  52          3HG       GLN  52  10.190  -4.107   2.419
  484   1HE2  GLN  52          1HE2      GLN  52   8.007  -3.173   2.489
  485   2HE2  GLN  52          2HE2      GLN  52   7.477  -2.369   3.929
  486    H    THR  53           HN       THR  53  14.209   0.137   3.211
  487    HA   THR  53           HA       THR  53  15.624  -0.954   5.548
  488    HB   THR  53           HB       THR  53  17.706   0.090   4.547
  489    HG1  THR  53           HG1      THR  53  17.442   0.959   2.436
  490   1HG2  THR  53          1HG2      THR  53  17.473  -1.443   2.271
  491   2HG2  THR  53          2HG2      THR  53  17.889  -2.117   3.865
  492   3HG2  THR  53          3HG2      THR  53  16.207  -2.173   3.287
  493    H    SER  54           HN       SER  54  15.067   2.055   3.593
  494    HA   SER  54           HA       SER  54  14.662   4.099   4.195
  495   1HB   SER  54          2HB       SER  54  12.875   2.647   5.636
  496   2HB   SER  54          3HB       SER  54  13.729   3.409   6.962
  497    HG   SER  54           HG       SER  54  12.823   5.299   6.493
  498    H    LEU  55           HN       LEU  55  15.500   5.938   5.490
  499    HA   LEU  55           HA       LEU  55  17.770   5.106   7.161
  500   1HB   LEU  55          2HB       LEU  55  18.981   6.997   6.376
  501   2HB   LEU  55          3HB       LEU  55  18.416   6.071   5.000
  502    HG   LEU  55           HG       LEU  55  16.593   8.245   5.777
  503   1HD1  LEU  55          1HD1      LEU  55  18.603   9.407   6.382
  504   2HD1  LEU  55          2HD1      LEU  55  19.409   8.900   4.877
  505   3HD1  LEU  55          3HD1      LEU  55  18.037  10.032   4.815
  506   1HD2  LEU  55          1HD2      LEU  55  17.908   7.853   3.101
  507   2HD2  LEU  55          2HD2      LEU  55  16.635   6.746   3.667
  508   3HD2  LEU  55          3HD2      LEU  55  16.288   8.483   3.488
  509    H    LEU  56           HN       LEU  56  17.853   5.860   9.233
  510    HA   LEU  56           HA       LEU  56  16.272   8.189   9.917
  511   1HB   LEU  56          2HB       LEU  56  15.132   7.036  11.756
  512   2HB   LEU  56          3HB       LEU  56  14.627   6.486  10.170
  513    HG   LEU  56           HG       LEU  56  16.780   4.821  11.163
  514   1HD1  LEU  56          1HD1      LEU  56  16.328   4.814  13.352
  515   2HD1  LEU  56          2HD1      LEU  56  14.763   5.633  13.131
  516   3HD1  LEU  56          3HD1      LEU  56  14.884   3.871  12.911
  517   1HD2  LEU  56          1HD2      LEU  56  14.767   4.514   9.434
  518   2HD2  LEU  56          2HD2      LEU  56  15.536   3.144  10.271
  519   3HD2  LEU  56          3HD2      LEU  56  13.996   3.805  10.872
  Start of MODEL   11
    1   1H5*    C 504          1H5*        C 504  37.355  -5.770  -1.788
    2   2H5*    C 504          2H5*        C 504  37.659  -5.216  -3.435
    3    H4*    C 504           H4*        C 504  38.176  -7.658  -2.854
    4    H3*    C 504           H3*        C 504  36.334  -7.286  -5.243
    5    H2*    C 504           H2*        C 504  37.406  -9.247  -5.948
    6   2HO*    C 504          2HO*        C 504  39.478  -8.230  -5.611
    7    H1*    C 504           H1*        C 504  37.308 -10.656  -3.838
    8   1H4     C 504          1H4         C 504  31.165  -8.866  -2.596
    9   2H4     C 504          2H4         C 504  31.083  -8.749  -4.340
   10    H5     C 504           H5         C 504  32.962  -8.916  -5.761
   11    H6     C 504           H6         C 504  35.408  -9.239  -5.857
   12   1H5*    C 505          1H5*        C 505  39.639  -8.392  -7.598
   13   2H5*    C 505          2H5*        C 505  39.773  -6.948  -8.601
   14    H4*    C 505           H4*        C 505  39.695  -8.879 -10.017
   15    H3*    C 505           H3*        C 505  37.310  -7.072 -10.102
   16    H2*    C 505           H2*        C 505  36.271  -8.436 -11.752
   17   2HO*    C 505          2HO*        C 505  37.603  -9.750 -12.923
   18    H1*    C 505           H1*        C 505  36.750 -10.801 -10.296
   19   1H4     C 505          1H4         C 505  30.743  -9.107  -8.894
   20   2H4     C 505          2H4         C 505  31.360  -8.107  -7.598
   21    H5     C 505           H5         C 505  33.658  -7.726  -7.210
   22    H6     C 505           H6         C 505  35.954  -8.217  -7.977
   23   1H5*    U 506          1H5*        U 506  39.515  -3.351 -10.041
   24   2H5*    U 506          2H5*        U 506  38.294  -3.563  -8.788
   25    H4*    U 506           H4*        U 506  37.628  -2.390 -10.974
   26    H3*    U 506           H3*        U 506  36.015  -4.600  -9.695
   27    H2*    U 506           H2*        U 506  34.381  -4.330 -11.329
   28   2HO*    U 506          2HO*        U 506  35.696  -1.847 -11.950
   29    H1*    U 506           H1*        U 506  36.431  -3.482 -13.275
   30    H3     U 506           H3         U 506  35.796  -6.906 -16.103
   31    H5     U 506           H5         U 506  34.011  -8.281 -12.573
   32    H6     U 506           H6         U 506  34.818  -6.237 -11.486
   33   1H5*    C 507          1H5*        C 507  34.745  -0.422 -10.496
   34   2H5*    C 507          2H5*        C 507  34.498   0.144  -8.844
   35    H4*    C 507           H4*        C 507  33.315   1.250 -10.972
   36    H3*    C 507           H3*        C 507  32.435   1.075  -8.117
   37    H2*    C 507           H2*        C 507  30.367   2.124  -8.632
   38   2HO*    C 507          2HO*        C 507  31.436   3.531 -10.164
   39    H1*    C 507           H1*        C 507  29.860   0.459 -10.827
   40   1H4     C 507          1H4         C 507  26.842  -2.130  -5.793
   41   2H4     C 507          2H4         C 507  28.220  -3.186  -5.586
   42    H5     C 507           H5         C 507  30.225  -2.990  -6.820
   43    H6     C 507           H6         C 507  31.410  -1.717  -8.574
   44   1H5*    C 508          1H5*        C 508  35.178   4.912  -6.044
   45   2H5*    C 508          2H5*        C 508  33.470   5.350  -5.989
   46    H4*    C 508           H4*        C 508  34.391   7.426  -6.076
   47    H3*    C 508           H3*        C 508  33.665   6.566  -8.788
   48    H2*    C 508           H2*        C 508  34.974   8.140  -9.942
   49   2HO*    C 508          2HO*        C 508  34.664   9.965  -8.756
   50    H1*    C 508           H1*        C 508  37.310   7.773  -8.662
   51   1H4     C 508          1H4         C 508  37.091   1.730 -11.119
   52   2H4     C 508          2H4         C 508  36.407   2.568 -12.493
   53    H5     C 508           H5         C 508  35.775   4.844 -12.467
   54    H6     C 508           H6         C 508  35.643   6.896 -11.099
   55   1H5*    G 509          1H5*        G 509  32.310  10.931 -10.292
   56   2H5*    G 509          2H5*        G 509  30.858  10.569  -9.358
   57    H4*    G 509           H4*        G 509  30.612  11.337 -11.803
   58    H3*    G 509           H3*        G 509  29.145   8.988 -10.604
   59    H2*    G 509           H2*        G 509  27.877   8.826 -12.601
   60   2HO*    G 509          2HO*        G 509  27.808  11.192 -12.682
   61    H1*    G 509           H1*        G 509  30.199   9.172 -14.221
   62    H8     G 509           H8         G 509  29.520   6.832 -11.247
   63    H1     G 509           H1         G 509  30.029   3.960 -17.024
   64   1H2     G 509          1H2         G 509  30.362   5.386 -18.475
   65   2H2     G 509          2H2         G 509  30.485   7.104 -18.172
   66   1H5*    U 510          1H5*        U 510  25.955  13.572  -9.112
   67   2H5*    U 510          2H5*        U 510  26.520  12.445  -7.879
   68    H4*    U 510           H4*        U 510  24.348  12.577  -7.255
   69    H3*    U 510           H3*        U 510  24.719  10.259  -8.955
   70    H2*    U 510           H2*        U 510  22.564  10.041  -9.815
   71   2HO*    U 510          2HO*        U 510  21.515  12.073  -8.162
   72    H1*    U 510           H1*        U 510  22.016  12.574 -10.481
   73    H3     U 510           H3         U 510  26.213  13.350 -12.959
   74    H5     U 510           H5         U 510  24.643   9.499 -13.450
   75    H6     U 510           H6         U 510  23.148   9.974 -11.564
   76   1H    ALA   1           HN       ALA   1  51.240 -12.424  32.543
   77    HA   ALA   1           HA       ALA   1  48.769 -13.237  31.623
   78   1HB   ALA   1          1HB       ALA   1  47.506 -11.041  32.106
   79   2HB   ALA   1          2HB       ALA   1  47.648 -12.207  33.442
   80   3HB   ALA   1          3HB       ALA   1  48.705 -10.777  33.395
   81    H    THR   2           HN       THR   2  49.447 -13.116  29.532
   82    HA   THR   2           HA       THR   2  50.353 -10.477  28.610
   83    HB   THR   2           HB       THR   2  51.640 -13.216  28.176
   84    HG1  THR   2           HG1      THR   2  52.524 -10.524  28.949
   85   1HG2  THR   2          1HG2      THR   2  53.140 -12.162  26.569
   86   2HG2  THR   2          2HG2      THR   2  51.482 -11.862  25.996
   87   3HG2  THR   2          3HG2      THR   2  52.384 -10.572  26.827
   88    H    VAL   3           HN       VAL   3  48.862  -9.720  27.254
   89    HA   VAL   3           HA       VAL   3  46.907 -11.332  26.091
   90    HB   VAL   3           HB       VAL   3  46.781  -8.897  26.573
   91   1HG1  VAL   3          1HG1      VAL   3  47.878  -8.006  24.029
   92   2HG1  VAL   3          2HG1      VAL   3  48.169  -7.393  25.674
   93   3HG1  VAL   3          3HG1      VAL   3  49.125  -8.759  25.052
   94   1HG2  VAL   3          1HG2      VAL   3  45.943  -8.541  23.932
   95   2HG2  VAL   3          2HG2      VAL   3  45.827 -10.296  24.203
   96   3HG2  VAL   3          3HG2      VAL   3  44.973  -9.171  25.285
   97    H    VAL   4           HN       VAL   4  46.772 -12.451  24.177
   98    HA   VAL   4           HA       VAL   4  49.121 -12.243  22.421
   99    HB   VAL   4           HB       VAL   4  48.825 -14.637  21.960
  100   1HG1  VAL   4          1HG1      VAL   4  50.495 -14.578  23.478
  101   2HG1  VAL   4          2HG1      VAL   4  49.589 -13.522  24.588
  102   3HG1  VAL   4          3HG1      VAL   4  49.281 -15.276  24.577
  103   1HG2  VAL   4          1HG2      VAL   4  47.338 -15.538  24.178
  104   2HG2  VAL   4          2HG2      VAL   4  46.369 -14.241  23.438
  105   3HG2  VAL   4          3HG2      VAL   4  46.890 -15.632  22.458
  106    H    SER   5           HN       SER   5  47.558 -10.453  21.589
  107    HA   SER   5           HA       SER   5  46.010 -11.721  19.498
  108   1HB   SER   5          2HB       SER   5  44.944  -9.992  21.671
  109   2HB   SER   5          3HB       SER   5  44.438  -9.519  20.061
  110    HG   SER   5           HG       SER   5  43.353 -11.421  21.522
  111    H    GLY   6           HN       GLY   6  45.649 -10.243  17.619
  112   1HA   GLY   6          1HA       GLY   6  46.480  -7.649  17.372
  113   2HA   GLY   6          2HA       GLY   6  47.943  -8.590  17.158
  114    H    GLN   7           HN       GLN   7  47.168  -7.127  14.999
  115    HA   GLN   7           HA       GLN   7  46.793  -9.125  13.076
  116   1HB   GLN   7          2HB       GLN   7  44.645  -8.425  12.122
  117   2HB   GLN   7          3HB       GLN   7  44.420  -8.921  13.788
  118   1HG   GLN   7          2HG       GLN   7  44.474  -6.539  14.522
  119   2HG   GLN   7          3HG       GLN   7  44.747  -6.025  12.868
  120   1HE2  GLN   7          1HE2      GLN   7  42.633  -5.100  14.348
  121   2HE2  GLN   7          2HE2      GLN   7  41.133  -5.679  13.707
  122    H    LYS   8           HN       LYS   8  46.528  -7.998  10.778
  123    HA   LYS   8           HA       LYS   8  47.659  -5.310  10.845
  124   1HB   LYS   8          2HB       LYS   8  49.451  -5.891   9.326
  125   2HB   LYS   8          3HB       LYS   8  49.579  -6.848  10.787
  126   1HG   LYS   8          2HG       LYS   8  48.013  -7.994   8.475
  127   2HG   LYS   8          3HG       LYS   8  49.761  -7.970   8.353
  128   1HD   LYS   8          2HD       LYS   8  49.812  -9.083  10.682
  129   2HD   LYS   8          3HD       LYS   8  48.083  -9.315  10.514
  130   1HE   LYS   8          2HE       LYS   8  48.457 -10.595   8.395
  131   2HE   LYS   8          3HE       LYS   8  50.187 -10.359   8.556
  132   1HZ   LYS   8          1HZ       LYS   8  50.299 -11.932  10.095
  133   2HZ   LYS   8          2HZ       LYS   8  48.963 -11.438  10.894
  134   3HZ   LYS   8          3HZ       LYS   8  48.822 -12.407   9.587
  135    H    GLN   9           HN       GLN   9  46.962  -4.010   9.155
  136    HA   GLN   9           HA       GLN   9  45.547  -5.333   7.010
  137   1HB   GLN   9          2HB       GLN   9  44.317  -3.432   9.010
  138   2HB   GLN   9          3HB       GLN   9  43.739  -3.414   7.356
  139   1HG   GLN   9          2HG       GLN   9  42.506  -5.276   7.736
  140   2HG   GLN   9          3HG       GLN   9  43.950  -6.172   8.164
  141   1HE2  GLN   9          1HE2      GLN   9  41.094  -5.892   9.223
  142   2HE2  GLN   9          2HE2      GLN   9  41.269  -5.718  10.937
  143    H    ASP  10           HN       ASP  10  46.189  -4.460   5.085
  144    HA   ASP  10           HA       ASP  10  47.298  -1.768   5.231
  145   1HB   ASP  10          2HB       ASP  10  48.285  -4.264   4.072
  146   2HB   ASP  10          3HB       ASP  10  48.141  -3.042   2.824
  147    H    ARG  11           HN       ARG  11  47.000  -0.485   3.124
  148    HA   ARG  11           HA       ARG  11  44.654  -1.428   1.686
  149   1HB   ARG  11          2HB       ARG  11  45.176   1.227   3.017
  150   2HB   ARG  11          3HB       ARG  11  44.309   1.259   1.494
  151   1HG   ARG  11          2HG       ARG  11  43.253  -0.863   3.206
  152   2HG   ARG  11          3HG       ARG  11  43.250   0.665   4.067
  153   1HD   ARG  11          2HD       ARG  11  41.610   1.560   2.731
  154   2HD   ARG  11          3HD       ARG  11  42.314   0.914   1.263
  155    HE   ARG  11           HE       ARG  11  41.177  -1.209   2.878
  156   1HH1  ARG  11          2HH2      ARG  11  40.315   1.384   0.660
  157   2HH1  ARG  11          1HH2      ARG  11  38.849   0.623   0.138
  158   1HH2  ARG  11          2HH1      ARG  11  39.242  -2.212   2.192
  159   2HH2  ARG  11          1HH1      ARG  11  38.234  -1.436   1.016
  160    H    GLN  12           HN       GLN  12  44.409  -0.158  -0.502
  161    HA   GLN  12           HA       GLN  12  47.089   0.075  -1.603
  162   1HB   GLN  12          2HB       GLN  12  44.944  -1.442  -2.455
  163   2HB   GLN  12          3HB       GLN  12  44.776  -0.023  -3.469
  164   1HG   GLN  12          2HG       GLN  12  47.099  -0.251  -4.263
  165   2HG   GLN  12          3HG       GLN  12  47.385  -1.578  -3.153
  166   1HE2  GLN  12          1HE2      GLN  12  47.873  -3.058  -4.706
  167   2HE2  GLN  12          2HE2      GLN  12  46.723  -3.729  -5.814
  168    H    GLY  13           HN       GLY  13  47.227   1.699  -3.543
  169   1HA   GLY  13          1HA       GLY  13  45.834   4.178  -2.729
  170   2HA   GLY  13          2HA       GLY  13  47.463   4.101  -3.369
  171    H    GLY  14           HN       GLY  14  47.668   4.652  -5.490
  172   1HA   GLY  14          1HA       GLY  14  47.196   4.923  -7.670
  173   2HA   GLY  14          2HA       GLY  14  46.112   3.551  -7.548
  174    H    GLU  15           HN       GLU  15  45.943   6.341  -8.895
  175    HA   GLU  15           HA       GLU  15  43.201   6.689  -8.309
  176   1HB   GLU  15          2HB       GLU  15  44.697   8.063  -6.545
  177   2HB   GLU  15          3HB       GLU  15  44.758   9.223  -7.857
  178   1HG   GLU  15          2HG       GLU  15  42.255   9.204  -7.984
  179   2HG   GLU  15          3HG       GLU  15  42.199   8.056  -6.663
  180    H    ARG  16           HN       ARG  16  42.303   7.036 -10.292
  181    HA   ARG  16           HA       ARG  16  43.892   8.617 -12.146
  182   1HB   ARG  16          2HB       ARG  16  42.326   6.051 -12.674
  183   2HB   ARG  16          3HB       ARG  16  42.794   7.129 -13.973
  184   1HG   ARG  16          2HG       ARG  16  44.907   6.304 -13.979
  185   2HG   ARG  16          3HG       ARG  16  45.100   6.661 -12.274
  186   1HD   ARG  16          2HD       ARG  16  43.646   4.491 -11.892
  187   2HD   ARG  16          3HD       ARG  16  44.053   4.113 -13.553
  188    HE   ARG  16           HE       ARG  16  45.846   3.999 -11.265
  189   1HH1  ARG  16          2HH2      ARG  16  45.730   4.518 -14.743
  190   2HH1  ARG  16          1HH2      ARG  16  47.370   4.024 -15.000
  191   1HH2  ARG  16          2HH1      ARG  16  48.010   3.346 -11.603
  192   2HH2  ARG  16          1HH1      ARG  16  48.676   3.354 -13.203
  193    H    ARG  17           HN       ARG  17  42.685  10.078 -13.492
  194    HA   ARG  17           HA       ARG  17  40.438  11.130 -12.407
  195   1HB   ARG  17          2HB       ARG  17  40.126  12.217 -14.710
  196   2HB   ARG  17          3HB       ARG  17  41.715  12.420 -14.000
  197   1HG   ARG  17          2HG       ARG  17  42.512  11.614 -15.980
  198   2HG   ARG  17          3HG       ARG  17  42.044  10.039 -15.374
  199   1HD   ARG  17          2HD       ARG  17  39.957  10.069 -16.566
  200   2HD   ARG  17          3HD       ARG  17  40.045  11.796 -16.851
  201    HE   ARG  17           HE       ARG  17  42.305  10.365 -18.021
  202   1HH1  ARG  17          2HH2      ARG  17  38.955  11.311 -18.534
  203   2HH1  ARG  17          1HH2      ARG  17  39.060  11.219 -20.260
  204   1HH2  ARG  17          2HH1      ARG  17  42.443  10.244 -20.299
  205   2HH2  ARG  17          1HH1      ARG  17  41.058  10.608 -21.271
  206    H    ARG  18           HN       ARG  18  40.806   8.552 -14.879
  207    HA   ARG  18           HA       ARG  18  38.635   7.174 -14.349
  208   1HB   ARG  18          2HB       ARG  18  37.814   9.694 -15.615
  209   2HB   ARG  18          3HB       ARG  18  37.302   8.325 -16.582
  210   1HG   ARG  18          2HG       ARG  18  36.138   7.323 -14.675
  211   2HG   ARG  18          3HG       ARG  18  36.800   8.518 -13.577
  212   1HD   ARG  18          2HD       ARG  18  34.966   9.189 -15.929
  213   2HD   ARG  18          3HD       ARG  18  34.411   8.989 -14.279
  214    HE   ARG  18           HE       ARG  18  36.433  10.853 -14.015
  215   1HH1  ARG  18          2HH2      ARG  18  33.578  10.656 -16.063
  216   2HH1  ARG  18          1HH2      ARG  18  33.376  12.372 -16.167
  217   1HH2  ARG  18          2HH1      ARG  18  36.168  13.119 -14.152
  218   2HH2  ARG  18          1HH1      ARG  18  34.860  13.783 -15.073
  219    H    SER  19           HN       SER  19  40.431   5.802 -15.159
  220    HA   SER  19           HA       SER  19  41.677   5.853 -17.473
  221   1HB   SER  19          2HB       SER  19  40.663   3.669 -15.731
  222   2HB   SER  19          3HB       SER  19  41.051   3.161 -17.362
  223    HG   SER  19           HG       SER  19  42.926   2.978 -16.062
  224    H    GLN  20           HN       GLN  20  40.668   6.670 -19.332
  225    HA   GLN  20           HA       GLN  20  39.114   6.911 -20.885
  226   1HB   GLN  20          2HB       GLN  20  38.941   4.871 -22.349
  227   2HB   GLN  20          3HB       GLN  20  40.583   5.262 -21.884
  228   1HG   GLN  20          2HG       GLN  20  40.444   3.569 -20.029
  229   2HG   GLN  20          3HG       GLN  20  38.819   3.160 -20.541
  230   1HE2  GLN  20          1HE2      GLN  20  38.511   2.404 -22.747
  231   2HE2  GLN  20          2HE2      GLN  20  39.736   1.446 -23.510
  232    H    LEU  21           HN       LEU  21  37.588   7.169 -18.774
  233    HA   LEU  21           HA       LEU  21  35.485   5.137 -18.940
  234   1HB   LEU  21          2HB       LEU  21  36.703   5.894 -16.753
  235   2HB   LEU  21          3HB       LEU  21  35.631   7.277 -16.848
  236    HG   LEU  21           HG       LEU  21  35.064   4.476 -16.115
  237   1HD1  LEU  21          1HD1      LEU  21  34.766   5.909 -14.352
  238   2HD1  LEU  21          2HD1      LEU  21  34.140   7.224 -15.374
  239   3HD1  LEU  21          3HD1      LEU  21  33.105   5.828 -14.987
  240   1HD2  LEU  21          1HD2      LEU  21  33.846   4.334 -18.127
  241   2HD2  LEU  21          2HD2      LEU  21  32.647   4.718 -16.869
  242   3HD2  LEU  21          3HD2      LEU  21  33.224   5.994 -17.968
  243    H    ASP  22           HN       ASP  22  34.647   5.887 -20.982
  244    HA   ASP  22           HA       ASP  22  34.023   8.504 -21.499
  245   1HB   ASP  22          2HB       ASP  22  33.811   6.112 -22.838
  246   2HB   ASP  22          3HB       ASP  22  32.120   6.423 -22.501
  247    H    ARG  23           HN       ARG  23  31.726   9.462 -21.634
  248    HA   ARG  23           HA       ARG  23  30.500   9.244 -19.149
  249   1HB   ARG  23          2HB       ARG  23  30.519  11.237 -20.823
  250   2HB   ARG  23          3HB       ARG  23  29.215  10.415 -21.658
  251   1HG   ARG  23          2HG       ARG  23  28.436  12.136 -19.967
  252   2HG   ARG  23          3HG       ARG  23  27.765  10.535 -19.718
  253   1HD   ARG  23          2HD       ARG  23  28.917  10.205 -17.739
  254   2HD   ARG  23          3HD       ARG  23  30.346  11.048 -18.302
  255    HE   ARG  23           HE       ARG  23  28.465  13.073 -18.066
  256   1HH1  ARG  23          2HH2      ARG  23  29.694  10.604 -15.882
  257   2HH1  ARG  23          1HH2      ARG  23  29.441  11.556 -14.458
  258   1HH2  ARG  23          2HH1      ARG  23  28.132  14.331 -16.189
  259   2HH2  ARG  23          1HH1      ARG  23  28.547  13.692 -14.633
  260    H    ASP  24           HN       ASP  24  30.406   7.169 -21.819
  261    HA   ASP  24           HA       ASP  24  27.841   6.130 -20.920
  262   1HB   ASP  24          2HB       ASP  24  28.857   6.209 -23.800
  263   2HB   ASP  24          3HB       ASP  24  27.369   5.442 -23.280
  264    H    GLN  25           HN       GLN  25  30.766   5.544 -20.314
  265    HA   GLN  25           HA       GLN  25  30.904   2.870 -21.472
  266   1HB   GLN  25          2HB       GLN  25  32.868   4.954 -21.259
  267   2HB   GLN  25          3HB       GLN  25  33.387   3.644 -20.217
  268   1HG   GLN  25          2HG       GLN  25  32.837   2.076 -22.242
  269   2HG   GLN  25          3HG       GLN  25  32.806   3.543 -23.200
  270   1HE2  GLN  25          1HE2      GLN  25  34.624   4.247 -24.028
  271   2HE2  GLN  25          2HE2      GLN  25  36.229   3.811 -23.547
  272    H    CYS  26           HN       CYS  26  30.612   1.156 -20.104
  273    HA   CYS  26           HA       CYS  26  29.829   1.516 -17.496
  274   1HB   CYS  26          2HB       CYS  26  29.290  -0.486 -18.793
  275   2HB   CYS  26          3HB       CYS  26  30.975  -0.968 -18.812
  276    H    ALA  27           HN       ALA  27  30.945   1.732 -15.554
  277    HA   ALA  27           HA       ALA  27  33.862   1.751 -15.767
  278   1HB   ALA  27          1HB       ALA  27  31.975   2.898 -13.670
  279   2HB   ALA  27          2HB       ALA  27  33.743   3.099 -13.702
  280   3HB   ALA  27          3HB       ALA  27  32.743   3.810 -14.991
  281    H    TYR  28           HN       TYR  28  32.340  -0.767 -15.717
  282    HA   TYR  28           HA       TYR  28  33.355  -1.781 -13.150
  283   1HB   TYR  28          2HB       TYR  28  30.747  -1.500 -13.565
  284   2HB   TYR  28          3HB       TYR  28  30.926  -2.788 -14.740
  285    HD1  TYR  28           HD1      TYR  28  30.749  -1.950 -11.199
  286    HD2  TYR  28           HD2      TYR  28  31.574  -5.081 -13.994
  287    HE1  TYR  28           HE1      TYR  28  30.482  -3.678  -9.353
  288    HE2  TYR  28           HE2      TYR  28  31.304  -6.799 -12.139
  289    HH   TYR  28           HH       TYR  28  30.064  -6.908  -9.956
  290    H    CYS  29           HN       CYS  29  32.011  -2.951 -16.326
  291    HA   CYS  29           HA       CYS  29  34.047  -5.018 -16.294
  292   1HB   CYS  29          2HB       CYS  29  32.776  -6.019 -18.140
  293   2HB   CYS  29          3HB       CYS  29  31.760  -5.737 -16.741
  294    H    LYS  30           HN       LYS  30  33.240  -1.898 -17.672
  295    HA   LYS  30           HA       LYS  30  34.621  -0.549 -18.832
  296   1HB   LYS  30          2HB       LYS  30  36.407  -2.529 -18.282
  297   2HB   LYS  30          3HB       LYS  30  36.335  -2.648 -20.029
  298   1HG   LYS  30          2HG       LYS  30  37.572  -0.763 -20.261
  299   2HG   LYS  30          3HG       LYS  30  36.425   0.157 -19.307
  300   1HD   LYS  30          2HD       LYS  30  37.874  -1.504 -17.470
  301   2HD   LYS  30          3HD       LYS  30  39.061  -0.798 -18.550
  302   1HE   LYS  30          2HE       LYS  30  36.920   1.025 -17.466
  303   2HE   LYS  30          3HE       LYS  30  38.169   0.500 -16.354
  304   1HZ   LYS  30          1HZ       LYS  30  38.381   2.499 -18.167
  305   2HZ   LYS  30          2HZ       LYS  30  39.615   1.824 -17.337
  306   3HZ   LYS  30          3HZ       LYS  30  39.255   1.294 -18.839
  307    H    GLU  31           HN       GLU  31  32.186  -2.172 -19.595
  308    HA   GLU  31           HA       GLU  31  32.608  -2.428 -22.441
  309   1HB   GLU  31          2HB       GLU  31  31.367  -4.180 -21.073
  310   2HB   GLU  31          3HB       GLU  31  30.087  -3.008 -20.830
  311   1HG   GLU  31          2HG       GLU  31  30.851  -3.210 -23.668
  312   2HG   GLU  31          3HG       GLU  31  30.354  -4.760 -23.018
  313    H    LYS  32           HN       LYS  32  31.937  -0.911 -23.921
  314    HA   LYS  32           HA       LYS  32  30.665   1.462 -22.841
  315   1HB   LYS  32          2HB       LYS  32  32.657   1.753 -24.200
  316   2HB   LYS  32          3HB       LYS  32  31.937   0.861 -25.526
  317   1HG   LYS  32          2HG       LYS  32  29.987   2.730 -25.161
  318   2HG   LYS  32          3HG       LYS  32  31.359   3.647 -24.572
  319   1HD   LYS  32          2HD       LYS  32  32.569   2.892 -26.762
  320   2HD   LYS  32          3HD       LYS  32  30.979   2.421 -27.329
  321   1HE   LYS  32          2HE       LYS  32  30.709   5.052 -26.213
  322   2HE   LYS  32          3HE       LYS  32  32.146   5.076 -27.215
  323   1HZ   LYS  32          1HZ       LYS  32  29.436   4.870 -27.996
  324   2HZ   LYS  32          2HZ       LYS  32  30.743   5.266 -28.891
  325   3HZ   LYS  32          3HZ       LYS  32  30.343   3.697 -28.682
  326    H    GLY  33           HN       GLY  33  28.525   1.872 -23.000
  327   1HA   GLY  33          1HA       GLY  33  26.762   1.818 -24.869
  328   2HA   GLY  33          2HA       GLY  33  26.942   0.081 -24.721
  329    H    HIS  34           HN       HIS  34  27.417  -0.014 -21.831
  330    HA   HIS  34           HA       HIS  34  24.806   0.924 -20.887
  331   1HB   HIS  34          2HB       HIS  34  24.490  -1.097 -19.667
  332   2HB   HIS  34          3HB       HIS  34  24.852  -1.523 -21.327
  333    HD1  HIS  34           HD1      HIS  34  26.830  -3.058 -21.740
  334    HD2  HIS  34           HD2      HIS  34  26.734  -1.535 -17.832
  335    HE1  HIS  34           HE1      HIS  34  28.640  -4.303 -20.442
  336    H    TRP  35           HN       TRP  35  24.707   1.359 -18.532
  337    HA   TRP  35           HA       TRP  35  27.223   2.513 -17.666
  338   1HB   TRP  35          2HB       TRP  35  24.355   2.927 -17.103
  339   2HB   TRP  35          3HB       TRP  35  25.422   3.121 -15.726
  340    HD1  TRP  35           HD1      TRP  35  25.998   4.287 -19.420
  341    HE1  TRP  35           HE1      TRP  35  26.559   6.865 -19.492
  342    HE3  TRP  35           HE3      TRP  35  25.460   5.081 -14.426
  343    HZ2  TRP  35           HZ2      TRP  35  26.711   8.901 -17.499
  344    HZ3  TRP  35           HZ3      TRP  35  25.832   7.392 -13.571
  345    HH2  TRP  35           HH2      TRP  35  26.437   9.267 -15.019
  346    H    ALA  36           HN       ALA  36  27.947   2.127 -15.370
  347    HA   ALA  36           HA       ALA  36  28.227  -0.597 -14.872
  348   1HB   ALA  36          1HB       ALA  36  29.872   0.970 -14.095
  349   2HB   ALA  36          2HB       ALA  36  28.655   1.887 -13.173
  350   3HB   ALA  36          3HB       ALA  36  29.124   0.252 -12.648
  351    H    LYS  37           HN       LYS  37  25.819   1.813 -13.821
  352    HA   LYS  37           HA       LYS  37  24.757   0.259 -11.721
  353   1HB   LYS  37          2HB       LYS  37  23.569   2.527 -13.345
  354   2HB   LYS  37          3HB       LYS  37  22.840   1.847 -11.904
  355   1HG   LYS  37          2HG       LYS  37  24.284   2.945 -10.517
  356   2HG   LYS  37          3HG       LYS  37  25.681   2.515 -11.483
  357   1HD   LYS  37          2HD       LYS  37  25.711   4.543 -12.513
  358   2HD   LYS  37          3HD       LYS  37  24.006   4.447 -12.910
  359   1HE   LYS  37          2HE       LYS  37  24.814   5.038 -10.052
  360   2HE   LYS  37          3HE       LYS  37  24.901   6.323 -11.241
  361   1HZ   LYS  37          1HZ       LYS  37  22.657   6.270 -11.555
  362   2HZ   LYS  37          2HZ       LYS  37  22.477   4.721 -11.072
  363   3HZ   LYS  37          3HZ       LYS  37  22.731   5.896  -9.967
  364    H    ASP  38           HN       ASP  38  24.824  -0.226 -15.085
  365    HA   ASP  38           HA       ASP  38  22.507  -1.974 -14.825
  366   1HB   ASP  38          2HB       ASP  38  22.613   0.226 -16.483
  367   2HB   ASP  38          3HB       ASP  38  23.244  -1.007 -17.555
  368    H    CYS  39           HN       CYS  39  25.533  -2.295 -14.466
  369    HA   CYS  39           HA       CYS  39  26.544  -3.590 -16.751
  370   1HB   CYS  39          2HB       CYS  39  27.944  -2.551 -14.962
  371   2HB   CYS  39          3HB       CYS  39  27.477  -3.842 -13.874
  372    HA   PRO  40           HA       PRO  40  24.479  -7.394 -16.104
  373   1HB   PRO  40          2HB       PRO  40  25.706  -8.871 -18.049
  374   2HB   PRO  40          3HB       PRO  40  24.358  -7.798 -18.367
  375   1HG   PRO  40          2HG       PRO  40  27.224  -7.405 -18.975
  376   2HG   PRO  40          3HG       PRO  40  25.836  -6.571 -19.645
  377   1HD   PRO  40          2HD       PRO  40  27.648  -5.566 -17.662
  378   2HD   PRO  40          3HD       PRO  40  26.194  -4.781 -18.248
  379    H    LYS  41           HN       LYS  41  27.498  -6.674 -15.177
  380    HA   LYS  41           HA       LYS  41  28.064  -9.424 -14.358
  381   1HB   LYS  41          2HB       LYS  41  29.684  -7.124 -15.140
  382   2HB   LYS  41          3HB       LYS  41  30.211  -7.809 -13.616
  383   1HG   LYS  41          2HG       LYS  41  29.845 -10.123 -14.989
  384   2HG   LYS  41          3HG       LYS  41  30.163  -9.062 -16.347
  385   1HD   LYS  41          2HD       LYS  41  32.371  -9.383 -15.900
  386   2HD   LYS  41          3HD       LYS  41  32.142  -8.297 -14.544
  387   1HE   LYS  41          2HE       LYS  41  33.172 -10.319 -13.684
  388   2HE   LYS  41          3HE       LYS  41  31.516 -10.294 -13.112
  389   1HZ   LYS  41          1HZ       LYS  41  31.297 -11.569 -15.448
  390   2HZ   LYS  41          2HZ       LYS  41  32.760 -12.090 -14.942
  391   3HZ   LYS  41          3HZ       LYS  41  31.445 -12.310 -14.000
  392    H    LYS  42           HN       LYS  42  26.774  -6.394 -13.270
  393    HA   LYS  42           HA       LYS  42  27.561  -6.568 -10.569
  394   1HB   LYS  42          2HB       LYS  42  25.755  -4.929 -12.226
  395   2HB   LYS  42          3HB       LYS  42  25.226  -5.118 -10.567
  396   1HG   LYS  42          2HG       LYS  42  27.423  -4.344  -9.735
  397   2HG   LYS  42          3HG       LYS  42  28.045  -4.259 -11.370
  398   1HD   LYS  42          2HD       LYS  42  27.394  -2.068 -11.273
  399   2HD   LYS  42          3HD       LYS  42  25.799  -2.699 -11.633
  400   1HE   LYS  42          2HE       LYS  42  25.092  -2.583  -9.368
  401   2HE   LYS  42          3HE       LYS  42  26.732  -2.576  -8.751
  402   1HZ   LYS  42          1HZ       LYS  42  26.845  -0.379 -10.091
  403   2HZ   LYS  42          2HZ       LYS  42  25.221  -0.394  -9.923
  404   3HZ   LYS  42          3HZ       LYS  42  26.179  -0.398  -8.601
  405    HA   PRO  43           HA       PRO  43  24.897  -9.918  -9.636
  406   1HB   PRO  43          2HB       PRO  43  25.934 -10.475  -7.169
  407   2HB   PRO  43          3HB       PRO  43  26.586 -11.137  -8.654
  408   1HG   PRO  43          2HG       PRO  43  27.674  -8.977  -6.957
  409   2HG   PRO  43          3HG       PRO  43  28.493  -9.931  -8.176
  410   1HD   PRO  43          2HD       PRO  43  27.572  -7.228  -8.445
  411   2HD   PRO  43          3HD       PRO  43  28.286  -8.222  -9.699
  412    H    ARG  44           HN       ARG  44  23.542 -10.609  -7.585
  413    HA   ARG  44           HA       ARG  44  22.645  -8.154  -6.349
  414   1HB   ARG  44          2HB       ARG  44  21.167  -9.675  -8.359
  415   2HB   ARG  44          3HB       ARG  44  20.290  -9.700  -6.842
  416   1HG   ARG  44          2HG       ARG  44  21.358  -7.022  -7.388
  417   2HG   ARG  44          3HG       ARG  44  20.371  -7.585  -8.722
  418   1HD   ARG  44          2HD       ARG  44  18.582  -6.895  -7.482
  419   2HD   ARG  44          3HD       ARG  44  18.835  -8.346  -6.532
  420    HE   ARG  44           HE       ARG  44  20.559  -6.187  -5.634
  421   1HH1  ARG  44          2HH2      ARG  44  17.272  -7.426  -5.448
  422   2HH1  ARG  44          1HH2      ARG  44  16.936  -6.670  -3.925
  423   1HH2  ARG  44          2HH1      ARG  44  20.119  -5.190  -3.626
  424   2HH2  ARG  44          1HH1      ARG  44  18.567  -5.390  -2.882
  425    H    GLY  45           HN       GLY  45  23.808  -9.129  -4.487
  426   1HA   GLY  45          1HA       GLY  45  22.588 -11.578  -3.408
  427   2HA   GLY  45          2HA       GLY  45  24.122 -10.871  -2.940
  428    HA   PRO  46           HA       PRO  46  23.735 -11.971  -1.250
  429   1HB   PRO  46          2HB       PRO  46  22.646 -13.159   0.958
  430   2HB   PRO  46          3HB       PRO  46  23.988 -12.035   1.038
  431   1HG   PRO  46          2HG       PRO  46  21.153 -11.589   1.744
  432   2HG   PRO  46          3HG       PRO  46  22.559 -10.651   2.205
  433   1HD   PRO  46          2HD       PRO  46  20.621  -9.968   0.203
  434   2HD   PRO  46          3HD       PRO  46  22.089  -9.090   0.584
  435    H    ARG  47           HN       ARG  47  23.564 -13.797  -2.415
  436    HA   ARG  47           HA       ARG  47  20.800 -14.661  -2.724
  437   1HB   ARG  47          2HB       ARG  47  21.940 -13.574  -4.775
  438   2HB   ARG  47          3HB       ARG  47  23.000 -14.968  -4.821
  439   1HG   ARG  47          2HG       ARG  47  20.129 -15.685  -4.610
  440   2HG   ARG  47          3HG       ARG  47  20.514 -14.790  -6.066
  441   1HD   ARG  47          2HD       ARG  47  22.524 -16.471  -6.310
  442   2HD   ARG  47          3HD       ARG  47  21.661 -17.449  -5.141
  443    HE   ARG  47           HE       ARG  47  19.910 -16.586  -7.295
  444   1HH1  ARG  47          2HH2      ARG  47  22.379 -18.945  -6.446
  445   2HH1  ARG  47          1HH2      ARG  47  21.835 -20.118  -7.597
  446   1HH2  ARG  47          2HH1      ARG  47  19.192 -18.133  -8.815
  447   2HH2  ARG  47          1HH1      ARG  47  20.010 -19.653  -8.954
  448    H    GLY  48           HN       GLY  48  20.397 -16.876  -2.417
  449   1HA   GLY  48          1HA       GLY  48  21.994 -19.017  -2.842
  450   2HA   GLY  48          2HA       GLY  48  22.542 -18.439  -1.281
  451    HA   PRO  49           HA       PRO  49  18.045 -20.001  -1.000
  452   1HB   PRO  49          2HB       PRO  49  17.358 -21.969  -2.768
  453   2HB   PRO  49          3HB       PRO  49  16.927 -20.286  -2.993
  454   1HG   PRO  49          2HG       PRO  49  19.011 -21.866  -4.372
  455   2HG   PRO  49          3HG       PRO  49  18.284 -20.347  -4.858
  456   1HD   PRO  49          2HD       PRO  49  20.881 -20.712  -3.696
  457   2HD   PRO  49          3HD       PRO  49  20.106 -19.185  -4.075
  458    H    ARG  50           HN       ARG  50  17.789 -21.184   0.787
  459    HA   ARG  50           HA       ARG  50  19.485 -23.550   0.819
  460   1HB   ARG  50          2HB       ARG  50  19.171 -21.366   2.701
  461   2HB   ARG  50          3HB       ARG  50  18.625 -22.839   3.480
  462   1HG   ARG  50          2HG       ARG  50  20.844 -23.894   2.517
  463   2HG   ARG  50          3HG       ARG  50  21.359 -22.232   2.309
  464   1HD   ARG  50          2HD       ARG  50  21.986 -22.225   4.493
  465   2HD   ARG  50          3HD       ARG  50  20.291 -22.302   4.927
  466    HE   ARG  50           HE       ARG  50  20.557 -24.559   5.484
  467   1HH1  ARG  50          2HH2      ARG  50  23.270 -23.536   3.491
  468   2HH1  ARG  50          1HH2      ARG  50  24.148 -25.014   3.702
  469   1HH2  ARG  50          2HH1      ARG  50  21.715 -26.510   5.762
  470   2HH2  ARG  50          1HH1      ARG  50  23.258 -26.717   5.003
  471    HA   PRO  51           HA       PRO  51  15.832 -25.856   1.432
  472   1HB   PRO  51          2HB       PRO  51  16.807 -28.127   2.599
  473   2HB   PRO  51          3HB       PRO  51  16.885 -27.826   0.874
  474   1HG   PRO  51          2HG       PRO  51  19.050 -27.678   2.881
  475   2HG   PRO  51          3HG       PRO  51  19.175 -27.803   1.137
  476   1HD   PRO  51          2HD       PRO  51  19.571 -25.446   2.722
  477   2HD   PRO  51          3HD       PRO  51  19.582 -25.546   0.973
  478    H    GLN  52           HN       GLN  52  14.554 -27.252   3.119
  479    HA   GLN  52           HA       GLN  52  14.872 -25.758   5.606
  480   1HB   GLN  52          2HB       GLN  52  12.815 -25.139   4.347
  481   2HB   GLN  52          3HB       GLN  52  12.299 -26.813   4.351
  482   1HG   GLN  52          2HG       GLN  52  11.131 -25.940   6.197
  483   2HG   GLN  52          3HG       GLN  52  12.534 -26.659   6.962
  484   1HE2  GLN  52          1HE2      GLN  52  10.949 -24.611   8.052
  485   2HE2  GLN  52          2HE2      GLN  52  11.908 -23.181   8.245
  486    H    THR  53           HN       THR  53  15.967 -27.178   6.938
  487    HA   THR  53           HA       THR  53  14.633 -29.730   7.446
  488    HB   THR  53           HB       THR  53  17.525 -29.294   6.574
  489    HG1  THR  53           HG1      THR  53  16.361 -30.069   4.843
  490   1HG2  THR  53          1HG2      THR  53  16.954 -30.919   8.714
  491   2HG2  THR  53          2HG2      THR  53  16.570 -32.021   7.370
  492   3HG2  THR  53          3HG2      THR  53  18.197 -31.311   7.501
  493    H    SER  54           HN       SER  54  13.864 -29.189   9.441
  494    HA   SER  54           HA       SER  54  15.950 -28.459  11.343
  495   1HB   SER  54          2HB       SER  54  14.373 -27.055  12.544
  496   2HB   SER  54          3HB       SER  54  14.385 -26.555  10.864
  497    HG   SER  54           HG       SER  54  12.444 -27.906  10.554
  498    H    LEU  55           HN       LEU  55  16.238 -30.049  12.860
  499    HA   LEU  55           HA       LEU  55  13.948 -31.822  13.356
  500   1HB   LEU  55          2HB       LEU  55  16.328 -32.532  12.321
  501   2HB   LEU  55          3HB       LEU  55  16.704 -32.683  14.026
  502    HG   LEU  55           HG       LEU  55  14.350 -34.029  13.954
  503   1HD1  LEU  55          1HD1      LEU  55  15.361 -35.342  11.586
  504   2HD1  LEU  55          2HD1      LEU  55  13.721 -34.754  11.954
  505   3HD1  LEU  55          3HD1      LEU  55  14.921 -33.653  11.236
  506   1HD2  LEU  55          1HD2      LEU  55  17.176 -34.686  14.042
  507   2HD2  LEU  55          2HD2      LEU  55  15.806 -35.396  14.929
  508   3HD2  LEU  55          3HD2      LEU  55  16.220 -35.994  13.305
  509    H    LEU  56           HN       LEU  56  16.977 -30.616  14.972
  510    HA   LEU  56           HA       LEU  56  15.971 -31.039  17.550
  511   1HB   LEU  56          2HB       LEU  56  18.389 -30.485  16.457
  512   2HB   LEU  56          3HB       LEU  56  17.994 -28.924  17.147
  513    HG   LEU  56           HG       LEU  56  17.428 -30.431  19.285
  514   1HD1  LEU  56          1HD1      LEU  56  18.664 -32.293  17.502
  515   2HD1  LEU  56          2HD1      LEU  56  19.752 -32.013  18.883
  516   3HD1  LEU  56          3HD1      LEU  56  18.076 -32.546  19.162
  517   1HD2  LEU  56          1HD2      LEU  56  19.670 -29.917  20.133
  518   2HD2  LEU  56          2HD2      LEU  56  20.219 -29.568  18.476
  519   3HD2  LEU  56          3HD2      LEU  56  18.975 -28.546  19.235
  Start of MODEL   12
    1   1H5*    C 504          1H5*        C 504  36.677  -5.395  -1.774
    2   2H5*    C 504          2H5*        C 504  36.652  -4.583  -3.339
    3    H4*    C 504           H4*        C 504  38.374  -6.460  -2.914
    4    H3*    C 504           H3*        C 504  36.668  -6.503  -5.432
    5    H2*    C 504           H2*        C 504  38.309  -7.945  -6.272
    6   2HO*    C 504          2HO*        C 504  39.907  -7.053  -4.049
    7    H1*    C 504           H1*        C 504  38.543  -9.623  -4.372
    8   1H4     C 504          1H4         C 504  32.084  -9.963  -3.560
    9   2H4     C 504          2H4         C 504  32.076  -9.629  -5.276
   10    H5     C 504           H5         C 504  33.998  -9.019  -6.507
   11    H6     C 504           H6         C 504  36.423  -8.574  -6.390
   12   1H5*    C 505          1H5*        C 505  40.317  -7.010  -7.441
   13   2H5*    C 505          2H5*        C 505  40.221  -5.606  -8.504
   14    H4*    C 505           H4*        C 505  40.393  -7.691  -9.762
   15    H3*    C 505           H3*        C 505  37.936  -6.004 -10.067
   16    H2*    C 505           H2*        C 505  37.035  -7.513 -11.661
   17   2HO*    C 505          2HO*        C 505  38.962  -7.991 -12.719
   18    H1*    C 505           H1*        C 505  37.635  -9.775 -10.069
   19   1H4     C 505          1H4         C 505  31.447  -8.597  -9.003
   20   2H4     C 505          2H4         C 505  31.898  -7.387  -7.823
   21    H5     C 505           H5         C 505  34.125  -6.714  -7.415
   22    H6     C 505           H6         C 505  36.491  -7.039  -8.046
   23   1H5*    U 506          1H5*        U 506  39.863  -2.167 -10.067
   24   2H5*    U 506          2H5*        U 506  38.613  -2.422  -8.849
   25    H4*    U 506           H4*        U 506  37.905  -1.306 -11.013
   26    H3*    U 506           H3*        U 506  36.471  -3.743  -9.941
   27    H2*    U 506           H2*        U 506  34.837  -3.444 -11.601
   28   2HO*    U 506          2HO*        U 506  36.111  -0.944 -12.208
   29    H1*    U 506           H1*        U 506  36.881  -2.572 -13.494
   30    H3     U 506           H3         U 506  36.665  -6.228 -16.098
   31    H5     U 506           H5         U 506  34.825  -7.493 -12.554
   32    H6     U 506           H6         U 506  35.431  -5.324 -11.583
   33   1H5*    C 507          1H5*        C 507  34.655   0.540 -10.711
   34   2H5*    C 507          2H5*        C 507  34.318   0.727  -8.990
   35    H4*    C 507           H4*        C 507  32.905   1.900 -10.993
   36    H3*    C 507           H3*        C 507  32.195   1.263  -8.147
   37    H2*    C 507           H2*        C 507  29.994   2.084  -8.490
   38   2HO*    C 507          2HO*        C 507  30.789   2.694 -11.175
   39    H1*    C 507           H1*        C 507  29.596   0.646 -10.842
   40   1H4     C 507          1H4         C 507  27.383  -3.013  -6.059
   41   2H4     C 507          2H4         C 507  28.912  -3.861  -6.080
   42    H5     C 507           H5         C 507  30.767  -3.198  -7.383
   43    H6     C 507           H6         C 507  31.617  -1.542  -9.006
   44   1H5*    C 508          1H5*        C 508  34.044   5.477  -5.668
   45   2H5*    C 508          2H5*        C 508  32.406   6.054  -5.975
   46    H4*    C 508           H4*        C 508  33.585   8.017  -6.018
   47    H3*    C 508           H3*        C 508  33.102   7.024  -8.740
   48    H2*    C 508           H2*        C 508  34.692   8.380  -9.813
   49   2HO*    C 508          2HO*        C 508  35.742   9.923  -8.006
   50    H1*    C 508           H1*        C 508  36.807   7.893  -8.223
   51   1H4     C 508          1H4         C 508  36.291   1.739 -10.336
   52   2H4     C 508          2H4         C 508  35.858   2.537 -11.831
   53    H5     C 508           H5         C 508  35.452   4.857 -12.016
   54    H6     C 508           H6         C 508  35.360   7.003 -10.798
   55   1H5*    G 509          1H5*        G 509  32.717   9.770 -11.024
   56   2H5*    G 509          2H5*        G 509  31.679  10.693  -9.936
   57    H4*    G 509           H4*        G 509  30.835  11.382 -11.929
   58    H3*    G 509           H3*        G 509  29.273   8.950 -11.141
   59    H2*    G 509           H2*        G 509  27.996   9.073 -13.142
   60   2HO*    G 509          2HO*        G 509  29.458  11.306 -14.061
   61    H1*    G 509           H1*        G 509  30.206   9.299 -14.801
   62    H8     G 509           H8         G 509  30.114   7.167 -11.608
   63    H1     G 509           H1         G 509  29.593   3.902 -17.171
   64   1H2     G 509          1H2         G 509  29.580   5.228 -18.750
   65   2H2     G 509          2H2         G 509  29.693   6.966 -18.590
   66   1H5*    U 510          1H5*        U 510  27.492  13.270 -11.047
   67   2H5*    U 510          2H5*        U 510  26.540  13.232  -9.563
   68    H4*    U 510           H4*        U 510  25.583  14.885 -10.958
   69    H3*    U 510           H3*        U 510  23.959  12.363 -10.800
   70    H2*    U 510           H2*        U 510  22.276  13.339 -12.151
   71   2HO*    U 510          2HO*        U 510  22.390  15.389 -11.182
   72    H1*    U 510           H1*        U 510  24.220  14.415 -13.955
   73    H3     U 510           H3         U 510  21.781  11.612 -16.569
   74    H5     U 510           H5         U 510  24.113   9.049 -14.217
   75    H6     U 510           H6         U 510  24.825  11.022 -12.947
   76   1H    ALA   1           HN       ALA   1  74.455  21.919 -28.504
   77    HA   ALA   1           HA       ALA   1  73.138  24.436 -28.736
   78   1HB   ALA   1          1HB       ALA   1  73.447  22.629 -31.137
   79   2HB   ALA   1          2HB       ALA   1  71.984  23.622 -30.938
   80   3HB   ALA   1          3HB       ALA   1  73.581  24.401 -31.038
   81    H    THR   2           HN       THR   2  70.942  24.253 -28.140
   82    HA   THR   2           HA       THR   2  69.611  21.749 -28.088
   83    HB   THR   2           HB       THR   2  71.286  21.443 -26.210
   84    HG1  THR   2           HG1      THR   2  69.393  21.089 -24.640
   85   1HG2  THR   2          1HG2      THR   2  71.019  24.023 -25.546
   86   2HG2  THR   2          2HG2      THR   2  69.620  23.417 -24.626
   87   3HG2  THR   2          3HG2      THR   2  71.252  22.797 -24.277
   88    H    VAL   3           HN       VAL   3  67.404  21.965 -27.677
   89    HA   VAL   3           HA       VAL   3  66.499  24.591 -26.811
   90    HB   VAL   3           HB       VAL   3  66.799  24.524 -29.335
   91   1HG1  VAL   3          1HG1      VAL   3  65.943  22.189 -29.608
   92   2HG1  VAL   3          2HG1      VAL   3  64.313  22.786 -29.213
   93   3HG1  VAL   3          3HG1      VAL   3  65.149  23.377 -30.669
   94   1HG2  VAL   3          1HG2      VAL   3  65.324  26.202 -29.347
   95   2HG2  VAL   3          2HG2      VAL   3  63.958  25.089 -29.101
   96   3HG2  VAL   3          3HG2      VAL   3  64.861  25.713 -27.700
   97    H    VAL   4           HN       VAL   4  64.546  24.509 -25.691
   98    HA   VAL   4           HA       VAL   4  63.209  21.901 -25.658
   99    HB   VAL   4           HB       VAL   4  64.783  22.131 -23.748
  100   1HG1  VAL   4          1HG1      VAL   4  64.506  24.626 -23.525
  101   2HG1  VAL   4          2HG1      VAL   4  62.927  24.318 -22.764
  102   3HG1  VAL   4          3HG1      VAL   4  64.417  23.721 -21.995
  103   1HG2  VAL   4          1HG2      VAL   4  62.821  20.689 -23.575
  104   2HG2  VAL   4          2HG2      VAL   4  63.154  21.473 -22.011
  105   3HG2  VAL   4          3HG2      VAL   4  61.830  22.068 -23.042
  106    H    SER   5           HN       SER   5  60.936  21.997 -25.284
  107    HA   SER   5           HA       SER   5  59.887  24.714 -25.262
  108   1HB   SER   5          2HB       SER   5  59.789  23.756 -27.568
  109   2HB   SER   5          3HB       SER   5  58.862  22.397 -26.964
  110    HG   SER   5           HG       SER   5  57.139  23.609 -27.315
  111    H    GLY   6           HN       GLY   6  57.844  24.967 -24.150
  112   1HA   GLY   6          1HA       GLY   6  56.933  22.566 -22.687
  113   2HA   GLY   6          2HA       GLY   6  57.231  24.088 -21.871
  114    H    GLN   7           HN       GLN   7  54.680  22.746 -21.907
  115    HA   GLN   7           HA       GLN   7  53.054  24.874 -22.526
  116   1HB   GLN   7          2HB       GLN   7  53.723  23.535 -24.876
  117   2HB   GLN   7          3HB       GLN   7  52.186  22.806 -24.454
  118   1HG   GLN   7          2HG       GLN   7  51.578  25.431 -23.989
  119   2HG   GLN   7          3HG       GLN   7  52.801  25.636 -25.228
  120   1HE2  GLN   7          1HE2      GLN   7  50.136  26.331 -25.561
  121   2HE2  GLN   7          2HE2      GLN   7  49.406  25.333 -26.774
  122    H    LYS   8           HN       LYS   8  51.325  24.636 -21.164
  123    HA   LYS   8           HA       LYS   8  50.059  22.086 -20.877
  124   1HB   LYS   8          2HB       LYS   8  52.207  22.225 -19.316
  125   2HB   LYS   8          3HB       LYS   8  51.131  23.156 -18.294
  126   1HG   LYS   8          2HG       LYS   8  49.456  21.096 -18.891
  127   2HG   LYS   8          3HG       LYS   8  50.985  20.257 -19.068
  128   1HD   LYS   8          2HD       LYS   8  51.171  21.835 -16.674
  129   2HD   LYS   8          3HD       LYS   8  49.618  21.023 -16.630
  130   1HE   LYS   8          2HE       LYS   8  51.196  18.949 -17.477
  131   2HE   LYS   8          3HE       LYS   8  52.375  19.855 -16.551
  132   1HZ   LYS   8          1HZ       LYS   8  51.396  18.545 -14.984
  133   2HZ   LYS   8          2HZ       LYS   8  50.512  19.907 -14.809
  134   3HZ   LYS   8          3HZ       LYS   8  49.900  18.635 -15.630
  135    H    GLN   9           HN       GLN   9  47.964  22.284 -19.951
  136    HA   GLN   9           HA       GLN   9  47.233  24.869 -18.947
  137   1HB   GLN   9          2HB       GLN   9  46.983  24.598 -21.634
  138   2HB   GLN   9          3HB       GLN   9  45.456  23.883 -21.154
  139   1HG   GLN   9          2HG       GLN   9  45.902  26.300 -19.600
  140   2HG   GLN   9          3HG       GLN   9  46.118  26.665 -21.300
  141   1HE2  GLN   9          1HE2      GLN   9  44.446  25.839 -22.800
  142   2HE2  GLN   9          2HE2      GLN   9  42.788  25.877 -22.302
  143    H    ASP  10           HN       ASP  10  46.327  24.219 -17.034
  144    HA   ASP  10           HA       ASP  10  44.766  21.785 -17.079
  145   1HB   ASP  10          2HB       ASP  10  44.825  22.037 -14.573
  146   2HB   ASP  10          3HB       ASP  10  46.415  21.921 -15.301
  147    H    ARG  11           HN       ARG  11  42.519  21.794 -16.393
  148    HA   ARG  11           HA       ARG  11  41.378  24.466 -16.376
  149   1HB   ARG  11          2HB       ARG  11  40.551  21.858 -17.540
  150   2HB   ARG  11          3HB       ARG  11  39.246  22.694 -16.719
  151   1HG   ARG  11          2HG       ARG  11  39.235  24.466 -18.223
  152   2HG   ARG  11          3HG       ARG  11  40.960  24.374 -18.519
  153   1HD   ARG  11          2HD       ARG  11  40.736  22.788 -20.200
  154   2HD   ARG  11          3HD       ARG  11  39.361  22.012 -19.439
  155    HE   ARG  11           HE       ARG  11  37.911  23.490 -20.558
  156   1HH1  ARG  11          2HH2      ARG  11  41.229  24.625 -20.850
  157   2HH1  ARG  11          1HH2      ARG  11  40.847  25.836 -22.028
  158   1HH2  ARG  11          2HH1      ARG  11  37.406  25.089 -22.112
  159   2HH2  ARG  11          1HH1      ARG  11  38.658  26.102 -22.750
  160    H    GLN  12           HN       GLN  12  41.153  25.099 -14.230
  161    HA   GLN  12           HA       GLN  12  41.001  23.453 -12.088
  162   1HB   GLN  12          2HB       GLN  12  40.132  25.397 -10.849
  163   2HB   GLN  12          3HB       GLN  12  41.391  25.893 -11.964
  164   1HG   GLN  12          2HG       GLN  12  39.867  26.919 -13.451
  165   2HG   GLN  12          3HG       GLN  12  38.513  25.956 -12.896
  166   1HE2  GLN  12          1HE2      GLN  12  37.079  27.315 -12.121
  167   2HE2  GLN  12          2HE2      GLN  12  37.349  28.553 -10.941
  168    H    GLY  13           HN       GLY  13  39.269  22.666 -10.722
  169   1HA   GLY  13          1HA       GLY  13  36.716  22.841 -10.595
  170   2HA   GLY  13          2HA       GLY  13  36.777  22.218 -12.231
  171    H    GLY  14           HN       GLY  14  37.148  20.017 -12.610
  172   1HA   GLY  14          1HA       GLY  14  37.086  18.326 -10.227
  173   2HA   GLY  14          2HA       GLY  14  36.733  17.857 -11.878
  174    H    GLU  15           HN       GLU  15  38.729  18.132 -13.467
  175    HA   GLU  15           HA       GLU  15  40.618  17.201 -14.042
  176   1HB   GLU  15          2HB       GLU  15  41.214  19.247 -12.026
  177   2HB   GLU  15          3HB       GLU  15  42.485  18.043 -12.105
  178   1HG   GLU  15          2HG       GLU  15  41.566  18.809 -14.793
  179   2HG   GLU  15          3HG       GLU  15  42.102  20.205 -13.880
  180    H    ARG  16           HN       ARG  16  39.656  15.037 -13.422
  181    HA   ARG  16           HA       ARG  16  41.255  13.910 -11.267
  182   1HB   ARG  16          2HB       ARG  16  38.352  13.349 -12.019
  183   2HB   ARG  16          3HB       ARG  16  39.279  12.226 -11.046
  184   1HG   ARG  16          2HG       ARG  16  39.828  14.409  -9.603
  185   2HG   ARG  16          3HG       ARG  16  38.375  15.030 -10.362
  186   1HD   ARG  16          2HD       ARG  16  37.048  13.784  -8.998
  187   2HD   ARG  16          3HD       ARG  16  37.890  12.310  -9.434
  188    HE   ARG  16           HE       ARG  16  38.364  13.953  -7.058
  189   1HH1  ARG  16          2HH2      ARG  16  39.772  11.575  -9.238
  190   2HH1  ARG  16          1HH2      ARG  16  40.922  11.002  -8.076
  191   1HH2  ARG  16          2HH1      ARG  16  39.882  13.198  -5.526
  192   2HH2  ARG  16          1HH1      ARG  16  40.985  11.932  -5.950
  193    H    ARG  17           HN       ARG  17  41.370  11.357 -11.553
  194    HA   ARG  17           HA       ARG  17  41.779  10.901 -14.397
  195   1HB   ARG  17          2HB       ARG  17  43.622  10.704 -12.326
  196   2HB   ARG  17          3HB       ARG  17  43.087   9.041 -12.469
  197   1HG   ARG  17          2HG       ARG  17  43.981   8.780 -14.595
  198   2HG   ARG  17          3HG       ARG  17  43.683  10.447 -15.047
  199   1HD   ARG  17          2HD       ARG  17  45.779  11.086 -14.421
  200   2HD   ARG  17          3HD       ARG  17  45.625  10.312 -12.857
  201    HE   ARG  17           HE       ARG  17  45.997   8.147 -14.483
  202   1HH1  ARG  17          2HH2      ARG  17  47.718  11.208 -14.247
  203   2HH1  ARG  17          1HH2      ARG  17  49.231  10.543 -14.763
  204   1HH2  ARG  17          2HH1      ARG  17  47.993   7.269 -15.164
  205   2HH2  ARG  17          1HH1      ARG  17  49.389   8.287 -15.288
  206    H    ARG  18           HN       ARG  18  40.012   9.757 -15.168
  207    HA   ARG  18           HA       ARG  18  39.280   7.416 -13.612
  208   1HB   ARG  18          2HB       ARG  18  37.403   9.420 -14.953
  209   2HB   ARG  18          3HB       ARG  18  36.871   7.832 -14.435
  210   1HG   ARG  18          2HG       ARG  18  37.296   8.316 -12.121
  211   2HG   ARG  18          3HG       ARG  18  38.284   9.712 -12.506
  212   1HD   ARG  18          2HD       ARG  18  36.235  10.852 -13.462
  213   2HD   ARG  18          3HD       ARG  18  35.270   9.475 -12.967
  214    HE   ARG  18           HE       ARG  18  36.531  10.161 -10.622
  215   1HH1  ARG  18          2HH2      ARG  18  34.710  12.034 -12.979
  216   2HH1  ARG  18          1HH2      ARG  18  34.142  13.186 -11.816
  217   1HH2  ARG  18          2HH1      ARG  18  35.782  11.679  -9.086
  218   2HH2  ARG  18          1HH1      ARG  18  34.756  12.982  -9.586
  219    H    SER  19           HN       SER  19  41.119   7.055 -15.537
  220    HA   SER  19           HA       SER  19  41.596   6.360 -17.573
  221   1HB   SER  19          2HB       SER  19  40.382   4.430 -16.191
  222   2HB   SER  19          3HB       SER  19  39.165   4.573 -17.443
  223    HG   SER  19           HG       SER  19  41.944   4.319 -18.144
  224    H    GLN  20           HN       GLN  20  39.488   5.031 -19.403
  225    HA   GLN  20           HA       GLN  20  38.668   7.526 -20.614
  226   1HB   GLN  20          2HB       GLN  20  39.375   4.819 -21.578
  227   2HB   GLN  20          3HB       GLN  20  37.970   5.490 -22.381
  228   1HG   GLN  20          2HG       GLN  20  39.742   7.664 -22.290
  229   2HG   GLN  20          3HG       GLN  20  40.805   6.300 -22.574
  230   1HE2  GLN  20          1HE2      GLN  20  39.614   8.621 -24.196
  231   2HE2  GLN  20          2HE2      GLN  20  39.085   7.896 -25.677
  232    H    LEU  21           HN       LEU  21  37.244   6.841 -18.262
  233    HA   LEU  21           HA       LEU  21  34.935   5.340 -18.778
  234   1HB   LEU  21          2HB       LEU  21  36.105   6.312 -16.582
  235   2HB   LEU  21          3HB       LEU  21  34.893   7.559 -16.799
  236    HG   LEU  21           HG       LEU  21  34.527   4.641 -16.188
  237   1HD1  LEU  21          1HD1      LEU  21  34.559   6.818 -14.589
  238   2HD1  LEU  21          2HD1      LEU  21  32.825   6.741 -14.983
  239   3HD1  LEU  21          3HD1      LEU  21  33.632   5.340 -14.241
  240   1HD2  LEU  21          1HD2      LEU  21  31.992   5.214 -16.562
  241   2HD2  LEU  21          2HD2      LEU  21  32.644   6.391 -17.728
  242   3HD2  LEU  21          3HD2      LEU  21  33.010   4.659 -17.913
  243    H    ASP  22           HN       ASP  22  34.109   5.951 -20.834
  244    HA   ASP  22           HA       ASP  22  33.582   8.606 -21.471
  245   1HB   ASP  22          2HB       ASP  22  32.268   6.042 -22.489
  246   2HB   ASP  22          3HB       ASP  22  32.123   7.606 -23.264
  247    H    ARG  23           HN       ARG  23  31.279   9.502 -21.829
  248    HA   ARG  23           HA       ARG  23  29.841   9.265 -19.456
  249   1HB   ARG  23          2HB       ARG  23  29.965  11.265 -21.101
  250   2HB   ARG  23          3HB       ARG  23  28.790  10.414 -22.083
  251   1HG   ARG  23          2HG       ARG  23  27.755  12.085 -20.499
  252   2HG   ARG  23          3HG       ARG  23  27.137  10.457 -20.298
  253   1HD   ARG  23          2HD       ARG  23  28.100  10.195 -18.209
  254   2HD   ARG  23          3HD       ARG  23  29.532  11.112 -18.632
  255    HE   ARG  23           HE       ARG  23  27.665  13.091 -18.602
  256   1HH1  ARG  23          2HH2      ARG  23  28.290  10.488 -16.317
  257   2HH1  ARG  23          1HH2      ARG  23  27.724  11.383 -14.947
  258   1HH2  ARG  23          2HH1      ARG  23  26.918  14.272 -16.794
  259   2HH2  ARG  23          1HH1      ARG  23  26.938  13.550 -15.220
  260    H    ASP  24           HN       ASP  24  30.056   7.153 -22.070
  261    HA   ASP  24           HA       ASP  24  27.421   6.093 -21.443
  262   1HB   ASP  24          2HB       ASP  24  28.762   6.254 -24.182
  263   2HB   ASP  24          3HB       ASP  24  27.334   5.289 -23.863
  264    H    GLN  25           HN       GLN  25  30.252   5.560 -20.484
  265    HA   GLN  25           HA       GLN  25  30.671   2.927 -21.649
  266   1HB   GLN  25          2HB       GLN  25  32.456   4.999 -20.461
  267   2HB   GLN  25          3HB       GLN  25  32.860   3.345 -20.044
  268   1HG   GLN  25          2HG       GLN  25  32.206   3.773 -22.923
  269   2HG   GLN  25          3HG       GLN  25  33.644   4.608 -22.372
  270   1HE2  GLN  25          1HE2      GLN  25  35.448   3.502 -21.794
  271   2HE2  GLN  25          2HE2      GLN  25  35.666   1.797 -22.006
  272    H    CYS  26           HN       CYS  26  31.941   1.517 -19.695
  273    HA   CYS  26           HA       CYS  26  30.069   1.632 -17.444
  274   1HB   CYS  26          2HB       CYS  26  29.500  -0.267 -18.865
  275   2HB   CYS  26          3HB       CYS  26  31.156  -0.838 -18.834
  276    H    ALA  27           HN       ALA  27  31.080   1.791 -15.453
  277    HA   ALA  27           HA       ALA  27  33.992   1.631 -15.465
  278   1HB   ALA  27          1HB       ALA  27  32.635   3.649 -14.619
  279   2HB   ALA  27          2HB       ALA  27  32.190   2.621 -13.235
  280   3HB   ALA  27          3HB       ALA  27  33.899   3.016 -13.537
  281    H    TYR  28           HN       TYR  28  32.372  -0.814 -15.668
  282    HA   TYR  28           HA       TYR  28  33.177  -2.024 -13.113
  283   1HB   TYR  28          2HB       TYR  28  30.610  -1.591 -13.689
  284   2HB   TYR  28          3HB       TYR  28  30.816  -2.846 -14.895
  285    HD1  TYR  28           HD1      TYR  28  30.402  -2.124 -11.354
  286    HD2  TYR  28           HD2      TYR  28  31.350  -5.189 -14.184
  287    HE1  TYR  28           HE1      TYR  28  29.941  -3.900  -9.595
  288    HE2  TYR  28           HE2      TYR  28  30.886  -6.955 -12.415
  289    HH   TYR  28           HH       TYR  28  30.934  -6.522  -9.383
  290    H    CYS  29           HN       CYS  29  31.965  -2.960 -16.417
  291    HA   CYS  29           HA       CYS  29  33.978  -5.061 -16.408
  292   1HB   CYS  29          2HB       CYS  29  32.720  -6.025 -18.275
  293   2HB   CYS  29          3HB       CYS  29  31.687  -5.765 -16.883
  294    H    LYS  30           HN       LYS  30  33.535  -1.835 -17.349
  295    HA   LYS  30           HA       LYS  30  34.764  -0.472 -18.588
  296   1HB   LYS  30          2HB       LYS  30  36.446  -2.904 -18.591
  297   2HB   LYS  30          3HB       LYS  30  36.733  -1.811 -19.930
  298   1HG   LYS  30          2HG       LYS  30  36.595  -0.849 -17.039
  299   2HG   LYS  30          3HG       LYS  30  38.092  -1.375 -17.782
  300   1HD   LYS  30          2HD       LYS  30  38.345   0.626 -18.817
  301   2HD   LYS  30          3HD       LYS  30  36.776   0.474 -19.585
  302   1HE   LYS  30          2HE       LYS  30  35.907   2.046 -18.199
  303   2HE   LYS  30          3HE       LYS  30  36.335   1.086 -16.797
  304   1HZ   LYS  30          1HZ       LYS  30  38.397   2.114 -16.671
  305   2HZ   LYS  30          2HZ       LYS  30  38.323   2.728 -18.182
  306   3HZ   LYS  30          3HZ       LYS  30  37.375   3.343 -17.003
  307    H    GLU  31           HN       GLU  31  32.393  -2.134 -19.495
  308    HA   GLU  31           HA       GLU  31  32.913  -2.409 -22.304
  309   1HB   GLU  31          2HB       GLU  31  31.506  -4.071 -21.122
  310   2HB   GLU  31          3HB       GLU  31  30.368  -2.817 -20.672
  311   1HG   GLU  31          2HG       GLU  31  29.686  -2.457 -22.952
  312   2HG   GLU  31          3HG       GLU  31  31.066  -3.329 -23.589
  313    H    LYS  32           HN       LYS  32  31.192  -1.427 -23.873
  314    HA   LYS  32           HA       LYS  32  30.506   1.272 -22.943
  315   1HB   LYS  32          2HB       LYS  32  32.569   0.996 -24.520
  316   2HB   LYS  32          3HB       LYS  32  31.375   0.723 -25.772
  317   1HG   LYS  32          2HG       LYS  32  30.710   3.042 -24.064
  318   2HG   LYS  32          3HG       LYS  32  32.259   3.220 -24.863
  319   1HD   LYS  32          2HD       LYS  32  30.708   2.236 -26.932
  320   2HD   LYS  32          3HD       LYS  32  29.521   3.159 -26.033
  321   1HE   LYS  32          2HE       LYS  32  31.342   5.064 -26.019
  322   2HE   LYS  32          3HE       LYS  32  32.095   4.146 -27.309
  323   1HZ   LYS  32          1HZ       LYS  32  29.368   5.231 -27.299
  324   2HZ   LYS  32          2HZ       LYS  32  30.610   5.697 -28.251
  325   3HZ   LYS  32          3HZ       LYS  32  29.932   4.225 -28.455
  326    H    GLY  33           HN       GLY  33  28.411   1.870 -23.267
  327   1HA   GLY  33          1HA       GLY  33  26.600   1.766 -24.992
  328   2HA   GLY  33          2HA       GLY  33  26.764   0.024 -24.889
  329    H    HIS  34           HN       HIS  34  27.430   0.307 -21.875
  330    HA   HIS  34           HA       HIS  34  24.775   1.071 -20.938
  331   1HB   HIS  34          2HB       HIS  34  24.506  -0.936 -19.672
  332   2HB   HIS  34          3HB       HIS  34  24.812  -1.378 -21.341
  333    HD1  HIS  34           HD1      HIS  34  26.967  -2.702 -21.868
  334    HD2  HIS  34           HD2      HIS  34  26.627  -1.556 -17.848
  335    HE1  HIS  34           HE1      HIS  34  28.773  -3.986 -20.604
  336    H    TRP  35           HN       TRP  35  24.774   1.199 -18.434
  337    HA   TRP  35           HA       TRP  35  27.296   2.475 -17.673
  338   1HB   TRP  35          2HB       TRP  35  24.432   2.885 -16.973
  339   2HB   TRP  35          3HB       TRP  35  25.623   3.209 -15.729
  340    HD1  TRP  35           HD1      TRP  35  25.718   4.109 -19.543
  341    HE1  TRP  35           HE1      TRP  35  26.223   6.679 -19.866
  342    HE3  TRP  35           HE3      TRP  35  25.844   5.245 -14.588
  343    HZ2  TRP  35           HZ2      TRP  35  26.610   8.849 -18.055
  344    HZ3  TRP  35           HZ3      TRP  35  26.291   7.612 -13.951
  345    HH2  TRP  35           HH2      TRP  35  26.667   9.385 -15.591
  346    H    ALA  36           HN       ALA  36  28.040   2.086 -15.387
  347    HA   ALA  36           HA       ALA  36  28.308  -0.626 -14.875
  348   1HB   ALA  36          1HB       ALA  36  28.627   1.773 -13.024
  349   2HB   ALA  36          2HB       ALA  36  29.287   0.145 -12.730
  350   3HB   ALA  36          3HB       ALA  36  29.874   1.109 -14.108
  351    H    LYS  37           HN       LYS  37  25.983   1.823 -13.633
  352    HA   LYS  37           HA       LYS  37  24.872   0.203 -11.644
  353   1HB   LYS  37          2HB       LYS  37  24.143   2.716 -13.063
  354   2HB   LYS  37          3HB       LYS  37  22.842   1.864 -12.257
  355   1HG   LYS  37          2HG       LYS  37  23.555   2.979 -10.392
  356   2HG   LYS  37          3HG       LYS  37  24.781   1.729 -10.314
  357   1HD   LYS  37          2HD       LYS  37  25.885   3.539 -12.133
  358   2HD   LYS  37          3HD       LYS  37  25.059   4.596 -11.005
  359   1HE   LYS  37          2HE       LYS  37  26.441   2.511  -9.519
  360   2HE   LYS  37          3HE       LYS  37  27.564   3.258 -10.637
  361   1HZ   LYS  37          1HZ       LYS  37  25.980   4.566  -8.554
  362   2HZ   LYS  37          2HZ       LYS  37  27.604   4.561  -8.738
  363   3HZ   LYS  37          3HZ       LYS  37  26.668   5.422  -9.763
  364    H    ASP  38           HN       ASP  38  24.834  -0.065 -15.071
  365    HA   ASP  38           HA       ASP  38  22.557  -1.870 -14.826
  366   1HB   ASP  38          2HB       ASP  38  22.481   0.393 -16.311
  367   2HB   ASP  38          3HB       ASP  38  23.272  -0.642 -17.483
  368    H    CYS  39           HN       CYS  39  25.532  -2.283 -14.506
  369    HA   CYS  39           HA       CYS  39  26.565  -3.373 -16.884
  370   1HB   CYS  39          2HB       CYS  39  27.963  -2.554 -15.000
  371   2HB   CYS  39          3HB       CYS  39  27.415  -3.898 -14.016
  372    HA   PRO  40           HA       PRO  40  24.409  -7.176 -16.668
  373   1HB   PRO  40          2HB       PRO  40  25.654  -8.477 -18.724
  374   2HB   PRO  40          3HB       PRO  40  24.335  -7.347 -18.964
  375   1HG   PRO  40          2HG       PRO  40  27.223  -6.959 -19.464
  376   2HG   PRO  40          3HG       PRO  40  25.867  -6.032 -20.078
  377   1HD   PRO  40          2HD       PRO  40  27.651  -5.271 -17.964
  378   2HD   PRO  40          3HD       PRO  40  26.228  -4.400 -18.500
  379    H    LYS  41           HN       LYS  41  27.405  -6.616 -15.589
  380    HA   LYS  41           HA       LYS  41  27.897  -9.448 -15.041
  381   1HB   LYS  41          2HB       LYS  41  29.581  -7.212 -15.698
  382   2HB   LYS  41          3HB       LYS  41  30.027  -7.810 -14.112
  383   1HG   LYS  41          2HG       LYS  41  29.718 -10.192 -15.429
  384   2HG   LYS  41          3HG       LYS  41  30.191  -9.173 -16.774
  385   1HD   LYS  41          2HD       LYS  41  32.342  -9.464 -16.105
  386   2HD   LYS  41          3HD       LYS  41  31.978  -8.413 -14.751
  387   1HE   LYS  41          2HE       LYS  41  32.475 -10.179 -13.405
  388   2HE   LYS  41          3HE       LYS  41  30.944 -10.869 -13.903
  389   1HZ   LYS  41          1HZ       LYS  41  33.117 -12.160 -14.265
  390   2HZ   LYS  41          2HZ       LYS  41  31.965 -12.203 -15.422
  391   3HZ   LYS  41          3HZ       LYS  41  33.272 -11.242 -15.606
  392    H    LYS  42           HN       LYS  42  26.667  -6.498 -13.688
  393    HA   LYS  42           HA       LYS  42  27.381  -6.969 -11.000
  394   1HB   LYS  42          2HB       LYS  42  25.606  -5.131 -12.508
  395   2HB   LYS  42          3HB       LYS  42  25.148  -5.425 -10.842
  396   1HG   LYS  42          2HG       LYS  42  27.987  -5.077 -10.831
  397   2HG   LYS  42          3HG       LYS  42  27.349  -3.822 -11.874
  398   1HD   LYS  42          2HD       LYS  42  26.111  -4.373  -9.151
  399   2HD   LYS  42          3HD       LYS  42  27.514  -3.334  -9.310
  400   1HE   LYS  42          2HE       LYS  42  25.912  -2.282 -11.281
  401   2HE   LYS  42          3HE       LYS  42  24.688  -2.854 -10.165
  402   1HZ   LYS  42          1HZ       LYS  42  26.629  -0.764  -9.813
  403   2HZ   LYS  42          2HZ       LYS  42  25.116  -0.895  -9.212
  404   3HZ   LYS  42          3HZ       LYS  42  26.351  -1.687  -8.494
  405    HA   PRO  43           HA       PRO  43  24.500  -9.983  -9.893
  406   1HB   PRO  43          2HB       PRO  43  24.204  -9.521  -7.216
  407   2HB   PRO  43          3HB       PRO  43  25.570 -10.384  -7.893
  408   1HG   PRO  43          2HG       PRO  43  25.456  -7.621  -6.847
  409   2HG   PRO  43          3HG       PRO  43  26.860  -8.632  -7.125
  410   1HD   PRO  43          2HD       PRO  43  25.958  -6.459  -8.765
  411   2HD   PRO  43          3HD       PRO  43  27.292  -7.544  -9.103
  412    H    ARG  44           HN       ARG  44  22.618  -9.771 -10.991
  413    HA   ARG  44           HA       ARG  44  20.837  -7.800  -9.828
  414   1HB   ARG  44          2HB       ARG  44  21.358  -8.766 -12.552
  415   2HB   ARG  44          3HB       ARG  44  19.650  -8.875 -12.176
  416   1HG   ARG  44          2HG       ARG  44  21.262  -6.349 -11.621
  417   2HG   ARG  44          3HG       ARG  44  20.498  -6.637 -13.172
  418   1HD   ARG  44          2HD       ARG  44  18.278  -6.876 -12.031
  419   2HD   ARG  44          3HD       ARG  44  19.043  -6.581 -10.483
  420    HE   ARG  44           HE       ARG  44  19.104  -4.296 -10.979
  421   1HH1  ARG  44          2HH2      ARG  44  18.645  -6.102 -13.963
  422   2HH1  ARG  44          1HH2      ARG  44  18.392  -4.688 -14.930
  423   1HH2  ARG  44          2HH1      ARG  44  18.769  -2.429 -12.253
  424   2HH2  ARG  44          1HH1      ARG  44  18.463  -2.584 -13.952
  425    H    GLY  45           HN       GLY  45  20.389  -9.305  -7.979
  426   1HA   GLY  45          1HA       GLY  45  18.140 -10.424  -7.616
  427   2HA   GLY  45          2HA       GLY  45  18.733 -11.627  -8.744
  428    HA   PRO  46           HA       PRO  46  17.543 -12.804  -7.524
  429   1HB   PRO  46          2HB       PRO  46  16.302 -14.074  -5.447
  430   2HB   PRO  46          3HB       PRO  46  17.320 -14.904  -6.606
  431   1HG   PRO  46          2HG       PRO  46  17.924 -14.159  -3.810
  432   2HG   PRO  46          3HG       PRO  46  18.729 -15.334  -4.831
  433   1HD   PRO  46          2HD       PRO  46  19.670 -12.707  -4.165
  434   2HD   PRO  46          3HD       PRO  46  20.416 -13.837  -5.277
  435    H    ARG  47           HN       ARG  47  15.332 -12.091  -7.489
  436    HA   ARG  47           HA       ARG  47  13.745 -10.717  -6.946
  437   1HB   ARG  47          2HB       ARG  47  14.741 -11.339  -4.434
  438   2HB   ARG  47          3HB       ARG  47  14.911  -9.595  -4.436
  439   1HG   ARG  47          2HG       ARG  47  12.667  -9.281  -4.228
  440   2HG   ARG  47          3HG       ARG  47  12.316 -10.377  -5.549
  441   1HD   ARG  47          2HD       ARG  47  12.732 -12.320  -3.928
  442   2HD   ARG  47          3HD       ARG  47  12.833 -11.140  -2.637
  443    HE   ARG  47           HE       ARG  47  10.436 -10.528  -3.922
  444   1HH1  ARG  47          2HH2      ARG  47  11.788 -13.406  -2.415
  445   2HH1  ARG  47          1HH2      ARG  47  10.246 -14.042  -1.947
  446   1HH2  ARG  47          2HH1      ARG  47   8.401 -11.366  -3.307
  447   2HH2  ARG  47          1HH1      ARG  47   8.307 -12.874  -2.457
  448    H    GLY  48           HN       GLY  48  14.071  -9.163  -8.570
  449   1HA   GLY  48          1HA       GLY  48  16.093  -7.484  -9.053
  450   2HA   GLY  48          2HA       GLY  48  14.416  -7.038  -9.290
  451    HA   PRO  49           HA       PRO  49  16.101  -5.203  -5.223
  452   1HB   PRO  49          2HB       PRO  49  18.764  -4.587  -5.236
  453   2HB   PRO  49          3HB       PRO  49  18.119  -6.033  -4.485
  454   1HG   PRO  49          2HG       PRO  49  19.591  -5.768  -7.035
  455   2HG   PRO  49          3HG       PRO  49  19.316  -7.205  -6.071
  456   1HD   PRO  49          2HD       PRO  49  17.966  -6.482  -8.496
  457   2HD   PRO  49          3HD       PRO  49  17.612  -7.858  -7.469
  458    H    ARG  50           HN       ARG  50  14.776  -4.031  -7.137
  459    HA   ARG  50           HA       ARG  50  15.912  -2.047  -8.517
  460   1HB   ARG  50          2HB       ARG  50  13.406  -2.797  -8.304
  461   2HB   ARG  50          3HB       ARG  50  13.291  -1.600  -7.030
  462   1HG   ARG  50          2HG       ARG  50  13.859   0.206  -8.536
  463   2HG   ARG  50          3HG       ARG  50  14.382  -0.904  -9.788
  464   1HD   ARG  50          2HD       ARG  50  12.270  -0.551 -10.627
  465   2HD   ARG  50          3HD       ARG  50  11.811  -1.780  -9.466
  466    HE   ARG  50           HE       ARG  50  11.848   0.897  -8.296
  467   1HH1  ARG  50          2HH2      ARG  50   9.915  -1.385 -10.151
  468   2HH1  ARG  50          1HH2      ARG  50   8.404  -0.676  -9.690
  469   1HH2  ARG  50          2HH1      ARG  50   9.855   1.832  -7.687
  470   2HH2  ARG  50          1HH1      ARG  50   8.370   1.167  -8.278
  471    HA   PRO  51           HA       PRO  51  17.311   0.816  -5.527
  472   1HB   PRO  51          2HB       PRO  51  17.775   2.983  -7.126
  473   2HB   PRO  51          3HB       PRO  51  18.903   1.651  -6.967
  474   1HG   PRO  51          2HG       PRO  51  17.086   2.283  -9.211
  475   2HG   PRO  51          3HG       PRO  51  18.493   1.238  -9.199
  476   1HD   PRO  51          2HD       PRO  51  15.746   0.416  -9.161
  477   2HD   PRO  51          3HD       PRO  51  17.152  -0.622  -9.032
  478    H    GLN  52           HN       GLN  52  16.806   2.675  -4.255
  479    HA   GLN  52           HA       GLN  52  14.010   3.322  -4.697
  480   1HB   GLN  52          2HB       GLN  52  15.765   3.065  -2.293
  481   2HB   GLN  52          3HB       GLN  52  14.568   4.344  -2.221
  482   1HG   GLN  52          2HG       GLN  52  13.512   1.774  -3.278
  483   2HG   GLN  52          3HG       GLN  52  14.089   1.673  -1.626
  484   1HE2  GLN  52          1HE2      GLN  52  11.904   3.308  -3.831
  485   2HE2  GLN  52          2HE2      GLN  52  10.783   3.913  -2.657
  486    H    THR  53           HN       THR  53  13.437   5.682  -3.837
  487    HA   THR  53           HA       THR  53  15.124   7.472  -5.376
  488    HB   THR  53           HB       THR  53  12.597   7.408  -5.555
  489    HG1  THR  53           HG1      THR  53  14.094   9.360  -5.811
  490   1HG2  THR  53          1HG2      THR  53  12.176   9.092  -3.196
  491   2HG2  THR  53          2HG2      THR  53  11.258   7.660  -3.719
  492   3HG2  THR  53          3HG2      THR  53  12.713   7.466  -2.712
  493    H    SER  54           HN       SER  54  16.448   9.051  -4.622
  494    HA   SER  54           HA       SER  54  16.895   8.948  -1.768
  495   1HB   SER  54          2HB       SER  54  18.542  10.386  -3.890
  496   2HB   SER  54          3HB       SER  54  19.034  10.024  -2.248
  497    HG   SER  54           HG       SER  54  19.179   7.830  -2.730
  498    H    LEU  55           HN       LEU  55  15.473  10.319  -0.704
  499    HA   LEU  55           HA       LEU  55  15.093  12.980  -1.868
  500   1HB   LEU  55          2HB       LEU  55  13.328  11.072  -0.719
  501   2HB   LEU  55          3HB       LEU  55  13.374  12.456   0.354
  502    HG   LEU  55           HG       LEU  55  13.130  13.347  -2.387
  503   1HD1  LEU  55          1HD1      LEU  55  10.637  11.922  -1.686
  504   2HD1  LEU  55          2HD1      LEU  55  11.409  12.195  -3.266
  505   3HD1  LEU  55          3HD1      LEU  55  11.995  10.894  -2.202
  506   1HD2  LEU  55          1HD2      LEU  55  11.126  13.558  -0.131
  507   2HD2  LEU  55          2HD2      LEU  55  12.578  14.578  -0.261
  508   3HD2  LEU  55          3HD2      LEU  55  11.330  14.641  -1.528
  509    H    LEU  56           HN       LEU  56  15.365  11.435   1.416
  510    HA   LEU  56           HA       LEU  56  17.498  13.206   2.100
  511   1HB   LEU  56          2HB       LEU  56  15.020  14.307   2.383
  512   2HB   LEU  56          3HB       LEU  56  15.250  13.585   3.963
  513    HG   LEU  56           HG       LEU  56  17.268  15.446   2.686
  514   1HD1  LEU  56          1HD1      LEU  56  14.682  16.101   3.688
  515   2HD1  LEU  56          2HD1      LEU  56  15.895  16.710   4.839
  516   3HD1  LEU  56          3HD1      LEU  56  15.974  17.189   3.126
  517   1HD2  LEU  56          1HD2      LEU  56  17.990  13.851   4.522
  518   2HD2  LEU  56          2HD2      LEU  56  18.289  15.582   4.811
  519   3HD2  LEU  56          3HD2      LEU  56  16.921  14.769   5.610
  Start of MODEL   13
    1   1H5*    C 504          1H5*        C 504  37.662  -7.892  -1.650
    2   2H5*    C 504          2H5*        C 504  38.399  -7.329  -3.149
    3    H4*    C 504           H4*        C 504  37.117  -9.528  -3.217
    4    H3*    C 504           H3*        C 504  36.038  -7.527  -5.221
    5    H2*    C 504           H2*        C 504  35.878  -9.502  -6.516
    6   2HO*    C 504          2HO*        C 504  37.337 -11.053  -4.692
    7    H1*    C 504           H1*        C 504  34.976 -11.126  -4.570
    8   1H4     C 504          1H4         C 504  29.591  -8.056  -6.018
    9   2H4     C 504          2H4         C 504  30.165  -6.619  -5.202
   10    H5     C 504           H5         C 504  32.312  -6.424  -4.237
   11    H6     C 504           H6         C 504  34.457  -7.570  -3.812
   12   1H5*    C 505          1H5*        C 505  40.401  -7.123  -7.338
   13   2H5*    C 505          2H5*        C 505  40.038  -5.728  -8.354
   14    H4*    C 505           H4*        C 505  40.459  -7.837  -9.605
   15    H3*    C 505           H3*        C 505  37.923  -6.283  -9.943
   16    H2*    C 505           H2*        C 505  37.134  -7.825 -11.566
   17   2HO*    C 505          2HO*        C 505  39.565  -9.291 -11.226
   18    H1*    C 505           H1*        C 505  37.814 -10.061  -9.973
   19   1H4     C 505          1H4         C 505  31.557  -9.217  -9.005
   20   2H4     C 505          2H4         C 505  31.920  -7.963  -7.842
   21    H5     C 505           H5         C 505  34.099  -7.157  -7.411
   22    H6     C 505           H6         C 505  36.489  -7.360  -7.996
   23   1H5*    U 506          1H5*        U 506  39.522  -2.330 -10.013
   24   2H5*    U 506          2H5*        U 506  38.355  -2.647  -8.730
   25    H4*    U 506           H4*        U 506  37.453  -1.630 -10.862
   26    H3*    U 506           H3*        U 506  36.272  -4.166  -9.713
   27    H2*    U 506           H2*        U 506  34.553  -4.021 -11.297
   28   2HO*    U 506          2HO*        U 506  35.591  -1.362 -11.704
   29    H1*    U 506           H1*        U 506  36.409  -2.927 -13.273
   30    H3     U 506           H3         U 506  36.399  -6.542 -15.942
   31    H5     U 506           H5         U 506  34.872  -8.035 -12.339
   32    H6     U 506           H6         U 506  35.321  -5.836 -11.352
   33   1H5*    C 507          1H5*        C 507  34.599   0.061 -10.614
   34   2H5*    C 507          2H5*        C 507  34.238   0.313  -8.906
   35    H4*    C 507           H4*        C 507  33.015   1.587 -10.985
   36    H3*    C 507           H3*        C 507  32.254   1.167  -8.123
   37    H2*    C 507           H2*        C 507  30.111   2.124  -8.485
   38   2HO*    C 507          2HO*        C 507  30.469   2.518 -11.220
   39    H1*    C 507           H1*        C 507  29.586   0.581 -10.752
   40   1H4     C 507          1H4         C 507  27.049  -2.645  -5.839
   41   2H4     C 507          2H4         C 507  28.567  -3.498  -5.664
   42    H5     C 507           H5         C 507  30.516  -2.979  -6.895
   43    H6     C 507           H6         C 507  31.497  -1.501  -8.611
   44   1H5*    C 508          1H5*        C 508  36.078   4.806  -7.223
   45   2H5*    C 508          2H5*        C 508  34.393   4.734  -6.708
   46    H4*    C 508           H4*        C 508  34.797   6.978  -6.546
   47    H3*    C 508           H3*        C 508  33.388   6.329  -9.004
   48    H2*    C 508           H2*        C 508  33.989   8.187 -10.285
   49   2HO*    C 508          2HO*        C 508  35.206   9.891  -8.843
   50    H1*    C 508           H1*        C 508  36.625   8.278  -9.820
   51   1H4     C 508          1H4         C 508  36.822   2.401 -12.661
   52   2H4     C 508          2H4         C 508  35.602   3.124 -13.687
   53    H5     C 508           H5         C 508  34.592   5.214 -13.257
   54    H6     C 508           H6         C 508  34.501   7.147 -11.723
   55   1H5*    G 509          1H5*        G 509  32.551   9.676  -9.740
   56   2H5*    G 509          2H5*        G 509  31.069  10.125  -8.897
   57    H4*    G 509           H4*        G 509  30.967  11.030 -11.095
   58    H3*    G 509           H3*        G 509  29.126   8.709 -10.611
   59    H2*    G 509           H2*        G 509  28.229   8.939 -12.799
   60   2HO*    G 509          2HO*        G 509  29.962  11.076 -13.417
   61    H1*    G 509           H1*        G 509  30.740   9.083 -14.020
   62    H8     G 509           H8         G 509  29.955   6.762 -11.072
   63    H1     G 509           H1         G 509  29.970   3.951 -16.901
   64   1H2     G 509          1H2         G 509  30.291   5.379 -18.353
   65   2H2     G 509          2H2         G 509  30.522   7.085 -18.038
   66   1H5*    U 510          1H5*        U 510  26.497  12.881  -7.875
   67   2H5*    U 510          2H5*        U 510  25.793  11.289  -7.596
   68    H4*    U 510           H4*        U 510  24.267  13.384  -7.920
   69    H3*    U 510           H3*        U 510  23.794  10.630  -9.049
   70    H2*    U 510           H2*        U 510  21.707  11.361  -9.894
   71   2HO*    U 510          2HO*        U 510  22.102  13.943  -8.787
   72    H1*    U 510           H1*        U 510  22.850  13.830 -10.805
   73    H3     U 510           H3         U 510  22.087  12.487 -14.988
   74    H5     U 510           H5         U 510  23.887   9.105 -13.298
   75    H6     U 510           H6         U 510  23.993  10.340 -11.182
   76   1H    ALA   1           HN       ALA   1  17.697  28.093 -16.116
   77    HA   ALA   1           HA       ALA   1  19.024  27.605 -14.056
   78   1HB   ALA   1          1HB       ALA   1  18.003  30.300 -13.562
   79   2HB   ALA   1          2HB       ALA   1  17.609  29.189 -12.228
   80   3HB   ALA   1          3HB       ALA   1  19.302  29.408 -12.733
   81    H    THR   2           HN       THR   2  17.824  25.703 -14.659
   82    HA   THR   2           HA       THR   2  15.207  25.574 -13.313
   83    HB   THR   2           HB       THR   2  14.455  24.130 -15.183
   84    HG1  THR   2           HG1      THR   2  17.076  24.845 -16.283
   85   1HG2  THR   2          1HG2      THR   2  13.910  26.188 -16.087
   86   2HG2  THR   2          2HG2      THR   2  15.507  26.878 -15.706
   87   3HG2  THR   2          3HG2      THR   2  15.296  25.869 -17.159
   88    H    VAL   3           HN       VAL   3  16.646  24.965 -11.460
   89    HA   VAL   3           HA       VAL   3  16.583  22.178 -11.168
   90    HB   VAL   3           HB       VAL   3  18.542  22.362 -12.682
   91   1HG1  VAL   3          1HG1      VAL   3  19.568  24.410 -12.180
   92   2HG1  VAL   3          2HG1      VAL   3  19.593  24.079 -10.431
   93   3HG1  VAL   3          3HG1      VAL   3  20.692  23.198 -11.520
   94   1HG2  VAL   3          1HG2      VAL   3  18.331  20.965 -10.188
   95   2HG2  VAL   3          2HG2      VAL   3  19.135  20.456 -11.692
   96   3HG2  VAL   3          3HG2      VAL   3  20.039  21.379 -10.468
   97    H    VAL   4           HN       VAL   4  16.551  21.690  -8.984
   98    HA   VAL   4           HA       VAL   4  17.520  23.775  -7.175
   99    HB   VAL   4           HB       VAL   4  14.796  22.468  -7.157
  100   1HG1  VAL   4          1HG1      VAL   4  14.489  22.994  -4.989
  101   2HG1  VAL   4          2HG1      VAL   4  16.268  23.027  -4.909
  102   3HG1  VAL   4          3HG1      VAL   4  15.358  24.540  -5.138
  103   1HG2  VAL   4          1HG2      VAL   4  13.903  24.662  -7.466
  104   2HG2  VAL   4          2HG2      VAL   4  15.499  25.416  -7.228
  105   3HG2  VAL   4          3HG2      VAL   4  15.181  24.444  -8.686
  106    H    SER   5           HN       SER   5  19.258  22.681  -6.334
  107    HA   SER   5           HA       SER   5  18.619  20.057  -5.232
  108   1HB   SER   5          2HB       SER   5  20.798  19.254  -5.787
  109   2HB   SER   5          3HB       SER   5  20.221  20.068  -7.228
  110    HG   SER   5           HG       SER   5  21.938  21.327  -7.115
  111    H    GLY   6           HN       GLY   6  19.682  19.537  -3.171
  112   1HA   GLY   6          1HA       GLY   6  21.147  21.676  -1.843
  113   2HA   GLY   6          2HA       GLY   6  19.568  21.294  -1.182
  114    H    GLN   7           HN       GLN   7  22.654  19.701  -2.235
  115    HA   GLN   7           HA       GLN   7  22.617  18.207   0.205
  116   1HB   GLN   7          2HB       GLN   7  22.019  16.972  -2.450
  117   2HB   GLN   7          3HB       GLN   7  23.166  16.103  -1.450
  118   1HG   GLN   7          2HG       GLN   7  21.284  16.648   0.443
  119   2HG   GLN   7          3HG       GLN   7  20.251  16.639  -0.972
  120   1HE2  GLN   7          1HE2      GLN   7  21.483  14.800   1.430
  121   2HE2  GLN   7          2HE2      GLN   7  21.393  13.216   0.737
  122    H    LYS   8           HN       LYS   8  24.617  18.864   0.914
  123    HA   LYS   8           HA       LYS   8  26.817  18.613  -1.020
  124   1HB   LYS   8          2HB       LYS   8  26.324  20.954  -0.405
  125   2HB   LYS   8          3HB       LYS   8  26.556  20.564   1.287
  126   1HG   LYS   8          2HG       LYS   8  28.872  19.549   0.035
  127   2HG   LYS   8          3HG       LYS   8  28.568  21.058  -0.801
  128   1HD   LYS   8          2HD       LYS   8  28.676  22.341   1.223
  129   2HD   LYS   8          3HD       LYS   8  28.488  20.922   2.235
  130   1HE   LYS   8          2HE       LYS   8  30.804  21.375   2.393
  131   2HE   LYS   8          3HE       LYS   8  30.738  20.103   1.189
  132   1HZ   LYS   8          1HZ       LYS   8  30.422  22.571  -0.070
  133   2HZ   LYS   8          2HZ       LYS   8  31.747  22.643   0.882
  134   3HZ   LYS   8          3HZ       LYS   8  31.623  21.480  -0.258
  135    H    GLN   9           HN       GLN   9  26.746  16.283  -0.339
  136    HA   GLN   9           HA       GLN   9  28.498  16.006   1.930
  137   1HB   GLN   9          2HB       GLN   9  25.736  15.452   2.182
  138   2HB   GLN   9          3HB       GLN   9  26.488  13.881   2.001
  139   1HG   GLN   9          2HG       GLN   9  28.245  14.967   3.766
  140   2HG   GLN   9          3HG       GLN   9  26.831  15.913   4.189
  141   1HE2  GLN   9          1HE2      GLN   9  26.955  14.852   6.233
  142   2HE2  GLN   9          2HE2      GLN   9  26.273  13.277   6.469
  143    H    ASP  10           HN       ASP  10  30.235  15.138   0.850
  144    HA   ASP  10           HA       ASP  10  29.875  12.566  -0.293
  145   1HB   ASP  10          2HB       ASP  10  29.572  14.667  -2.068
  146   2HB   ASP  10          3HB       ASP  10  31.296  14.380  -2.188
  147    H    ARG  11           HN       ARG  11  32.083  11.593  -0.800
  148    HA   ARG  11           HA       ARG  11  34.414  13.007  -0.457
  149   1HB   ARG  11          2HB       ARG  11  33.259  12.829   2.002
  150   2HB   ARG  11          3HB       ARG  11  34.080  11.281   1.989
  151   1HG   ARG  11          2HG       ARG  11  36.239  12.423   1.463
  152   2HG   ARG  11          3HG       ARG  11  35.422  13.974   1.455
  153   1HD   ARG  11          2HD       ARG  11  35.594  14.131   3.715
  154   2HD   ARG  11          3HD       ARG  11  34.764  12.603   3.925
  155    HE   ARG  11           HE       ARG  11  37.675  13.030   3.916
  156   1HH1  ARG  11          2HH2      ARG  11  35.073  10.678   3.642
  157   2HH1  ARG  11          1HH2      ARG  11  36.071   9.332   4.078
  158   1HH2  ARG  11          2HH1      ARG  11  38.993  11.255   4.491
  159   2HH2  ARG  11          1HH1      ARG  11  38.317   9.662   4.565
  160    H    GLN  12           HN       GLN  12  35.260  11.703  -2.105
  161    HA   GLN  12           HA       GLN  12  36.272   9.228  -1.408
  162   1HB   GLN  12          2HB       GLN  12  33.537   9.145  -2.406
  163   2HB   GLN  12          3HB       GLN  12  34.601   8.316  -3.525
  164   1HG   GLN  12          2HG       GLN  12  35.582   7.307  -1.196
  165   2HG   GLN  12          3HG       GLN  12  33.943   7.643  -0.672
  166   1HE2  GLN  12          1HE2      GLN  12  35.997   5.544  -2.325
  167   2HE2  GLN  12          2HE2      GLN  12  34.832   4.466  -3.020
  168    H    GLY  13           HN       GLY  13  37.658   8.358  -3.114
  169   1HA   GLY  13          1HA       GLY  13  37.746   9.088  -5.745
  170   2HA   GLY  13          2HA       GLY  13  38.571  10.394  -4.916
  171    H    GLY  14           HN       GLY  14  39.271   7.763  -6.642
  172   1HA   GLY  14          1HA       GLY  14  41.819   7.365  -5.321
  173   2HA   GLY  14          2HA       GLY  14  40.774   5.959  -5.344
  174    H    GLU  15           HN       GLU  15  41.571   8.624  -7.698
  175    HA   GLU  15           HA       GLU  15  42.860   6.832  -9.431
  176   1HB   GLU  15          2HB       GLU  15  39.977   7.060  -9.713
  177   2HB   GLU  15          3HB       GLU  15  40.754   7.713 -11.142
  178   1HG   GLU  15          2HG       GLU  15  41.710   5.671 -11.739
  179   2HG   GLU  15          3HG       GLU  15  41.837   5.116 -10.082
  180    H    ARG  16           HN       ARG  16  43.216   8.034 -11.695
  181    HA   ARG  16           HA       ARG  16  44.233  10.557 -10.981
  182   1HB   ARG  16          2HB       ARG  16  44.554   8.645 -13.121
  183   2HB   ARG  16          3HB       ARG  16  44.193  10.194 -13.855
  184   1HG   ARG  16          2HG       ARG  16  46.502  10.395 -13.634
  185   2HG   ARG  16          3HG       ARG  16  45.997  11.107 -12.114
  186   1HD   ARG  16          2HD       ARG  16  46.440   9.052 -10.896
  187   2HD   ARG  16          3HD       ARG  16  46.625   8.133 -12.377
  188    HE   ARG  16           HE       ARG  16  48.502  10.386 -12.104
  189   1HH1  ARG  16          2HH2      ARG  16  47.945   6.960 -11.522
  190   2HH1  ARG  16          1HH2      ARG  16  49.631   6.574 -11.413
  191   1HH2  ARG  16          2HH1      ARG  16  50.725   9.877 -11.961
  192   2HH2  ARG  16          1HH1      ARG  16  51.222   8.245 -11.664
  193    H    ARG  17           HN       ARG  17  41.735   9.427 -13.381
  194    HA   ARG  17           HA       ARG  17  39.922  11.363 -12.762
  195   1HB   ARG  17          2HB       ARG  17  42.080  12.445 -14.321
  196   2HB   ARG  17          3HB       ARG  17  40.696  12.340 -15.392
  197   1HG   ARG  17          2HG       ARG  17  39.635  13.331 -12.961
  198   2HG   ARG  17          3HG       ARG  17  41.165  14.165 -13.143
  199   1HD   ARG  17          2HD       ARG  17  40.539  14.963 -15.380
  200   2HD   ARG  17          3HD       ARG  17  39.087  13.982 -15.374
  201    HE   ARG  17           HE       ARG  17  38.036  15.546 -13.959
  202   1HH1  ARG  17          2HH2      ARG  17  41.481  16.237 -14.168
  203   2HH1  ARG  17          1HH2      ARG  17  41.351  17.772 -13.379
  204   1HH2  ARG  17          2HH1      ARG  17  37.864  17.573 -12.916
  205   2HH2  ARG  17          1HH1      ARG  17  39.279  18.538 -12.662
  206    H    ARG  18           HN       ARG  18  38.672   9.394 -13.076
  207    HA   ARG  18           HA       ARG  18  37.652   7.807 -14.172
  208   1HB   ARG  18          2HB       ARG  18  37.194  10.333 -15.732
  209   2HB   ARG  18          3HB       ARG  18  36.664   8.852 -16.503
  210   1HG   ARG  18          2HG       ARG  18  35.147   8.322 -14.734
  211   2HG   ARG  18          3HG       ARG  18  35.929   9.418 -13.611
  212   1HD   ARG  18          2HD       ARG  18  35.109  11.004 -15.857
  213   2HD   ARG  18          3HD       ARG  18  33.755   9.967 -15.458
  214    HE   ARG  18           HE       ARG  18  33.544  11.041 -13.359
  215   1HH1  ARG  18          2HH2      ARG  18  36.481  12.086 -14.992
  216   2HH1  ARG  18          1HH2      ARG  18  36.771  13.400 -13.902
  217   1HH2  ARG  18          2HH1      ARG  18  33.927  12.775 -11.921
  218   2HH2  ARG  18          1HH1      ARG  18  35.309  13.795 -12.144
  219    H    SER  19           HN       SER  19  39.883   6.753 -14.540
  220    HA   SER  19           HA       SER  19  41.434   7.001 -16.680
  221   1HB   SER  19          2HB       SER  19  40.811   4.903 -14.774
  222   2HB   SER  19          3HB       SER  19  41.099   4.180 -16.345
  223    HG   SER  19           HG       SER  19  43.042   5.917 -16.193
  224    H    GLN  20           HN       GLN  20  40.525   7.518 -18.694
  225    HA   GLN  20           HA       GLN  20  39.208   7.357 -20.454
  226   1HB   GLN  20          2HB       GLN  20  40.751   4.813 -20.199
  227   2HB   GLN  20          3HB       GLN  20  39.468   4.797 -21.393
  228   1HG   GLN  20          2HG       GLN  20  40.470   7.097 -22.183
  229   2HG   GLN  20          3HG       GLN  20  41.885   6.633 -21.259
  230   1HE2  GLN  20          1HE2      GLN  20  42.906   6.741 -23.371
  231   2HE2  GLN  20          2HE2      GLN  20  42.891   5.357 -24.412
  232    H    LEU  21           HN       LEU  21  37.457   7.372 -18.420
  233    HA   LEU  21           HA       LEU  21  35.700   5.067 -18.874
  234   1HB   LEU  21          2HB       LEU  21  36.374   5.313 -16.581
  235   2HB   LEU  21          3HB       LEU  21  35.917   7.005 -16.571
  236    HG   LEU  21           HG       LEU  21  34.376   5.152 -15.508
  237   1HD1  LEU  21          1HD1      LEU  21  32.949   6.843 -15.251
  238   2HD1  LEU  21          2HD1      LEU  21  34.033   7.785 -16.303
  239   3HD1  LEU  21          3HD1      LEU  21  32.625   6.945 -16.999
  240   1HD2  LEU  21          1HD2      LEU  21  32.531   4.566 -17.155
  241   2HD2  LEU  21          2HD2      LEU  21  33.677   5.011 -18.443
  242   3HD2  LEU  21          3HD2      LEU  21  34.067   3.682 -17.325
  243    H    ASP  22           HN       ASP  22  34.834   5.794 -20.878
  244    HA   ASP  22           HA       ASP  22  34.022   8.284 -21.477
  245   1HB   ASP  22          2HB       ASP  22  33.588   5.628 -22.461
  246   2HB   ASP  22          3HB       ASP  22  32.010   6.387 -22.392
  247    H    ARG  23           HN       ARG  23  31.913   9.406 -21.329
  248    HA   ARG  23           HA       ARG  23  30.689   9.045 -18.855
  249   1HB   ARG  23          2HB       ARG  23  30.115  10.741 -21.306
  250   2HB   ARG  23          3HB       ARG  23  28.945  10.701 -20.002
  251   1HG   ARG  23          2HG       ARG  23  31.898  11.331 -19.558
  252   2HG   ARG  23          3HG       ARG  23  30.697  12.570 -19.866
  253   1HD   ARG  23          2HD       ARG  23  30.227  10.554 -17.647
  254   2HD   ARG  23          3HD       ARG  23  31.300  11.911 -17.368
  255    HE   ARG  23           HE       ARG  23  28.950  12.983 -18.522
  256   1HH1  ARG  23          2HH2      ARG  23  29.855  11.257 -15.593
  257   2HH1  ARG  23          1HH2      ARG  23  28.595  11.961 -14.635
  258   1HH2  ARG  23          2HH1      ARG  23  27.287  13.913 -17.260
  259   2HH2  ARG  23          1HH1      ARG  23  27.124  13.482 -15.590
  260    H    ASP  24           HN       ASP  24  30.412   7.252 -21.696
  261    HA   ASP  24           HA       ASP  24  27.734   6.413 -20.921
  262   1HB   ASP  24          2HB       ASP  24  27.991   7.759 -23.164
  263   2HB   ASP  24          3HB       ASP  24  28.746   6.304 -23.786
  264    H    GLN  25           HN       GLN  25  30.584   5.493 -20.304
  265    HA   GLN  25           HA       GLN  25  30.385   2.855 -21.535
  266   1HB   GLN  25          2HB       GLN  25  32.393   3.921 -22.352
  267   2HB   GLN  25          3HB       GLN  25  32.840   4.472 -20.750
  268   1HG   GLN  25          2HG       GLN  25  33.226   2.164 -19.998
  269   2HG   GLN  25          3HG       GLN  25  32.606   1.523 -21.507
  270   1HE2  GLN  25          1HE2      GLN  25  35.247   1.369 -20.120
  271   2HE2  GLN  25          2HE2      GLN  25  36.436   1.836 -21.291
  272    H    CYS  26           HN       CYS  26  30.452   1.048 -20.168
  273    HA   CYS  26           HA       CYS  26  29.676   1.420 -17.539
  274   1HB   CYS  26          2HB       CYS  26  29.183  -0.614 -18.821
  275   2HB   CYS  26          3HB       CYS  26  30.882  -1.040 -18.846
  276    H    ALA  27           HN       ALA  27  30.839   1.699 -15.634
  277    HA   ALA  27           HA       ALA  27  33.750   1.787 -15.932
  278   1HB   ALA  27          1HB       ALA  27  32.186   2.855 -13.579
  279   2HB   ALA  27          2HB       ALA  27  33.745   3.405 -14.239
  280   3HB   ALA  27          3HB       ALA  27  32.235   3.762 -15.111
  281    H    TYR  28           HN       TYR  28  32.229  -0.746 -15.736
  282    HA   TYR  28           HA       TYR  28  33.331  -1.654 -13.164
  283   1HB   TYR  28          2HB       TYR  28  30.719  -1.454 -13.533
  284   2HB   TYR  28          3HB       TYR  28  30.903  -2.749 -14.698
  285    HD1  TYR  28           HD1      TYR  28  30.712  -1.889 -11.175
  286    HD2  TYR  28           HD2      TYR  28  31.671  -5.016 -13.933
  287    HE1  TYR  28           HE1      TYR  28  30.516  -3.606  -9.309
  288    HE2  TYR  28           HE2      TYR  28  31.472  -6.721 -12.058
  289    HH   TYR  28           HH       TYR  28  31.607  -6.823  -9.699
  290    H    CYS  29           HN       CYS  29  31.998  -2.941 -16.299
  291    HA   CYS  29           HA       CYS  29  34.060  -4.978 -16.212
  292   1HB   CYS  29          2HB       CYS  29  32.812  -6.032 -18.047
  293   2HB   CYS  29          3HB       CYS  29  31.787  -5.733 -16.657
  294    H    LYS  30           HN       LYS  30  33.155  -1.935 -17.748
  295    HA   LYS  30           HA       LYS  30  34.551  -0.584 -18.906
  296   1HB   LYS  30          2HB       LYS  30  36.247  -2.921 -19.785
  297   2HB   LYS  30          3HB       LYS  30  36.671  -1.222 -19.725
  298   1HG   LYS  30          2HG       LYS  30  35.847  -1.987 -17.075
  299   2HG   LYS  30          3HG       LYS  30  36.950  -3.221 -17.651
  300   1HD   LYS  30          2HD       LYS  30  38.648  -1.819 -17.099
  301   2HD   LYS  30          3HD       LYS  30  38.180  -0.836 -18.473
  302   1HE   LYS  30          2HE       LYS  30  36.549  -0.411 -16.005
  303   2HE   LYS  30          3HE       LYS  30  38.229   0.068 -15.872
  304   1HZ   LYS  30          1HZ       LYS  30  37.283   1.912 -16.761
  305   2HZ   LYS  30          2HZ       LYS  30  37.740   1.168 -18.141
  306   3HZ   LYS  30          3HZ       LYS  30  36.183   1.101 -17.655
  307    H    GLU  31           HN       GLU  31  32.125  -2.186 -19.633
  308    HA   GLU  31           HA       GLU  31  32.567  -2.541 -22.471
  309   1HB   GLU  31          2HB       GLU  31  30.310  -3.299 -20.584
  310   2HB   GLU  31          3HB       GLU  31  30.105  -3.379 -22.323
  311   1HG   GLU  31          2HG       GLU  31  31.116  -5.430 -20.795
  312   2HG   GLU  31          3HG       GLU  31  31.403  -5.253 -22.515
  313    H    LYS  32           HN       LYS  32  32.330  -0.751 -23.736
  314    HA   LYS  32           HA       LYS  32  30.925   1.527 -22.803
  315   1HB   LYS  32          2HB       LYS  32  31.537   2.503 -24.934
  316   2HB   LYS  32          3HB       LYS  32  32.911   1.665 -24.241
  317   1HG   LYS  32          2HG       LYS  32  31.961  -0.390 -25.685
  318   2HG   LYS  32          3HG       LYS  32  31.216   0.893 -26.619
  319   1HD   LYS  32          2HD       LYS  32  33.706   1.940 -26.453
  320   2HD   LYS  32          3HD       LYS  32  34.136   0.253 -26.256
  321   1HE   LYS  32          2HE       LYS  32  33.193  -0.354 -28.386
  322   2HE   LYS  32          3HE       LYS  32  32.305   1.150 -28.516
  323   1HZ   LYS  32          1HZ       LYS  32  35.161   0.697 -28.859
  324   2HZ   LYS  32          2HZ       LYS  32  34.124   1.509 -29.824
  325   3HZ   LYS  32          3HZ       LYS  32  34.634   2.181 -28.427
  326    H    GLY  33           HN       GLY  33  28.789   1.976 -22.904
  327   1HA   GLY  33          1HA       GLY  33  26.982   1.921 -24.741
  328   2HA   GLY  33          2HA       GLY  33  27.115   0.187 -24.533
  329    H    HIS  34           HN       HIS  34  27.310  -0.329 -21.894
  330    HA   HIS  34           HA       HIS  34  24.879   0.906 -20.839
  331   1HB   HIS  34          2HB       HIS  34  24.516  -1.102 -19.594
  332   2HB   HIS  34          3HB       HIS  34  24.822  -1.536 -21.265
  333    HD1  HIS  34           HD1      HIS  34  26.669  -3.201 -21.701
  334    HD2  HIS  34           HD2      HIS  34  26.848  -1.566 -17.842
  335    HE1  HIS  34           HE1      HIS  34  28.479  -4.501 -20.458
  336    H    TRP  35           HN       TRP  35  24.802   1.356 -18.488
  337    HA   TRP  35           HA       TRP  35  27.357   2.432 -17.636
  338   1HB   TRP  35          2HB       TRP  35  24.511   2.951 -17.089
  339   2HB   TRP  35          3HB       TRP  35  25.555   3.073 -15.686
  340    HD1  TRP  35           HD1      TRP  35  25.864   4.402 -19.366
  341    HE1  TRP  35           HE1      TRP  35  26.681   6.911 -19.366
  342    HE3  TRP  35           HE3      TRP  35  26.198   4.841 -14.312
  343    HZ2  TRP  35           HZ2      TRP  35  27.362   8.756 -17.298
  344    HZ3  TRP  35           HZ3      TRP  35  26.947   7.030 -13.384
  345    HH2  TRP  35           HH2      TRP  35  27.518   8.947 -14.788
  346    H    ALA  36           HN       ALA  36  28.052   2.045 -15.319
  347    HA   ALA  36           HA       ALA  36  28.272  -0.690 -14.823
  348   1HB   ALA  36          1HB       ALA  36  29.930   0.925 -14.075
  349   2HB   ALA  36          2HB       ALA  36  28.726   1.745 -13.053
  350   3HB   ALA  36          3HB       ALA  36  29.255   0.093 -12.653
  351    H    LYS  37           HN       LYS  37  25.924   1.783 -13.780
  352    HA   LYS  37           HA       LYS  37  24.822   0.239 -11.684
  353   1HB   LYS  37          2HB       LYS  37  24.141   2.750 -13.140
  354   2HB   LYS  37          3HB       LYS  37  22.838   1.943 -12.292
  355   1HG   LYS  37          2HG       LYS  37  23.593   2.906 -10.381
  356   2HG   LYS  37          3HG       LYS  37  24.981   1.840 -10.467
  357   1HD   LYS  37          2HD       LYS  37  26.053   3.913 -10.414
  358   2HD   LYS  37          3HD       LYS  37  25.938   3.665 -12.145
  359   1HE   LYS  37          2HE       LYS  37  25.123   5.869 -11.879
  360   2HE   LYS  37          3HE       LYS  37  23.651   4.925 -11.986
  361   1HZ   LYS  37          1HZ       LYS  37  23.480   4.948  -9.626
  362   2HZ   LYS  37          2HZ       LYS  37  24.925   5.686  -9.451
  363   3HZ   LYS  37          3HZ       LYS  37  23.676   6.488 -10.131
  364    H    ASP  38           HN       ASP  38  24.891  -0.235 -15.036
  365    HA   ASP  38           HA       ASP  38  22.500  -1.884 -14.805
  366   1HB   ASP  38          2HB       ASP  38  22.636   0.332 -16.409
  367   2HB   ASP  38          3HB       ASP  38  23.296  -0.862 -17.509
  368    H    CYS  39           HN       CYS  39  25.582  -2.219 -14.536
  369    HA   CYS  39           HA       CYS  39  26.558  -3.510 -16.797
  370   1HB   CYS  39          2HB       CYS  39  27.944  -2.640 -14.911
  371   2HB   CYS  39          3HB       CYS  39  27.373  -3.957 -13.907
  372    HA   PRO  40           HA       PRO  40  24.199  -7.191 -16.393
  373   1HB   PRO  40          2HB       PRO  40  25.173  -8.506 -18.581
  374   2HB   PRO  40          3HB       PRO  40  23.874  -7.333 -18.667
  375   1HG   PRO  40          2HG       PRO  40  26.702  -7.029 -19.472
  376   2HG   PRO  40          3HG       PRO  40  25.319  -6.053 -19.929
  377   1HD   PRO  40          2HD       PRO  40  27.342  -5.372 -18.013
  378   2HD   PRO  40          3HD       PRO  40  25.899  -4.451 -18.385
  379    H    LYS  41           HN       LYS  41  27.328  -6.743 -15.669
  380    HA   LYS  41           HA       LYS  41  27.671  -9.593 -15.050
  381   1HB   LYS  41          2HB       LYS  41  29.330  -8.465 -16.606
  382   2HB   LYS  41          3HB       LYS  41  29.845  -7.495 -15.241
  383   1HG   LYS  41          2HG       LYS  41  29.829 -10.105 -14.203
  384   2HG   LYS  41          3HG       LYS  41  30.406 -10.331 -15.841
  385   1HD   LYS  41          2HD       LYS  41  32.398  -9.279 -15.422
  386   2HD   LYS  41          3HD       LYS  41  31.637  -7.994 -14.502
  387   1HE   LYS  41          2HE       LYS  41  31.865 -10.787 -13.328
  388   2HE   LYS  41          3HE       LYS  41  33.227  -9.688 -13.260
  389   1HZ   LYS  41          1HZ       LYS  41  31.203  -9.741 -11.513
  390   2HZ   LYS  41          2HZ       LYS  41  32.222  -8.480 -11.716
  391   3HZ   LYS  41          3HZ       LYS  41  30.771  -8.486 -12.465
  392    H    LYS  42           HN       LYS  42  26.196  -7.186 -13.660
  393    HA   LYS  42           HA       LYS  42  27.668  -7.333 -11.129
  394   1HB   LYS  42          2HB       LYS  42  26.576  -5.156 -12.522
  395   2HB   LYS  42          3HB       LYS  42  25.468  -5.436 -11.195
  396   1HG   LYS  42          2HG       LYS  42  27.919  -5.729  -9.930
  397   2HG   LYS  42          3HG       LYS  42  28.295  -4.514 -11.134
  398   1HD   LYS  42          2HD       LYS  42  25.924  -4.336  -9.217
  399   2HD   LYS  42          3HD       LYS  42  27.472  -3.568  -8.931
  400   1HE   LYS  42          2HE       LYS  42  27.098  -2.518 -11.341
  401   2HE   LYS  42          3HE       LYS  42  25.418  -2.936 -11.069
  402   1HZ   LYS  42          1HZ       LYS  42  26.753  -0.760 -10.089
  403   2HZ   LYS  42          2HZ       LYS  42  25.234  -1.226  -9.716
  404   3HZ   LYS  42          3HZ       LYS  42  26.487  -1.708  -8.787
  405    HA   PRO  43           HA       PRO  43  24.402 -10.118 -10.149
  406   1HB   PRO  43          2HB       PRO  43  25.654 -11.330  -8.044
  407   2HB   PRO  43          3HB       PRO  43  25.827 -11.870  -9.701
  408   1HG   PRO  43          2HG       PRO  43  27.752 -10.373  -8.030
  409   2HG   PRO  43          3HG       PRO  43  28.048 -11.279  -9.501
  410   1HD   PRO  43          2HD       PRO  43  27.884  -8.427  -9.245
  411   2HD   PRO  43          3HD       PRO  43  28.064  -9.338 -10.731
  412    H    ARG  44           HN       ARG  44  23.456 -10.851  -7.807
  413    HA   ARG  44           HA       ARG  44  22.277 -10.163  -6.134
  414   1HB   ARG  44          2HB       ARG  44  24.782  -9.241  -5.557
  415   2HB   ARG  44          3HB       ARG  44  23.928  -7.712  -5.575
  416   1HG   ARG  44          2HG       ARG  44  23.529  -8.264  -3.370
  417   2HG   ARG  44          3HG       ARG  44  22.165  -9.108  -4.075
  418   1HD   ARG  44          2HD       ARG  44  23.222 -11.231  -3.920
  419   2HD   ARG  44          3HD       ARG  44  24.829 -10.537  -3.828
  420    HE   ARG  44           HE       ARG  44  22.930 -10.863  -1.607
  421   1HH1  ARG  44          2HH2      ARG  44  25.828  -9.218  -2.739
  422   2HH1  ARG  44          1HH2      ARG  44  26.401  -8.859  -1.145
  423   1HH2  ARG  44          2HH1      ARG  44  23.686 -10.388   0.497
  424   2HH2  ARG  44          1HH1      ARG  44  25.175  -9.528   0.708
  425    H    GLY  45           HN       GLY  45  20.635  -8.537  -5.444
  426   1HA   GLY  45          1HA       GLY  45  20.304  -5.988  -6.325
  427   2HA   GLY  45          2HA       GLY  45  19.726  -6.955  -7.668
  428    HA   PRO  46           HA       PRO  46  18.400  -5.356  -7.727
  429   1HB   PRO  46          2HB       PRO  46  16.584  -3.388  -7.184
  430   2HB   PRO  46          3HB       PRO  46  16.234  -4.754  -8.225
  431   1HG   PRO  46          2HG       PRO  46  15.335  -4.257  -5.453
  432   2HG   PRO  46          3HG       PRO  46  14.676  -5.366  -6.638
  433   1HD   PRO  46          2HD       PRO  46  16.337  -6.037  -4.398
  434   2HD   PRO  46          3HD       PRO  46  15.774  -7.127  -5.647
  435    H    ARG  47           HN       ARG  47  18.895  -2.868  -7.857
  436    HA   ARG  47           HA       ARG  47  21.046  -2.500  -6.269
  437   1HB   ARG  47          2HB       ARG  47  19.201  -0.512  -7.657
  438   2HB   ARG  47          3HB       ARG  47  20.632   0.033  -6.804
  439   1HG   ARG  47          2HG       ARG  47  21.826  -0.410  -8.680
  440   2HG   ARG  47          3HG       ARG  47  21.564  -2.115  -8.372
  441   1HD   ARG  47          2HD       ARG  47  20.445  -2.176 -10.355
  442   2HD   ARG  47          3HD       ARG  47  19.145  -1.327  -9.543
  443    HE   ARG  47           HE       ARG  47  21.293   0.417 -10.557
  444   1HH1  ARG  47          2HH2      ARG  47  18.183  -1.087 -11.229
  445   2HH1  ARG  47          1HH2      ARG  47  17.757   0.048 -12.466
  446   1HH2  ARG  47          2HH1      ARG  47  20.731   1.915 -12.189
  447   2HH2  ARG  47          1HH1      ARG  47  19.217   1.768 -13.015
  448    H    GLY  48           HN       GLY  48  21.476  -1.198  -4.347
  449   1HA   GLY  48          1HA       GLY  48  19.768   0.340  -2.900
  450   2HA   GLY  48          2HA       GLY  48  19.339  -1.290  -2.419
  451    HA   PRO  49           HA       PRO  49  23.777  -0.247  -1.019
  452   1HB   PRO  49          2HB       PRO  49  24.274   2.393  -0.515
  453   2HB   PRO  49          3HB       PRO  49  24.759   1.593  -1.996
  454   1HG   PRO  49          2HG       PRO  49  22.533   3.487  -1.557
  455   2HG   PRO  49          3HG       PRO  49  23.291   3.016  -3.064
  456   1HD   PRO  49          2HD       PRO  49  20.757   2.120  -2.064
  457   2HD   PRO  49          3HD       PRO  49  21.568   1.562  -3.513
  458    H    ARG  50           HN       ARG  50  24.039  -0.985   0.986
  459    HA   ARG  50           HA       ARG  50  22.033  -0.152   2.831
  460   1HB   ARG  50          2HB       ARG  50  24.377  -2.103   3.051
  461   2HB   ARG  50          3HB       ARG  50  23.254  -1.815   4.364
  462   1HG   ARG  50          2HG       ARG  50  21.593  -3.052   3.387
  463   2HG   ARG  50          3HG       ARG  50  21.889  -2.372   1.798
  464   1HD   ARG  50          2HD       ARG  50  23.923  -4.299   2.939
  465   2HD   ARG  50          3HD       ARG  50  22.419  -4.946   2.313
  466    HE   ARG  50           HE       ARG  50  24.567  -3.675   0.752
  467   1HH1  ARG  50          2HH2      ARG  50  21.203  -4.705   0.788
  468   2HH1  ARG  50          1HH2      ARG  50  21.073  -4.774  -0.939
  469   1HH2  ARG  50          2HH1      ARG  50  24.397  -3.767  -1.525
  470   2HH2  ARG  50          1HH1      ARG  50  22.902  -4.237  -2.263
  471    HA   PRO  51           HA       PRO  51  24.624   2.844   4.699
  472   1HB   PRO  51          2HB       PRO  51  23.075   3.464   6.864
  473   2HB   PRO  51          3HB       PRO  51  22.818   4.152   5.274
  474   1HG   PRO  51          2HG       PRO  51  21.259   2.058   6.659
  475   2HG   PRO  51          3HG       PRO  51  20.794   3.047   5.290
  476   1HD   PRO  51          2HD       PRO  51  21.612   0.299   5.222
  477   2HD   PRO  51          3HD       PRO  51  21.259   1.321   3.843
  478    H    GLN  52           HN       GLN  52  26.167   0.973   4.950
  479    HA   GLN  52           HA       GLN  52  26.521   0.706   7.822
  480   1HB   GLN  52          2HB       GLN  52  25.500  -1.395   6.892
  481   2HB   GLN  52          3HB       GLN  52  26.875  -1.568   5.820
  482   1HG   GLN  52          2HG       GLN  52  27.880  -1.142   8.497
  483   2HG   GLN  52          3HG       GLN  52  26.649  -2.386   8.574
  484   1HE2  GLN  52          1HE2      GLN  52  27.181  -4.378   8.083
  485   2HE2  GLN  52          2HE2      GLN  52  28.594  -4.901   7.226
  486    H    THR  53           HN       THR  53  28.435   1.682   8.311
  487    HA   THR  53           HA       THR  53  30.304   2.526   6.495
  488    HB   THR  53           HB       THR  53  30.443   1.801   9.459
  489    HG1  THR  53           HG1      THR  53  30.517   4.289   9.306
  490   1HG2  THR  53          1HG2      THR  53  32.700   2.178   7.808
  491   2HG2  THR  53          2HG2      THR  53  32.366   3.800   8.461
  492   3HG2  THR  53          3HG2      THR  53  32.643   2.435   9.569
  493    H    SER  54           HN       SER  54  31.808   1.631   5.230
  494    HA   SER  54           HA       SER  54  32.145  -1.198   5.438
  495   1HB   SER  54          2HB       SER  54  32.096   0.558   3.325
  496   2HB   SER  54          3HB       SER  54  33.824   0.353   3.523
  497    HG   SER  54           HG       SER  54  32.071  -1.336   2.347
  498    H    LEU  55           HN       LEU  55  34.165  -2.293   5.838
  499    HA   LEU  55           HA       LEU  55  35.784  -1.070   7.762
  500   1HB   LEU  55          2HB       LEU  55  35.877  -3.612   6.183
  501   2HB   LEU  55          3HB       LEU  55  37.269  -3.137   7.136
  502    HG   LEU  55           HG       LEU  55  34.545  -3.229   8.409
  503   1HD1  LEU  55          1HD1      LEU  55  34.355  -5.392   7.869
  504   2HD1  LEU  55          2HD1      LEU  55  36.056  -5.517   7.357
  505   3HD1  LEU  55          3HD1      LEU  55  35.633  -5.653   9.081
  506   1HD2  LEU  55          1HD2      LEU  55  36.573  -4.190  10.111
  507   2HD2  LEU  55          2HD2      LEU  55  37.252  -2.772   9.277
  508   3HD2  LEU  55          3HD2      LEU  55  35.728  -2.624  10.185
  509    H    LEU  56           HN       LEU  56  38.297  -1.010   7.500
  510    HA   LEU  56           HA       LEU  56  38.836   0.946   5.550
  511   1HB   LEU  56          2HB       LEU  56  40.909   1.127   6.535
  512   2HB   LEU  56          3HB       LEU  56  39.873   0.610   7.851
  513    HG   LEU  56           HG       LEU  56  40.759  -1.804   7.023
  514   1HD1  LEU  56          1HD1      LEU  56  42.259  -0.235   5.400
  515   2HD1  LEU  56          2HD1      LEU  56  43.343  -0.387   6.804
  516   3HD1  LEU  56          3HD1      LEU  56  42.749  -1.846   5.975
  517   1HD2  LEU  56          1HD2      LEU  56  41.706  -1.895   9.058
  518   2HD2  LEU  56          2HD2      LEU  56  42.688  -0.436   8.789
  519   3HD2  LEU  56          3HD2      LEU  56  40.979  -0.284   9.265
  Start of MODEL   14
    1   1H5*    C 504          1H5*        C 504  33.900  -8.462  -2.350
    2   2H5*    C 504          2H5*        C 504  34.581  -7.184  -3.356
    3    H4*    C 504           H4*        C 504  35.983  -9.254  -3.118
    4    H3*    C 504           H3*        C 504  35.167  -8.465  -5.939
    5    H2*    C 504           H2*        C 504  37.161  -9.683  -6.562
    6   2HO*    C 504          2HO*        C 504  38.618  -9.578  -4.956
    7    H1*    C 504           H1*        C 504  36.173 -11.748  -4.749
    8   1H4     C 504          1H4         C 504  35.697 -14.358 -10.553
    9   2H4     C 504          2H4         C 504  34.318 -13.337 -10.892
   10    H5     C 504           H5         C 504  33.543 -11.648  -9.435
   11    H6     C 504           H6         C 504  33.905 -10.511  -7.273
   12   1H5*    C 505          1H5*        C 505  38.485  -7.685  -6.267
   13   2H5*    C 505          2H5*        C 505  39.199  -6.186  -6.859
   14    H4*    C 505           H4*        C 505  39.782  -7.643  -8.525
   15    H3*    C 505           H3*        C 505  37.225  -6.292  -9.304
   16    H2*    C 505           H2*        C 505  37.139  -7.528 -11.337
   17   2HO*    C 505          2HO*        C 505  39.031  -8.532 -12.010
   18    H1*    C 505           H1*        C 505  37.612  -9.977 -10.028
   19   1H4     C 505          1H4         C 505  31.266  -9.586 -10.773
   20   2H4     C 505          2H4         C 505  31.172  -8.764  -9.232
   21    H5     C 505           H5         C 505  33.060  -8.090  -7.983
   22    H6     C 505           H6         C 505  35.528  -8.039  -7.905
   23   1H5*    U 506          1H5*        U 506  39.859  -1.430 -10.064
   24   2H5*    U 506          2H5*        U 506  38.730  -2.192  -8.945
   25    H4*    U 506           H4*        U 506  38.026  -1.048 -11.291
   26    H3*    U 506           H3*        U 506  36.680  -3.282  -9.763
   27    H2*    U 506           H2*        U 506  35.036  -3.369 -11.400
   28   2HO*    U 506          2HO*        U 506  36.039  -0.754 -12.079
   29    H1*    U 506           H1*        U 506  36.995  -2.397 -13.405
   30    H3     U 506           H3         U 506  36.638  -5.949 -16.114
   31    H5     U 506           H5         U 506  35.075  -7.391 -12.507
   32    H6     U 506           H6         U 506  35.680  -5.240 -11.498
   33   1H5*    C 507          1H5*        C 507  34.893   0.965 -10.719
   34   2H5*    C 507          2H5*        C 507  34.524   1.322  -9.031
   35    H4*    C 507           H4*        C 507  33.184   2.351 -11.138
   36    H3*    C 507           H3*        C 507  32.375   1.912  -8.287
   37    H2*    C 507           H2*        C 507  30.170   2.663  -8.751
   38   2HO*    C 507          2HO*        C 507  29.822   3.646 -10.840
   39    H1*    C 507           H1*        C 507  29.880   1.046 -11.008
   40   1H4     C 507          1H4         C 507  27.460  -2.257  -6.071
   41   2H4     C 507          2H4         C 507  29.004  -3.067  -5.928
   42    H5     C 507           H5         C 507  30.921  -2.473  -7.175
   43    H6     C 507           H6         C 507  31.837  -0.941  -8.881
   44   1H5*    C 508          1H5*        C 508  33.987   6.080  -5.977
   45   2H5*    C 508          2H5*        C 508  33.157   7.459  -6.700
   46    H4*    C 508           H4*        C 508  35.666   7.658  -6.375
   47    H3*    C 508           H3*        C 508  34.332   8.197  -9.028
   48    H2*    C 508           H2*        C 508  36.395   8.942  -9.882
   49   2HO*    C 508          2HO*        C 508  37.501  10.053  -8.384
   50    H1*    C 508           H1*        C 508  37.814   6.860  -8.449
   51   1H4     C 508          1H4         C 508  38.274   4.599 -14.367
   52   2H4     C 508          2H4         C 508  36.609   5.018 -14.703
   53    H5     C 508           H5         C 508  35.171   6.050 -13.140
   54    H6     C 508           H6         C 508  34.973   6.942 -10.846
   55   1H5*    G 509          1H5*        G 509  31.912   8.643  -9.418
   56   2H5*    G 509          2H5*        G 509  33.141   8.522 -10.677
   57    H4*    G 509           H4*        G 509  31.623  10.908 -11.117
   58    H3*    G 509           H3*        G 509  29.958   8.553 -10.339
   59    H2*    G 509           H2*        G 509  28.481   8.892 -12.167
   60   2HO*    G 509          2HO*        G 509  30.129  11.218 -12.587
   61    H1*    G 509           H1*        G 509  30.553   9.135 -14.036
   62    H8     G 509           H8         G 509  29.968   6.717 -11.105
   63    H1     G 509           H1         G 509  30.013   4.032 -16.993
   64   1H2     G 509          1H2         G 509  30.388   5.482 -18.409
   65   2H2     G 509          2H2         G 509  30.653   7.174 -18.054
   66   1H5*    U 510          1H5*        U 510  29.028   9.543  -6.981
   67   2H5*    U 510          2H5*        U 510  28.962   7.787  -7.129
   68    H4*    U 510           H4*        U 510  27.336   8.631  -5.513
   69    H3*    U 510           H3*        U 510  26.299   7.249  -7.977
   70    H2*    U 510           H2*        U 510  24.093   7.386  -7.118
   71   2HO*    U 510          2HO*        U 510  23.988   7.360  -4.944
   72    H1*    U 510           H1*        U 510  24.453  10.101  -6.333
   73    H3     U 510           H3         U 510  21.623  11.284  -9.568
   74    H5     U 510           H5         U 510  24.209   8.679 -11.582
   75    H6     U 510           H6         U 510  25.384   8.358  -9.454
   76   1H    ALA   1           HN       ALA   1  12.083  27.355 -19.917
   77    HA   ALA   1           HA       ALA   1  12.640  27.953 -22.121
   78   1HB   ALA   1          1HB       ALA   1  12.422  25.653 -22.200
   79   2HB   ALA   1          2HB       ALA   1  10.703  25.691 -21.740
   80   3HB   ALA   1          3HB       ALA   1  11.190  26.116 -23.398
   81    H    THR   2           HN       THR   2  11.376  30.201 -21.686
   82    HA   THR   2           HA       THR   2   9.361  30.341 -23.827
   83    HB   THR   2           HB       THR   2   8.259  32.116 -22.373
   84    HG1  THR   2           HG1      THR   2  10.435  32.275 -21.166
   85   1HG2  THR   2          1HG2      THR   2   6.995  30.268 -21.825
   86   2HG2  THR   2          2HG2      THR   2   8.431  29.221 -21.707
   87   3HG2  THR   2          3HG2      THR   2   7.963  30.248 -20.331
   88    H    VAL   3           HN       VAL   3  11.512  30.665 -25.016
   89    HA   VAL   3           HA       VAL   3  12.822  32.042 -26.141
   90    HB   VAL   3           HB       VAL   3  10.889  34.107 -25.079
   91   1HG1  VAL   3          1HG1      VAL   3  12.784  34.505 -27.405
   92   2HG1  VAL   3          2HG1      VAL   3  11.779  35.714 -26.570
   93   3HG1  VAL   3          3HG1      VAL   3  13.189  35.005 -25.745
   94   1HG2  VAL   3          1HG2      VAL   3  10.096  34.011 -27.502
   95   2HG2  VAL   3          2HG2      VAL   3  11.077  32.533 -27.659
   96   3HG2  VAL   3          3HG2      VAL   3   9.736  32.592 -26.490
   97    H    VAL   4           HN       VAL   4  14.757  33.286 -25.875
   98    HA   VAL   4           HA       VAL   4  16.507  34.054 -24.768
   99    HB   VAL   4           HB       VAL   4  14.371  34.956 -22.832
  100   1HG1  VAL   4          1HG1      VAL   4  16.871  36.455 -22.743
  101   2HG1  VAL   4          2HG1      VAL   4  15.904  35.766 -21.417
  102   3HG1  VAL   4          3HG1      VAL   4  17.095  34.754 -22.269
  103   1HG2  VAL   4          1HG2      VAL   4  13.966  36.525 -24.363
  104   2HG2  VAL   4          2HG2      VAL   4  15.630  37.122 -24.153
  105   3HG2  VAL   4          3HG2      VAL   4  15.273  35.903 -25.399
  106    H    SER   5           HN       SER   5  17.795  32.346 -24.247
  107    HA   SER   5           HA       SER   5  17.793  31.461 -21.596
  108   1HB   SER   5          2HB       SER   5  16.305  29.827 -23.580
  109   2HB   SER   5          3HB       SER   5  17.499  28.925 -22.668
  110    HG   SER   5           HG       SER   5  15.047  29.886 -21.854
  111    H    GLY   6           HN       GLY   6  20.005  32.115 -21.803
  112   1HA   GLY   6          1HA       GLY   6  21.647  30.258 -23.412
  113   2HA   GLY   6          2HA       GLY   6  21.929  31.987 -23.436
  114    H    GLN   7           HN       GLN   7  22.024  29.030 -21.434
  115    HA   GLN   7           HA       GLN   7  23.919  30.424 -19.731
  116   1HB   GLN   7          2HB       GLN   7  21.438  28.930 -18.878
  117   2HB   GLN   7          3HB       GLN   7  22.849  28.879 -17.840
  118   1HG   GLN   7          2HG       GLN   7  22.421  30.970 -17.075
  119   2HG   GLN   7          3HG       GLN   7  22.461  31.614 -18.704
  120   1HE2  GLN   7          1HE2      GLN   7  20.815  33.028 -17.701
  121   2HE2  GLN   7          2HE2      GLN   7  19.151  32.554 -17.769
  122    H    LYS   8           HN       LYS   8  25.746  29.207 -19.209
  123    HA   LYS   8           HA       LYS   8  25.647  26.343 -19.670
  124   1HB   LYS   8          2HB       LYS   8  27.514  26.325 -21.197
  125   2HB   LYS   8          3HB       LYS   8  26.227  27.306 -21.868
  126   1HG   LYS   8          2HG       LYS   8  27.476  29.222 -21.790
  127   2HG   LYS   8          3HG       LYS   8  28.090  28.873 -20.186
  128   1HD   LYS   8          2HD       LYS   8  29.262  26.933 -21.938
  129   2HD   LYS   8          3HD       LYS   8  29.389  28.478 -22.758
  130   1HE   LYS   8          2HE       LYS   8  30.117  28.338 -19.825
  131   2HE   LYS   8          3HE       LYS   8  31.249  27.697 -20.999
  132   1HZ   LYS   8          1HZ       LYS   8  31.385  30.140 -20.386
  133   2HZ   LYS   8          2HZ       LYS   8  31.492  29.753 -21.969
  134   3HZ   LYS   8          3HZ       LYS   8  30.098  30.354 -21.368
  135    H    GLN   9           HN       GLN   9  27.119  25.201 -18.383
  136    HA   GLN   9           HA       GLN   9  28.994  26.809 -16.878
  137   1HB   GLN   9          2HB       GLN   9  26.608  26.281 -15.710
  138   2HB   GLN   9          3HB       GLN   9  27.429  24.787 -15.305
  139   1HG   GLN   9          2HG       GLN   9  29.279  26.940 -14.817
  140   2HG   GLN   9          3HG       GLN   9  27.747  27.396 -14.099
  141   1HE2  GLN   9          1HE2      GLN   9  27.268  26.650 -12.175
  142   2HE2  GLN   9          2HE2      GLN   9  28.004  25.310 -11.361
  143    H    ASP  10           HN       ASP  10  30.844  25.844 -17.682
  144    HA   ASP  10           HA       ASP  10  31.483  23.306 -16.759
  145   1HB   ASP  10          2HB       ASP  10  31.595  22.023 -18.812
  146   2HB   ASP  10          3HB       ASP  10  29.963  22.646 -18.666
  147    H    ARG  11           HN       ARG  11  33.667  23.699 -16.368
  148    HA   ARG  11           HA       ARG  11  35.141  24.994 -18.504
  149   1HB   ARG  11          2HB       ARG  11  36.383  26.366 -16.838
  150   2HB   ARG  11          3HB       ARG  11  34.669  26.727 -16.788
  151   1HG   ARG  11          2HG       ARG  11  34.484  26.018 -14.633
  152   2HG   ARG  11          3HG       ARG  11  35.309  24.512 -14.979
  153   1HD   ARG  11          2HD       ARG  11  37.517  25.674 -14.821
  154   2HD   ARG  11          3HD       ARG  11  36.703  27.193 -14.505
  155    HE   ARG  11           HE       ARG  11  37.187  25.085 -12.588
  156   1HH1  ARG  11          2HH2      ARG  11  34.835  27.553 -13.459
  157   2HH1  ARG  11          1HH2      ARG  11  34.207  27.702 -11.851
  158   1HH2  ARG  11          2HH1      ARG  11  36.359  25.282 -10.468
  159   2HH2  ARG  11          1HH1      ARG  11  35.079  26.402 -10.139
  160    H    GLN  12           HN       GLN  12  37.584  24.622 -18.256
  161    HA   GLN  12           HA       GLN  12  38.244  22.440 -16.499
  162   1HB   GLN  12          2HB       GLN  12  39.152  21.027 -18.297
  163   2HB   GLN  12          3HB       GLN  12  37.440  21.302 -18.548
  164   1HG   GLN  12          2HG       GLN  12  38.057  21.904 -20.666
  165   2HG   GLN  12          3HG       GLN  12  38.492  23.436 -19.935
  166   1HE2  GLN  12          1HE2      GLN  12  39.532  21.243 -22.015
  167   2HE2  GLN  12          2HE2      GLN  12  41.251  21.319 -21.821
  168    H    GLY  13           HN       GLY  13  40.485  22.371 -15.977
  169   1HA   GLY  13          1HA       GLY  13  42.551  23.555 -17.378
  170   2HA   GLY  13          2HA       GLY  13  41.891  24.814 -16.354
  171    H    GLY  14           HN       GLY  14  43.107  21.405 -16.292
  172   1HA   GLY  14          1HA       GLY  14  44.876  21.789 -14.189
  173   2HA   GLY  14          2HA       GLY  14  43.366  21.264 -13.472
  174    H    GLU  15           HN       GLU  15  43.766  19.140 -12.904
  175    HA   GLU  15           HA       GLU  15  44.273  17.369 -15.134
  176   1HB   GLU  15          2HB       GLU  15  45.943  16.074 -13.819
  177   2HB   GLU  15          3HB       GLU  15  46.491  17.705 -14.153
  178   1HG   GLU  15          2HG       GLU  15  46.779  18.036 -11.931
  179   2HG   GLU  15          3HG       GLU  15  45.048  17.880 -11.705
  180    H    ARG  16           HN       ARG  16  42.587  15.952 -15.158
  181    HA   ARG  16           HA       ARG  16  41.961  14.478 -12.871
  182   1HB   ARG  16          2HB       ARG  16  40.613  16.964 -13.010
  183   2HB   ARG  16          3HB       ARG  16  39.435  15.809 -13.603
  184   1HG   ARG  16          2HG       ARG  16  41.002  15.220 -11.071
  185   2HG   ARG  16          3HG       ARG  16  39.599  16.268 -11.011
  186   1HD   ARG  16          2HD       ARG  16  38.470  14.284 -10.699
  187   2HD   ARG  16          3HD       ARG  16  38.530  14.212 -12.448
  188    HE   ARG  16           HE       ARG  16  40.910  13.036 -11.777
  189   1HH1  ARG  16          2HH2      ARG  16  37.628  12.515 -10.621
  190   2HH1  ARG  16          1HH2      ARG  16  37.886  10.841 -10.254
  191   1HH2  ARG  16          2HH1      ARG  16  41.251  10.829 -11.293
  192   2HH2  ARG  16          1HH1      ARG  16  39.962   9.876 -10.639
  193    H    ARG  17           HN       ARG  17  42.169  12.668 -14.256
  194    HA   ARG  17           HA       ARG  17  40.189  12.585 -16.392
  195   1HB   ARG  17          2HB       ARG  17  43.078  11.854 -16.326
  196   2HB   ARG  17          3HB       ARG  17  42.059  10.639 -17.072
  197   1HG   ARG  17          2HG       ARG  17  41.451  13.433 -17.912
  198   2HG   ARG  17          3HG       ARG  17  43.048  12.875 -18.366
  199   1HD   ARG  17          2HD       ARG  17  41.574  10.671 -19.068
  200   2HD   ARG  17          3HD       ARG  17  40.367  11.919 -19.300
  201    HE   ARG  17           HE       ARG  17  42.829  11.550 -20.863
  202   1HH1  ARG  17          2HH2      ARG  17  40.256  13.781 -19.979
  203   2HH1  ARG  17          1HH2      ARG  17  40.467  14.779 -21.378
  204   1HH2  ARG  17          2HH1      ARG  17  43.108  12.866 -22.709
  205   2HH2  ARG  17          1HH1      ARG  17  42.101  14.256 -22.942
  206    H    ARG  18           HN       ARG  18  38.587  11.085 -16.014
  207    HA   ARG  18           HA       ARG  18  38.931   9.268 -13.866
  208   1HB   ARG  18          2HB       ARG  18  36.706  10.135 -15.681
  209   2HB   ARG  18          3HB       ARG  18  36.552   8.518 -15.023
  210   1HG   ARG  18          2HG       ARG  18  37.128   9.648 -12.713
  211   2HG   ARG  18          3HG       ARG  18  36.726  11.151 -13.520
  212   1HD   ARG  18          2HD       ARG  18  34.827   8.770 -13.585
  213   2HD   ARG  18          3HD       ARG  18  34.815   9.906 -12.251
  214    HE   ARG  18           HE       ARG  18  33.798  10.382 -14.934
  215   1HH1  ARG  18          2HH2      ARG  18  35.207  11.966 -12.125
  216   2HH1  ARG  18          1HH2      ARG  18  34.510  13.509 -12.485
  217   1HH2  ARG  18          2HH1      ARG  18  32.876  12.418 -15.410
  218   2HH2  ARG  18          1HH1      ARG  18  33.174  13.768 -14.365
  219    H    SER  19           HN       SER  19  40.921   8.471 -15.444
  220    HA   SER  19           HA       SER  19  41.754   6.967 -16.797
  221   1HB   SER  19          2HB       SER  19  39.847   5.563 -14.999
  222   2HB   SER  19          3HB       SER  19  40.343   4.626 -16.394
  223    HG   SER  19           HG       SER  19  42.454   4.637 -15.729
  224    H    GLN  20           HN       GLN  20  40.373   8.507 -18.448
  225    HA   GLN  20           HA       GLN  20  38.995   8.689 -20.158
  226   1HB   GLN  20          2HB       GLN  20  40.602   6.180 -20.660
  227   2HB   GLN  20          3HB       GLN  20  39.417   6.682 -21.850
  228   1HG   GLN  20          2HG       GLN  20  41.141   7.956 -22.667
  229   2HG   GLN  20          3HG       GLN  20  40.657   9.080 -21.414
  230   1HE2  GLN  20          1HE2      GLN  20  42.695   6.231 -21.993
  231   2HE2  GLN  20          2HE2      GLN  20  44.001   6.671 -20.943
  232    H    LEU  21           HN       LEU  21  37.445   7.856 -18.030
  233    HA   LEU  21           HA       LEU  21  35.946   5.528 -18.852
  234   1HB   LEU  21          2HB       LEU  21  36.479   5.872 -16.508
  235   2HB   LEU  21          3HB       LEU  21  35.662   7.422 -16.517
  236    HG   LEU  21           HG       LEU  21  34.557   5.082 -15.683
  237   1HD1  LEU  21          1HD1      LEU  21  32.574   6.271 -15.422
  238   2HD1  LEU  21          2HD1      LEU  21  33.812   7.548 -15.493
  239   3HD1  LEU  21          3HD1      LEU  21  32.811   7.198 -16.923
  240   1HD2  LEU  21          1HD2      LEU  21  33.371   5.482 -18.434
  241   2HD2  LEU  21          2HD2      LEU  21  34.614   4.261 -18.075
  242   3HD2  LEU  21          3HD2      LEU  21  33.033   4.189 -17.259
  243    H    ASP  22           HN       ASP  22  35.104   6.177 -20.897
  244    HA   ASP  22           HA       ASP  22  34.005   8.464 -21.615
  245   1HB   ASP  22          2HB       ASP  22  33.891   5.799 -22.498
  246   2HB   ASP  22          3HB       ASP  22  32.202   6.220 -22.289
  247    H    ARG  23           HN       ARG  23  31.891   9.502 -21.433
  248    HA   ARG  23           HA       ARG  23  30.676   9.143 -18.959
  249   1HB   ARG  23          2HB       ARG  23  30.270  10.848 -21.379
  250   2HB   ARG  23          3HB       ARG  23  28.828  10.604 -20.414
  251   1HG   ARG  23          2HG       ARG  23  31.507  11.599 -19.330
  252   2HG   ARG  23          3HG       ARG  23  30.133  12.624 -19.699
  253   1HD   ARG  23          2HD       ARG  23  29.021  10.641 -18.047
  254   2HD   ARG  23          3HD       ARG  23  30.604  10.902 -17.343
  255    HE   ARG  23           HE       ARG  23  29.174  13.385 -17.985
  256   1HH1  ARG  23          2HH2      ARG  23  29.747  10.914 -15.547
  257   2HH1  ARG  23          1HH2      ARG  23  29.280  11.930 -14.224
  258   1HH2  ARG  23          2HH1      ARG  23  28.558  14.726 -16.240
  259   2HH2  ARG  23          1HH1      ARG  23  28.600  14.113 -14.622
  260    H    ASP  24           HN       ASP  24  30.481   7.277 -21.766
  261    HA   ASP  24           HA       ASP  24  27.852   6.322 -20.958
  262   1HB   ASP  24          2HB       ASP  24  28.596   7.459 -23.480
  263   2HB   ASP  24          3HB       ASP  24  28.416   5.738 -23.754
  264    H    GLN  25           HN       GLN  25  30.692   5.527 -20.276
  265    HA   GLN  25           HA       GLN  25  30.669   2.886 -21.518
  266   1HB   GLN  25          2HB       GLN  25  32.644   4.265 -22.168
  267   2HB   GLN  25          3HB       GLN  25  33.070   4.458 -20.479
  268   1HG   GLN  25          2HG       GLN  25  33.175   1.898 -20.318
  269   2HG   GLN  25          3HG       GLN  25  32.993   1.849 -22.059
  270   1HE2  GLN  25          1HE2      GLN  25  35.146   1.863 -19.574
  271   2HE2  GLN  25          2HE2      GLN  25  36.585   2.398 -20.377
  272    H    CYS  26           HN       CYS  26  30.536   1.122 -20.153
  273    HA   CYS  26           HA       CYS  26  29.759   1.483 -17.535
  274   1HB   CYS  26          2HB       CYS  26  29.245  -0.530 -18.842
  275   2HB   CYS  26          3HB       CYS  26  30.936  -0.993 -18.841
  276    H    ALA  27           HN       ALA  27  30.895   1.709 -15.605
  277    HA   ALA  27           HA       ALA  27  33.812   1.748 -15.855
  278   1HB   ALA  27          1HB       ALA  27  32.654   3.817 -15.107
  279   2HB   ALA  27          2HB       ALA  27  31.970   2.920 -13.729
  280   3HB   ALA  27          3HB       ALA  27  33.730   3.159 -13.849
  281    H    TYR  28           HN       TYR  28  32.238  -0.758 -15.715
  282    HA   TYR  28           HA       TYR  28  33.278  -1.719 -13.137
  283   1HB   TYR  28          2HB       TYR  28  30.674  -1.469 -13.567
  284   2HB   TYR  28          3HB       TYR  28  30.867  -2.767 -14.730
  285    HD1  TYR  28           HD1      TYR  28  30.762  -1.893 -11.177
  286    HD2  TYR  28           HD2      TYR  28  31.429  -5.055 -13.980
  287    HE1  TYR  28           HE1      TYR  28  30.496  -3.608  -9.318
  288    HE2  TYR  28           HE2      TYR  28  31.161  -6.759 -12.113
  289    HH   TYR  28           HH       TYR  28  30.298  -5.719  -8.836
  290    H    CYS  29           HN       CYS  29  31.987  -2.941 -16.316
  291    HA   CYS  29           HA       CYS  29  34.023  -5.006 -16.218
  292   1HB   CYS  29          2HB       CYS  29  32.785  -6.034 -18.075
  293   2HB   CYS  29          3HB       CYS  29  31.748  -5.737 -16.693
  294    H    LYS  30           HN       LYS  30  33.198  -1.924 -17.697
  295    HA   LYS  30           HA       LYS  30  34.619  -0.585 -18.832
  296   1HB   LYS  30          2HB       LYS  30  36.404  -2.518 -18.222
  297   2HB   LYS  30          3HB       LYS  30  36.321  -2.749 -19.956
  298   1HG   LYS  30          2HG       LYS  30  37.641  -0.936 -20.264
  299   2HG   LYS  30          3HG       LYS  30  36.423   0.082 -19.523
  300   1HD   LYS  30          2HD       LYS  30  37.711  -1.304 -17.378
  301   2HD   LYS  30          3HD       LYS  30  38.991  -0.766 -18.447
  302   1HE   LYS  30          2HE       LYS  30  38.650   1.064 -16.952
  303   2HE   LYS  30          3HE       LYS  30  37.855   1.554 -18.435
  304   1HZ   LYS  30          1HZ       LYS  30  36.458   0.261 -16.197
  305   2HZ   LYS  30          2HZ       LYS  30  36.517   1.877 -16.425
  306   3HZ   LYS  30          3HZ       LYS  30  35.774   0.924 -17.524
  307    H    GLU  31           HN       GLU  31  32.173  -2.163 -19.600
  308    HA   GLU  31           HA       GLU  31  32.623  -2.454 -22.442
  309   1HB   GLU  31          2HB       GLU  31  30.354  -3.237 -20.582
  310   2HB   GLU  31          3HB       GLU  31  30.153  -3.274 -22.322
  311   1HG   GLU  31          2HG       GLU  31  31.137  -5.371 -20.846
  312   2HG   GLU  31          3HG       GLU  31  31.444  -5.149 -22.557
  313    H    LYS  32           HN       LYS  32  32.034  -0.896 -23.901
  314    HA   LYS  32           HA       LYS  32  30.775   1.480 -22.858
  315   1HB   LYS  32          2HB       LYS  32  31.322   2.437 -25.040
  316   2HB   LYS  32          3HB       LYS  32  32.723   1.684 -24.305
  317   1HG   LYS  32          2HG       LYS  32  31.341  -0.325 -25.861
  318   2HG   LYS  32          3HG       LYS  32  31.527   1.103 -26.859
  319   1HD   LYS  32          2HD       LYS  32  33.940   0.337 -25.267
  320   2HD   LYS  32          3HD       LYS  32  33.481  -0.798 -26.521
  321   1HE   LYS  32          2HE       LYS  32  33.480   1.052 -28.205
  322   2HE   LYS  32          3HE       LYS  32  33.925   2.196 -26.953
  323   1HZ   LYS  32          1HZ       LYS  32  35.767   1.218 -28.318
  324   2HZ   LYS  32          2HZ       LYS  32  35.983   1.178 -26.700
  325   3HZ   LYS  32          3HZ       LYS  32  35.550  -0.178 -27.500
  326    H    GLY  33           HN       GLY  33  28.652   2.002 -23.024
  327   1HA   GLY  33          1HA       GLY  33  26.818   1.911 -24.799
  328   2HA   GLY  33          2HA       GLY  33  26.964   0.175 -24.609
  329    H    HIS  34           HN       HIS  34  27.270  -0.270 -21.918
  330    HA   HIS  34           HA       HIS  34  24.806   0.898 -20.851
  331   1HB   HIS  34          2HB       HIS  34  24.485  -1.111 -19.605
  332   2HB   HIS  34          3HB       HIS  34  24.789  -1.548 -21.274
  333    HD1  HIS  34           HD1      HIS  34  26.674  -3.174 -21.717
  334    HD2  HIS  34           HD2      HIS  34  26.821  -1.539 -17.857
  335    HE1  HIS  34           HE1      HIS  34  28.509  -4.438 -20.475
  336    H    TRP  35           HN       TRP  35  24.757   1.340 -18.495
  337    HA   TRP  35           HA       TRP  35  27.314   2.447 -17.680
  338   1HB   TRP  35          2HB       TRP  35  24.469   2.957 -17.105
  339   2HB   TRP  35          3HB       TRP  35  25.535   3.106 -15.722
  340    HD1  TRP  35           HD1      TRP  35  26.000   4.314 -19.424
  341    HE1  TRP  35           HE1      TRP  35  26.715   6.853 -19.475
  342    HE3  TRP  35           HE3      TRP  35  25.875   4.994 -14.387
  343    HZ2  TRP  35           HZ2      TRP  35  27.140   8.817 -17.449
  344    HZ3  TRP  35           HZ3      TRP  35  26.455   7.252 -13.505
  345    HH2  TRP  35           HH2      TRP  35  27.071   9.127 -14.947
  346    H    ALA  36           HN       ALA  36  28.008   2.091 -15.349
  347    HA   ALA  36           HA       ALA  36  28.264  -0.636 -14.837
  348   1HB   ALA  36          1HB       ALA  36  29.895   1.002 -14.085
  349   2HB   ALA  36          2HB       ALA  36  28.672   1.817 -13.080
  350   3HB   ALA  36          3HB       ALA  36  29.217   0.175 -12.661
  351    H    LYS  37           HN       LYS  37  25.876   1.806 -13.811
  352    HA   LYS  37           HA       LYS  37  24.786   0.270 -11.710
  353   1HB   LYS  37          2HB       LYS  37  23.901   2.672 -13.292
  354   2HB   LYS  37          3HB       LYS  37  22.789   1.887 -12.188
  355   1HG   LYS  37          2HG       LYS  37  25.075   2.046 -10.629
  356   2HG   LYS  37          3HG       LYS  37  25.221   3.500 -11.599
  357   1HD   LYS  37          2HD       LYS  37  22.593   3.712 -10.945
  358   2HD   LYS  37          3HD       LYS  37  23.128   2.767  -9.570
  359   1HE   LYS  37          2HE       LYS  37  24.774   4.444  -8.942
  360   2HE   LYS  37          3HE       LYS  37  24.566   5.308 -10.452
  361   1HZ   LYS  37          1HZ       LYS  37  22.668   6.232  -9.735
  362   2HZ   LYS  37          2HZ       LYS  37  22.186   4.933  -8.870
  363   3HZ   LYS  37          3HZ       LYS  37  23.300   5.955  -8.255
  364    H    ASP  38           HN       ASP  38  24.867  -0.228 -15.070
  365    HA   ASP  38           HA       ASP  38  22.544  -1.966 -14.811
  366   1HB   ASP  38          2HB       ASP  38  22.575   0.245 -16.423
  367   2HB   ASP  38          3HB       ASP  38  23.274  -0.921 -17.526
  368    H    CYS  39           HN       CYS  39  25.555  -2.312 -14.468
  369    HA   CYS  39           HA       CYS  39  26.580  -3.546 -16.775
  370   1HB   CYS  39          2HB       CYS  39  27.966  -2.589 -14.932
  371   2HB   CYS  39          3HB       CYS  39  27.461  -3.906 -13.892
  372    HA   PRO  40           HA       PRO  40  24.382  -7.309 -16.265
  373   1HB   PRO  40          2HB       PRO  40  25.415  -8.651 -18.409
  374   2HB   PRO  40          3HB       PRO  40  24.074  -7.532 -18.536
  375   1HG   PRO  40          2HG       PRO  40  26.892  -7.145 -19.338
  376   2HG   PRO  40          3HG       PRO  40  25.477  -6.236 -19.830
  377   1HD   PRO  40          2HD       PRO  40  27.463  -5.422 -17.927
  378   2HD   PRO  40          3HD       PRO  40  25.987  -4.568 -18.333
  379    H    LYS  41           HN       LYS  41  27.489  -6.723 -15.545
  380    HA   LYS  41           HA       LYS  41  28.058  -9.536 -14.996
  381   1HB   LYS  41          2HB       LYS  41  29.629  -7.521 -16.050
  382   2HB   LYS  41          3HB       LYS  41  30.134  -7.551 -14.373
  383   1HG   LYS  41          2HG       LYS  41  29.988 -10.262 -14.955
  384   2HG   LYS  41          3HG       LYS  41  30.503  -9.601 -16.495
  385   1HD   LYS  41          2HD       LYS  41  32.610  -9.343 -15.706
  386   2HD   LYS  41          3HD       LYS  41  32.026  -8.268 -14.451
  387   1HE   LYS  41          2HE       LYS  41  32.925  -9.946 -13.115
  388   2HE   LYS  41          3HE       LYS  41  31.291 -10.557 -13.271
  389   1HZ   LYS  41          1HZ       LYS  41  33.623 -11.765 -14.103
  390   2HZ   LYS  41          2HZ       LYS  41  32.097 -12.317 -14.283
  391   3HZ   LYS  41          3HZ       LYS  41  32.783 -11.415 -15.459
  392    H    LYS  42           HN       LYS  42  26.902  -6.599 -13.554
  393    HA   LYS  42           HA       LYS  42  27.849  -6.604 -11.033
  394   1HB   LYS  42          2HB       LYS  42  25.116  -6.034 -12.162
  395   2HB   LYS  42          3HB       LYS  42  25.402  -5.911 -10.438
  396   1HG   LYS  42          2HG       LYS  42  27.583  -4.610 -11.851
  397   2HG   LYS  42          3HG       LYS  42  26.061  -3.998 -12.467
  398   1HD   LYS  42          2HD       LYS  42  25.332  -3.300 -10.273
  399   2HD   LYS  42          3HD       LYS  42  26.595  -4.219  -9.477
  400   1HE   LYS  42          2HE       LYS  42  28.193  -2.601  -9.842
  401   2HE   LYS  42          3HE       LYS  42  27.604  -2.231 -11.450
  402   1HZ   LYS  42          1HZ       LYS  42  27.060  -0.388 -10.226
  403   2HZ   LYS  42          2HZ       LYS  42  25.650  -1.210 -10.203
  404   3HZ   LYS  42          3HZ       LYS  42  26.625  -1.225  -8.894
  405    HA   PRO  43           HA       PRO  43  26.672 -10.306  -9.154
  406   1HB   PRO  43          2HB       PRO  43  26.569  -9.595  -6.517
  407   2HB   PRO  43          3HB       PRO  43  28.067  -9.932  -7.362
  408   1HG   PRO  43          2HG       PRO  43  26.944  -7.321  -6.548
  409   2HG   PRO  43          3HG       PRO  43  28.592  -7.716  -6.995
  410   1HD   PRO  43          2HD       PRO  43  26.651  -6.365  -8.617
  411   2HD   PRO  43          3HD       PRO  43  28.259  -6.864  -9.104
  412    H    ARG  44           HN       ARG  44  24.779 -11.184  -9.733
  413    HA   ARG  44           HA       ARG  44  22.522  -9.993  -8.330
  414   1HB   ARG  44          2HB       ARG  44  22.857 -10.905 -11.180
  415   2HB   ARG  44          3HB       ARG  44  21.300 -11.215 -10.438
  416   1HG   ARG  44          2HG       ARG  44  20.745  -9.071 -10.939
  417   2HG   ARG  44          3HG       ARG  44  21.850  -8.571  -9.675
  418   1HD   ARG  44          2HD       ARG  44  23.731  -8.673 -11.437
  419   2HD   ARG  44          3HD       ARG  44  22.479  -8.883 -12.645
  420    HE   ARG  44           HE       ARG  44  23.056  -6.425 -11.124
  421   1HH1  ARG  44          2HH2      ARG  44  20.765  -8.125 -13.183
  422   2HH1  ARG  44          1HH2      ARG  44  19.946  -6.683 -13.681
  423   1HH2  ARG  44          2HH1      ARG  44  21.977  -4.521 -11.781
  424   2HH2  ARG  44          1HH1      ARG  44  20.641  -4.618 -12.879
  425    H    GLY  45           HN       GLY  45  22.724 -11.505  -6.551
  426   1HA   GLY  45          1HA       GLY  45  22.189 -13.396  -5.457
  427   2HA   GLY  45          2HA       GLY  45  21.350 -13.949  -6.893
  428    HA   PRO  46           HA       PRO  46  21.324 -15.666  -5.713
  429   1HB   PRO  46          2HB       PRO  46  21.918 -17.805  -4.118
  430   2HB   PRO  46          3HB       PRO  46  21.378 -17.966  -5.778
  431   1HG   PRO  46          2HG       PRO  46  24.097 -18.311  -4.671
  432   2HG   PRO  46          3HG       PRO  46  23.457 -18.869  -6.204
  433   1HD   PRO  46          2HD       PRO  46  25.184 -16.618  -5.783
  434   2HD   PRO  46          3HD       PRO  46  24.451 -17.107  -7.297
  435    H    ARG  47           HN       ARG  47  20.274 -15.010  -3.841
  436    HA   ARG  47           HA       ARG  47  21.855 -13.325  -2.297
  437   1HB   ARG  47          2HB       ARG  47  19.075 -13.877  -2.655
  438   2HB   ARG  47          3HB       ARG  47  19.378 -14.091  -0.943
  439   1HG   ARG  47          2HG       ARG  47  19.652 -11.855  -0.606
  440   2HG   ARG  47          3HG       ARG  47  20.753 -11.705  -1.961
  441   1HD   ARG  47          2HD       ARG  47  17.782 -12.046  -2.476
  442   2HD   ARG  47          3HD       ARG  47  18.410 -10.471  -2.035
  443    HE   ARG  47           HE       ARG  47  20.125 -11.186  -4.041
  444   1HH1  ARG  47          2HH2      ARG  47  16.613 -11.252  -3.831
  445   2HH1  ARG  47          1HH2      ARG  47  16.379 -11.007  -5.530
  446   1HH2  ARG  47          2HH1      ARG  47  19.817 -10.864  -6.283
  447   2HH2  ARG  47          1HH1      ARG  47  18.214 -10.785  -6.933
  448    H    GLY  48           HN       GLY  48  23.407 -14.084  -0.879
  449   1HA   GLY  48          1HA       GLY  48  22.582 -16.184   1.018
  450   2HA   GLY  48          2HA       GLY  48  24.084 -16.337   0.128
  451    HA   PRO  49           HA       PRO  49  24.565 -13.595   3.876
  452   1HB   PRO  49          2HB       PRO  49  25.272 -15.354   5.845
  453   2HB   PRO  49          3HB       PRO  49  23.647 -14.723   5.662
  454   1HG   PRO  49          2HG       PRO  49  24.680 -17.408   4.982
  455   2HG   PRO  49          3HG       PRO  49  23.020 -16.896   5.209
  456   1HD   PRO  49          2HD       PRO  49  24.337 -17.389   2.709
  457   2HD   PRO  49          3HD       PRO  49  22.714 -16.766   2.934
  458    H    ARG  50           HN       ARG  50  26.476 -12.597   4.417
  459    HA   ARG  50           HA       ARG  50  28.579 -13.140   2.844
  460   1HB   ARG  50          2HB       ARG  50  29.957 -11.886   4.602
  461   2HB   ARG  50          3HB       ARG  50  28.496 -11.067   4.086
  462   1HG   ARG  50          2HG       ARG  50  27.395 -11.434   6.114
  463   2HG   ARG  50          3HG       ARG  50  28.263 -12.920   6.446
  464   1HD   ARG  50          2HD       ARG  50  30.363 -11.532   6.837
  465   2HD   ARG  50          3HD       ARG  50  29.388 -10.087   6.662
  466    HE   ARG  50           HE       ARG  50  29.353 -11.965   8.933
  467   1HH1  ARG  50          2HH2      ARG  50  27.712  -9.318   7.296
  468   2HH1  ARG  50          1HH2      ARG  50  26.813  -8.840   8.697
  469   1HH2  ARG  50          2HH1      ARG  50  28.167 -11.335  10.782
  470   2HH2  ARG  50          1HH1      ARG  50  27.073  -9.995  10.693
  471    HA   PRO  51           HA       PRO  51  30.538 -16.630   4.583
  472   1HB   PRO  51          2HB       PRO  51  33.081 -16.360   3.617
  473   2HB   PRO  51          3HB       PRO  51  31.756 -17.002   2.665
  474   1HG   PRO  51          2HG       PRO  51  33.032 -14.340   2.505
  475   2HG   PRO  51          3HG       PRO  51  32.026 -15.149   1.320
  476   1HD   PRO  51          2HD       PRO  51  31.240 -13.019   3.073
  477   2HD   PRO  51          3HD       PRO  51  30.206 -13.904   1.970
  478    H    GLN  52           HN       GLN  52  30.113 -15.839   6.767
  479    HA   GLN  52           HA       GLN  52  32.687 -15.513   8.021
  480   1HB   GLN  52          2HB       GLN  52  31.830 -13.187   7.609
  481   2HB   GLN  52          3HB       GLN  52  30.394 -13.566   8.539
  482   1HG   GLN  52          2HG       GLN  52  31.478 -13.171  10.493
  483   2HG   GLN  52          3HG       GLN  52  32.739 -14.317  10.082
  484   1HE2  GLN  52          1HE2      GLN  52  34.375 -13.565   8.481
  485   2HE2  GLN  52          2HE2      GLN  52  34.954 -11.938   8.599
  486    H    THR  53           HN       THR  53  32.252 -17.714   8.720
  487    HA   THR  53           HA       THR  53  30.170 -17.837  10.802
  488    HB   THR  53           HB       THR  53  29.859 -20.196  10.139
  489    HG1  THR  53           HG1      THR  53  31.816 -19.499   8.072
  490   1HG2  THR  53          1HG2      THR  53  28.544 -18.671   8.721
  491   2HG2  THR  53          2HG2      THR  53  29.975 -18.314   7.724
  492   3HG2  THR  53          3HG2      THR  53  29.246 -19.937   7.685
  493    H    SER  54           HN       SER  54  30.690 -19.787  12.360
  494    HA   SER  54           HA       SER  54  31.952 -20.505  13.971
  495   1HB   SER  54          2HB       SER  54  33.204 -21.814  12.434
  496   2HB   SER  54          3HB       SER  54  33.998 -20.415  11.739
  497    HG   SER  54           HG       SER  54  34.643 -21.893  14.049
  498    H    LEU  55           HN       LEU  55  32.027 -19.014  15.630
  499    HA   LEU  55           HA       LEU  55  33.914 -16.789  15.305
  500   1HB   LEU  55          2HB       LEU  55  31.304 -17.049  16.772
  501   2HB   LEU  55          3HB       LEU  55  32.473 -15.819  17.211
  502    HG   LEU  55           HG       LEU  55  32.323 -15.386  14.534
  503   1HD1  LEU  55          1HD1      LEU  55  30.022 -17.020  15.188
  504   2HD1  LEU  55          2HD1      LEU  55  29.528 -15.418  14.590
  505   3HD1  LEU  55          3HD1      LEU  55  30.602 -16.443  13.608
  506   1HD2  LEU  55          1HD2      LEU  55  31.861 -13.383  15.359
  507   2HD2  LEU  55          2HD2      LEU  55  30.193 -13.900  15.708
  508   3HD2  LEU  55          3HD2      LEU  55  31.468 -14.114  16.933
  509    H    LEU  56           HN       LEU  56  32.422 -18.803  17.944
  510    HA   LEU  56           HA       LEU  56  33.279 -19.558  19.840
  511   1HB   LEU  56          2HB       LEU  56  35.582 -20.093  17.967
  512   2HB   LEU  56          3HB       LEU  56  35.525 -20.690  19.613
  513    HG   LEU  56           HG       LEU  56  33.119 -21.573  18.685
  514   1HD1  LEU  56          1HD1      LEU  56  34.971 -21.988  16.338
  515   2HD1  LEU  56          2HD1      LEU  56  33.232 -22.351  16.469
  516   3HD1  LEU  56          3HD1      LEU  56  33.786 -20.660  16.400
  517   1HD2  LEU  56          1HD2      LEU  56  35.832 -22.779  18.955
  518   2HD2  LEU  56          2HD2      LEU  56  34.316 -23.148  19.813
  519   3HD2  LEU  56          3HD2      LEU  56  34.566 -23.740  18.153
  Start of MODEL   15
    1   1H5*    C 504          1H5*        C 504  38.379 -14.095  -5.738
    2   2H5*    C 504          2H5*        C 504  37.721 -12.476  -5.969
    3    H4*    C 504           H4*        C 504  39.481 -13.562  -7.638
    4    H3*    C 504           H3*        C 504  37.165 -11.939  -8.751
    5    H2*    C 504           H2*        C 504  38.772 -11.431 -10.414
    6   2HO*    C 504          2HO*        C 504  41.030 -11.837  -9.825
    7    H1*    C 504           H1*        C 504  39.824 -13.954 -10.596
    8   1H4     C 504          1H4         C 504  34.864 -14.176 -14.605
    9   2H4     C 504          2H4         C 504  33.795 -14.496 -13.257
   10    H5     C 504           H5         C 504  34.487 -14.494 -11.000
   11    H6     C 504           H6         C 504  36.395 -14.182  -9.463
   12   1H5*    C 505          1H5*        C 505  39.999  -9.711  -8.756
   13   2H5*    C 505          2H5*        C 505  40.089  -8.029  -8.233
   14    H4*    C 505           H4*        C 505  40.715  -7.745 -10.388
   15    H3*    C 505           H3*        C 505  37.726  -7.558 -10.375
   16    H2*    C 505           H2*        C 505  37.678  -7.309 -12.736
   17   2HO*    C 505          2HO*        C 505  39.639  -6.018 -12.632
   18    H1*    C 505           H1*        C 505  39.345  -9.486 -13.213
   19   1H4     C 505          1H4         C 505  33.613 -12.236 -13.421
   20   2H4     C 505          2H4         C 505  33.364 -11.910 -11.721
   21    H5     C 505           H5         C 505  34.895 -10.721 -10.371
   22    H6     C 505           H6         C 505  37.062  -9.540 -10.321
   23   1H5*    U 506          1H5*        U 506  40.092  -3.458 -10.597
   24   2H5*    U 506          2H5*        U 506  39.521  -2.158  -9.552
   25    H4*    U 506           H4*        U 506  38.126  -1.773 -11.275
   26    H3*    U 506           H3*        U 506  36.719  -3.999  -9.794
   27    H2*    U 506           H2*        U 506  35.051  -3.989 -11.399
   28   2HO*    U 506          2HO*        U 506  35.875  -1.491 -12.445
   29    H1*    U 506           H1*        U 506  36.993  -2.920 -13.387
   30    H3     U 506           H3         U 506  36.403  -6.196 -16.383
   31    H5     U 506           H5         U 506  34.895  -7.898 -12.866
   32    H6     U 506           H6         U 506  35.612  -5.867 -11.693
   33   1H5*    C 507          1H5*        C 507  35.031   0.146 -10.620
   34   2H5*    C 507          2H5*        C 507  34.660   0.654  -8.973
   35    H4*    C 507           H4*        C 507  33.354   1.614 -11.051
   36    H3*    C 507           H3*        C 507  32.320   1.011  -8.300
   37    H2*    C 507           H2*        C 507  30.148   1.751  -8.931
   38   2HO*    C 507          2HO*        C 507  31.526   2.408 -11.373
   39    H1*    C 507           H1*        C 507  30.150   0.216 -11.289
   40   1H4     C 507          1H4         C 507  27.051  -3.203  -6.832
   41   2H4     C 507          2H4         C 507  28.554  -4.043  -6.518
   42    H5     C 507           H5         C 507  30.624  -3.437  -7.478
   43    H6     C 507           H6         C 507  31.775  -1.860  -8.991
   44   1H5*    C 508          1H5*        C 508  32.625   5.644  -5.931
   45   2H5*    C 508          2H5*        C 508  31.755   6.380  -7.276
   46    H4*    C 508           H4*        C 508  33.727   7.604  -5.933
   47    H3*    C 508           H3*        C 508  32.827   7.929  -8.783
   48    H2*    C 508           H2*        C 508  34.512   9.553  -9.141
   49   2HO*    C 508          2HO*        C 508  34.903   9.239  -6.303
   50    H1*    C 508           H1*        C 508  36.470   7.987  -7.776
   51   1H4     C 508          1H4         C 508  37.961   6.875 -13.856
   52   2H4     C 508          2H4         C 508  36.365   6.228 -14.164
   53    H5     C 508           H5         C 508  34.644   6.150 -12.549
   54    H6     C 508           H6         C 508  34.024   6.678 -10.217
   55   1H5*    G 509          1H5*        G 509  29.973   8.196 -10.008
   56   2H5*    G 509          2H5*        G 509  31.506   8.323 -10.871
   57    H4*    G 509           H4*        G 509  30.074  10.781 -11.192
   58    H3*    G 509           H3*        G 509  28.317   8.414 -11.282
   59    H2*    G 509           H2*        G 509  27.525   8.800 -13.471
   60   2HO*    G 509          2HO*        G 509  29.061  11.100 -13.882
   61    H1*    G 509           H1*        G 509  29.955   9.139 -14.661
   62    H8     G 509           H8         G 509  29.567   6.885 -11.580
   63    H1     G 509           H1         G 509  29.866   3.813 -17.267
   64   1H2     G 509          1H2         G 509  29.970   5.196 -18.793
   65   2H2     G 509          2H2         G 509  29.974   6.931 -18.566
   66   1H5*    U 510          1H5*        U 510  25.509  13.151  -9.506
   67   2H5*    U 510          2H5*        U 510  25.442  11.516  -8.851
   68    H4*    U 510           H4*        U 510  23.283  12.837  -8.851
   69    H3*    U 510           H3*        U 510  23.471  10.075 -10.052
   70    H2*    U 510           H2*        U 510  21.121  10.081 -10.325
   71   2HO*    U 510          2HO*        U 510  20.656  11.025  -8.323
   72    H1*    U 510           H1*        U 510  21.150  12.798 -11.249
   73    H3     U 510           H3         U 510  19.390  10.543 -14.771
   74    H5     U 510           H5         U 510  23.438   9.473 -14.801
   75    H6     U 510           H6         U 510  23.664  10.649 -12.662
   76   1H    ALA   1           HN       ALA   1  38.043  10.835 -48.816
   77    HA   ALA   1           HA       ALA   1  37.641  13.536 -49.687
   78   1HB   ALA   1          1HB       ALA   1  36.571  11.579 -51.328
   79   2HB   ALA   1          2HB       ALA   1  35.217  11.954 -50.236
   80   3HB   ALA   1          3HB       ALA   1  35.975  13.250 -51.190
   81    H    THR   2           HN       THR   2  37.191  14.513 -47.783
   82    HA   THR   2           HA       THR   2  35.068  13.465 -46.143
   83    HB   THR   2           HB       THR   2  37.989  13.489 -45.238
   84    HG1  THR   2           HG1      THR   2  37.115  11.258 -44.647
   85   1HG2  THR   2          1HG2      THR   2  35.458  13.026 -43.572
   86   2HG2  THR   2          2HG2      THR   2  37.137  12.869 -43.001
   87   3HG2  THR   2          3HG2      THR   2  36.492  14.468 -43.444
   88    H    VAL   3           HN       VAL   3  34.156  15.016 -44.766
   89    HA   VAL   3           HA       VAL   3  35.011  17.720 -45.451
   90    HB   VAL   3           HB       VAL   3  32.485  16.562 -44.268
   91   1HG1  VAL   3          1HG1      VAL   3  33.394  19.419 -44.542
   92   2HG1  VAL   3          2HG1      VAL   3  31.668  19.008 -44.683
   93   3HG1  VAL   3          3HG1      VAL   3  32.556  18.619 -43.190
   94   1HG2  VAL   3          1HG2      VAL   3  31.727  16.462 -46.364
   95   2HG2  VAL   3          2HG2      VAL   3  32.169  18.162 -46.656
   96   3HG2  VAL   3          3HG2      VAL   3  33.365  16.872 -46.928
   97    H    VAL   4           HN       VAL   4  35.464  19.305 -43.844
   98    HA   VAL   4           HA       VAL   4  35.793  18.221 -41.139
   99    HB   VAL   4           HB       VAL   4  37.926  19.425 -40.979
  100   1HG1  VAL   4          1HG1      VAL   4  37.495  17.181 -42.905
  101   2HG1  VAL   4          2HG1      VAL   4  39.114  17.918 -42.834
  102   3HG1  VAL   4          3HG1      VAL   4  38.390  17.217 -41.366
  103   1HG2  VAL   4          1HG2      VAL   4  39.033  20.100 -43.170
  104   2HG2  VAL   4          2HG2      VAL   4  37.414  20.019 -43.904
  105   3HG2  VAL   4          3HG2      VAL   4  37.734  21.166 -42.581
  106    H    SER   5           HN       SER   5  35.508  19.760 -39.440
  107    HA   SER   5           HA       SER   5  34.708  22.401 -40.307
  108   1HB   SER   5          2HB       SER   5  32.984  20.538 -38.617
  109   2HB   SER   5          3HB       SER   5  32.691  22.260 -38.757
  110    HG   SER   5           HG       SER   5  32.748  21.735 -41.218
  111    H    GLY   6           HN       GLY   6  34.511  23.927 -38.354
  112   1HA   GLY   6          1HA       GLY   6  36.682  23.327 -36.507
  113   2HA   GLY   6          2HA       GLY   6  35.888  24.868 -36.765
  114    H    GLN   7           HN       GLN   7  35.622  25.173 -34.460
  115    HA   GLN   7           HA       GLN   7  33.161  24.303 -33.535
  116   1HB   GLN   7          2HB       GLN   7  33.828  22.851 -31.653
  117   2HB   GLN   7          3HB       GLN   7  34.285  22.133 -33.186
  118   1HG   GLN   7          2HG       GLN   7  36.609  23.188 -32.863
  119   2HG   GLN   7          3HG       GLN   7  36.109  23.608 -31.236
  120   1HE2  GLN   7          1HE2      GLN   7  38.236  21.863 -32.066
  121   2HE2  GLN   7          2HE2      GLN   7  37.934  20.290 -31.408
  122    H    LYS   8           HN       LYS   8  32.488  25.980 -32.266
  123    HA   LYS   8           HA       LYS   8  34.263  28.013 -31.529
  124   1HB   LYS   8          2HB       LYS   8  31.953  28.488 -32.000
  125   2HB   LYS   8          3HB       LYS   8  31.404  27.409 -30.734
  126   1HG   LYS   8          2HG       LYS   8  32.143  28.853 -28.997
  127   2HG   LYS   8          3HG       LYS   8  33.264  29.702 -30.042
  128   1HD   LYS   8          2HD       LYS   8  31.573  30.996 -31.047
  129   2HD   LYS   8          3HD       LYS   8  30.320  29.817 -30.714
  130   1HE   LYS   8          2HE       LYS   8  31.282  30.580 -28.158
  131   2HE   LYS   8          3HE       LYS   8  31.221  32.074 -29.071
  132   1HZ   LYS   8          1HZ       LYS   8  29.029  32.030 -29.023
  133   2HZ   LYS   8          2HZ       LYS   8  28.932  30.477 -29.520
  134   3HZ   LYS   8          3HZ       LYS   8  29.117  30.817 -27.932
  135    H    GLN   9           HN       GLN   9  35.201  28.593 -29.547
  136    HA   GLN   9           HA       GLN   9  35.117  26.438 -27.581
  137   1HB   GLN   9          2HB       GLN   9  37.326  27.210 -28.941
  138   2HB   GLN   9          3HB       GLN   9  37.413  28.374 -27.633
  139   1HG   GLN   9          2HG       GLN   9  38.450  26.713 -26.461
  140   2HG   GLN   9          3HG       GLN   9  36.842  26.053 -26.238
  141   1HE2  GLN   9          1HE2      GLN   9  36.920  23.956 -26.476
  142   2HE2  GLN   9          2HE2      GLN   9  37.699  23.071 -27.745
  143    H    ASP  10           HN       ASP  10  35.522  27.187 -25.261
  144    HA   ASP  10           HA       ASP  10  34.985  29.941 -24.770
  145   1HB   ASP  10          2HB       ASP  10  32.952  29.500 -23.389
  146   2HB   ASP  10          3HB       ASP  10  32.690  29.141 -25.085
  147    H    ARG  11           HN       ARG  11  35.122  30.364 -22.327
  148    HA   ARG  11           HA       ARG  11  37.120  28.710 -21.237
  149   1HB   ARG  11          2HB       ARG  11  36.451  31.338 -20.922
  150   2HB   ARG  11          3HB       ARG  11  35.669  30.688 -19.494
  151   1HG   ARG  11          2HG       ARG  11  38.486  29.778 -20.040
  152   2HG   ARG  11          3HG       ARG  11  38.274  31.436 -19.513
  153   1HD   ARG  11          2HD       ARG  11  37.337  30.799 -17.426
  154   2HD   ARG  11          3HD       ARG  11  36.866  29.214 -18.006
  155    HE   ARG  11           HE       ARG  11  39.698  29.366 -18.201
  156   1HH1  ARG  11          2HH2      ARG  11  37.221  29.363 -15.701
  157   2HH1  ARG  11          1HH2      ARG  11  38.252  28.658 -14.501
  158   1HH2  ARG  11          2HH1      ARG  11  41.059  28.436 -16.618
  159   2HH2  ARG  11          1HH1      ARG  11  40.450  28.128 -15.026
  160    H    GLN  12           HN       GLN  12  36.627  26.718 -20.355
  161    HA   GLN  12           HA       GLN  12  34.581  26.661 -18.343
  162   1HB   GLN  12          2HB       GLN  12  34.192  25.517 -21.016
  163   2HB   GLN  12          3HB       GLN  12  34.061  24.288 -19.774
  164   1HG   GLN  12          2HG       GLN  12  32.667  26.869 -19.181
  165   2HG   GLN  12          3HG       GLN  12  31.998  25.938 -20.506
  166   1HE2  GLN  12          1HE2      GLN  12  30.524  26.366 -18.285
  167   2HE2  GLN  12          2HE2      GLN  12  30.310  24.911 -17.369
  168    H    GLY  13           HN       GLY  13  36.077  26.144 -16.742
  169   1HA   GLY  13          1HA       GLY  13  38.087  24.113 -17.234
  170   2HA   GLY  13          2HA       GLY  13  37.858  25.071 -15.784
  171    H    GLY  14           HN       GLY  14  37.880  21.970 -16.759
  172   1HA   GLY  14          1HA       GLY  14  35.719  21.195 -14.892
  173   2HA   GLY  14          2HA       GLY  14  36.000  20.358 -16.406
  174    H    GLU  15           HN       GLU  15  36.650  20.315 -13.099
  175    HA   GLU  15           HA       GLU  15  39.267  19.146 -13.387
  176   1HB   GLU  15          2HB       GLU  15  37.998  20.636 -11.374
  177   2HB   GLU  15          3HB       GLU  15  38.047  19.015 -10.710
  178   1HG   GLU  15          2HG       GLU  15  40.597  19.425 -11.918
  179   2HG   GLU  15          3HG       GLU  15  40.233  20.916 -11.072
  180    H    ARG  16           HN       ARG  16  38.459  17.302 -14.714
  181    HA   ARG  16           HA       ARG  16  37.264  15.304 -12.967
  182   1HB   ARG  16          2HB       ARG  16  36.222  14.307 -15.038
  183   2HB   ARG  16          3HB       ARG  16  35.623  15.915 -14.682
  184   1HG   ARG  16          2HG       ARG  16  37.952  16.257 -16.320
  185   2HG   ARG  16          3HG       ARG  16  37.006  14.978 -17.058
  186   1HD   ARG  16          2HD       ARG  16  35.069  16.893 -16.342
  187   2HD   ARG  16          3HD       ARG  16  36.424  17.866 -16.878
  188    HE   ARG  16           HE       ARG  16  36.290  15.975 -18.858
  189   1HH1  ARG  16          2HH2      ARG  16  33.837  18.023 -17.385
  190   2HH1  ARG  16          1HH2      ARG  16  32.858  18.097 -18.812
  191   1HH2  ARG  16          2HH1      ARG  16  34.999  16.072 -20.742
  192   2HH2  ARG  16          1HH1      ARG  16  33.524  16.980 -20.735
  193    H    ARG  17           HN       ARG  17  38.569  13.516 -12.663
  194    HA   ARG  17           HA       ARG  17  40.510  12.982 -14.761
  195   1HB   ARG  17          2HB       ARG  17  42.115  12.276 -12.900
  196   2HB   ARG  17          3HB       ARG  17  41.794  13.997 -12.974
  197   1HG   ARG  17          2HG       ARG  17  39.900  13.539 -11.237
  198   2HG   ARG  17          3HG       ARG  17  40.648  11.970 -11.014
  199   1HD   ARG  17          2HD       ARG  17  42.829  13.734 -10.882
  200   2HD   ARG  17          3HD       ARG  17  41.551  14.623 -10.077
  201    HE   ARG  17           HE       ARG  17  41.336  12.090  -8.978
  202   1HH1  ARG  17          2HH2      ARG  17  43.986  14.377  -9.329
  203   2HH1  ARG  17          1HH2      ARG  17  44.807  13.841  -7.901
  204   1HH2  ARG  17          2HH1      ARG  17  42.419  11.381  -7.096
  205   2HH2  ARG  17          1HH1      ARG  17  43.909  12.125  -6.622
  206    H    ARG  18           HN       ARG  18  38.157  11.656 -14.891
  207    HA   ARG  18           HA       ARG  18  38.496   9.226 -13.355
  208   1HB   ARG  18          2HB       ARG  18  36.171  10.401 -14.936
  209   2HB   ARG  18          3HB       ARG  18  36.151   8.729 -14.415
  210   1HG   ARG  18          2HG       ARG  18  36.514   9.494 -12.039
  211   2HG   ARG  18          3HG       ARG  18  36.456  11.158 -12.585
  212   1HD   ARG  18          2HD       ARG  18  34.184   9.159 -13.016
  213   2HD   ARG  18          3HD       ARG  18  34.253  10.272 -11.664
  214    HE   ARG  18           HE       ARG  18  33.630  10.940 -14.447
  215   1HH1  ARG  18          2HH2      ARG  18  34.782  12.206 -11.373
  216   2HH1  ARG  18          1HH2      ARG  18  34.325  13.840 -11.729
  217   1HH2  ARG  18          2HH1      ARG  18  33.027  13.093 -14.917
  218   2HH2  ARG  18          1HH1      ARG  18  33.319  14.347 -13.758
  219    H    SER  19           HN       SER  19  40.495   9.089 -15.014
  220    HA   SER  19           HA       SER  19  41.383   8.353 -16.889
  221   1HB   SER  19          2HB       SER  19  39.372   6.086 -16.739
  222   2HB   SER  19          3HB       SER  19  41.061   6.008 -17.200
  223    HG   SER  19           HG       SER  19  40.134   6.702 -14.544
  224    H    GLN  20           HN       GLN  20  39.954   6.457 -18.827
  225    HA   GLN  20           HA       GLN  20  38.775   8.577 -20.386
  226   1HB   GLN  20          2HB       GLN  20  40.554   6.960 -21.276
  227   2HB   GLN  20          3HB       GLN  20  39.330   5.705 -21.239
  228   1HG   GLN  20          2HG       GLN  20  38.018   7.799 -22.550
  229   2HG   GLN  20          3HG       GLN  20  39.661   7.952 -23.137
  230   1HE2  GLN  20          1HE2      GLN  20  38.063   7.380 -25.033
  231   2HE2  GLN  20          2HE2      GLN  20  38.061   5.716 -25.513
  232    H    LEU  21           HN       LEU  21  37.321   7.549 -18.041
  233    HA   LEU  21           HA       LEU  21  35.398   5.663 -18.770
  234   1HB   LEU  21          2HB       LEU  21  36.135   6.877 -16.488
  235   2HB   LEU  21          3HB       LEU  21  34.690   7.803 -16.842
  236    HG   LEU  21           HG       LEU  21  34.934   4.843 -16.312
  237   1HD1  LEU  21          1HD1      LEU  21  33.863   5.233 -14.361
  238   2HD1  LEU  21          2HD1      LEU  21  34.547   6.863 -14.579
  239   3HD1  LEU  21          3HD1      LEU  21  32.859   6.537 -15.039
  240   1HD2  LEU  21          1HD2      LEU  21  32.623   6.306 -17.601
  241   2HD2  LEU  21          2HD2      LEU  21  33.513   4.891 -18.210
  242   3HD2  LEU  21          3HD2      LEU  21  32.458   4.732 -16.786
  243    H    ASP  22           HN       ASP  22  34.472   5.983 -20.791
  244    HA   ASP  22           HA       ASP  22  33.682   8.446 -21.737
  245   1HB   ASP  22          2HB       ASP  22  33.874   5.998 -22.825
  246   2HB   ASP  22          3HB       ASP  22  32.158   5.940 -22.470
  247    H    ARG  23           HN       ARG  23  31.501   9.403 -21.876
  248    HA   ARG  23           HA       ARG  23  30.045   9.120 -19.529
  249   1HB   ARG  23          2HB       ARG  23  29.783  10.643 -22.098
  250   2HB   ARG  23          3HB       ARG  23  28.293  10.422 -21.203
  251   1HG   ARG  23          2HG       ARG  23  30.872  11.665 -20.140
  252   2HG   ARG  23          3HG       ARG  23  29.384  12.516 -20.503
  253   1HD   ARG  23          2HD       ARG  23  28.665  10.390 -18.726
  254   2HD   ARG  23          3HD       ARG  23  30.125  11.102 -18.066
  255    HE   ARG  23           HE       ARG  23  28.354  13.213 -18.860
  256   1HH1  ARG  23          2HH2      ARG  23  28.652  10.702 -16.413
  257   2HH1  ARG  23          1HH2      ARG  23  27.735  11.571 -15.228
  258   1HH2  ARG  23          2HH1      ARG  23  27.145  14.360 -17.297
  259   2HH2  ARG  23          1HH1      ARG  23  26.872  13.665 -15.734
  260    H    ASP  24           HN       ASP  24  30.187   7.143 -22.290
  261    HA   ASP  24           HA       ASP  24  27.534   6.102 -21.678
  262   1HB   ASP  24          2HB       ASP  24  28.946   6.254 -24.382
  263   2HB   ASP  24          3HB       ASP  24  27.481   5.332 -24.107
  264    H    GLN  25           HN       GLN  25  30.307   5.469 -20.639
  265    HA   GLN  25           HA       GLN  25  30.618   2.808 -21.786
  266   1HB   GLN  25          2HB       GLN  25  32.536   4.857 -20.829
  267   2HB   GLN  25          3HB       GLN  25  32.885   3.241 -20.247
  268   1HG   GLN  25          2HG       GLN  25  32.655   2.423 -22.665
  269   2HG   GLN  25          3HG       GLN  25  32.557   4.101 -23.156
  270   1HE2  GLN  25          1HE2      GLN  25  34.531   2.324 -24.003
  271   2HE2  GLN  25          2HE2      GLN  25  36.078   2.839 -23.419
  272    H    CYS  26           HN       CYS  26  31.918   1.413 -19.840
  273    HA   CYS  26           HA       CYS  26  30.083   1.625 -17.564
  274   1HB   CYS  26          2HB       CYS  26  29.622  -0.373 -18.904
  275   2HB   CYS  26          3HB       CYS  26  31.297  -0.873 -18.788
  276    H    ALA  27           HN       ALA  27  31.033   1.540 -15.480
  277    HA   ALA  27           HA       ALA  27  33.966   1.648 -15.499
  278   1HB   ALA  27          1HB       ALA  27  32.152   2.625 -13.281
  279   2HB   ALA  27          2HB       ALA  27  33.817   3.126 -13.669
  280   3HB   ALA  27          3HB       ALA  27  32.470   3.625 -14.719
  281    H    TYR  28           HN       TYR  28  32.398  -0.853 -15.625
  282    HA   TYR  28           HA       TYR  28  33.242  -1.955 -13.032
  283   1HB   TYR  28          2HB       TYR  28  30.682  -1.636 -13.501
  284   2HB   TYR  28          3HB       TYR  28  30.869  -2.788 -14.808
  285    HD1  TYR  28           HD1      TYR  28  30.367  -2.366 -11.269
  286    HD2  TYR  28           HD2      TYR  28  31.650  -5.158 -14.245
  287    HE1  TYR  28           HE1      TYR  28  29.991  -4.284  -9.643
  288    HE2  TYR  28           HE2      TYR  28  31.270  -7.066 -12.610
  289    HH   TYR  28           HH       TYR  28  31.148  -6.789  -9.516
  290    H    CYS  29           HN       CYS  29  32.074  -3.007 -16.318
  291    HA   CYS  29           HA       CYS  29  34.097  -5.091 -16.230
  292   1HB   CYS  29          2HB       CYS  29  32.898  -6.077 -18.124
  293   2HB   CYS  29          3HB       CYS  29  31.820  -5.796 -16.769
  294    H    LYS  30           HN       LYS  30  33.327  -1.954 -17.591
  295    HA   LYS  30           HA       LYS  30  34.766  -0.585 -18.662
  296   1HB   LYS  30          2HB       LYS  30  36.521  -2.578 -18.116
  297   2HB   LYS  30          3HB       LYS  30  36.473  -2.697 -19.863
  298   1HG   LYS  30          2HG       LYS  30  37.882  -0.924 -19.969
  299   2HG   LYS  30          3HG       LYS  30  36.594   0.085 -19.344
  300   1HD   LYS  30          2HD       LYS  30  37.832  -1.437 -17.173
  301   2HD   LYS  30          3HD       LYS  30  39.053  -0.551 -18.067
  302   1HE   LYS  30          2HE       LYS  30  38.155   1.538 -17.514
  303   2HE   LYS  30          3HE       LYS  30  36.520   0.923 -17.373
  304   1HZ   LYS  30          1HZ       LYS  30  38.017   1.461 -15.299
  305   2HZ   LYS  30          2HZ       LYS  30  36.868   0.302 -15.261
  306   3HZ   LYS  30          3HZ       LYS  30  38.434  -0.107 -15.479
  307    H    GLU  31           HN       GLU  31  32.340  -2.201 -19.529
  308    HA   GLU  31           HA       GLU  31  32.757  -2.611 -22.308
  309   1HB   GLU  31          2HB       GLU  31  30.420  -2.801 -20.411
  310   2HB   GLU  31          3HB       GLU  31  30.091  -2.728 -22.131
  311   1HG   GLU  31          2HG       GLU  31  32.152  -4.677 -21.044
  312   2HG   GLU  31          3HG       GLU  31  30.447  -5.076 -20.999
  313    H    LYS  32           HN       LYS  32  30.707  -1.550 -23.710
  314    HA   LYS  32           HA       LYS  32  30.598   1.291 -23.048
  315   1HB   LYS  32          2HB       LYS  32  32.543   0.684 -24.651
  316   2HB   LYS  32          3HB       LYS  32  31.292   0.409 -25.846
  317   1HG   LYS  32          2HG       LYS  32  30.557   2.677 -25.789
  318   2HG   LYS  32          3HG       LYS  32  31.312   2.982 -24.238
  319   1HD   LYS  32          2HD       LYS  32  32.961   3.947 -25.508
  320   2HD   LYS  32          3HD       LYS  32  33.528   2.299 -25.688
  321   1HE   LYS  32          2HE       LYS  32  32.177   2.077 -27.796
  322   2HE   LYS  32          3HE       LYS  32  31.645   3.737 -27.619
  323   1HZ   LYS  32          1HZ       LYS  32  34.231   4.086 -27.460
  324   2HZ   LYS  32          2HZ       LYS  32  34.240   2.730 -28.371
  325   3HZ   LYS  32          3HZ       LYS  32  33.447   4.058 -28.894
  326    H    GLY  33           HN       GLY  33  28.503   1.881 -23.014
  327   1HA   GLY  33          1HA       GLY  33  26.603   2.046 -24.686
  328   2HA   GLY  33          2HA       GLY  33  26.618   0.294 -24.641
  329    H    HIS  34           HN       HIS  34  27.150  -0.205 -21.893
  330    HA   HIS  34           HA       HIS  34  24.684   0.859 -20.734
  331   1HB   HIS  34          2HB       HIS  34  24.538  -1.150 -19.438
  332   2HB   HIS  34          3HB       HIS  34  24.762  -1.584 -21.122
  333    HD1  HIS  34           HD1      HIS  34  26.593  -3.230 -21.607
  334    HD2  HIS  34           HD2      HIS  34  27.098  -1.337 -17.898
  335    HE1  HIS  34           HE1      HIS  34  28.587  -4.364 -20.493
  336    H    TRP  35           HN       TRP  35  24.708   1.296 -18.365
  337    HA   TRP  35           HA       TRP  35  27.245   2.536 -17.663
  338   1HB   TRP  35          2HB       TRP  35  24.396   2.922 -16.942
  339   2HB   TRP  35          3HB       TRP  35  25.566   3.235 -15.677
  340    HD1  TRP  35           HD1      TRP  35  25.965   4.138 -19.456
  341    HE1  TRP  35           HE1      TRP  35  26.378   6.727 -19.750
  342    HE3  TRP  35           HE3      TRP  35  25.423   5.315 -14.539
  343    HZ2  TRP  35           HZ2      TRP  35  26.431   8.928 -17.933
  344    HZ3  TRP  35           HZ3      TRP  35  25.671   7.707 -13.884
  345    HH2  TRP  35           HH2      TRP  35  26.158   9.485 -15.489
  346    H    ALA  36           HN       ALA  36  27.806   2.337 -15.194
  347    HA   ALA  36           HA       ALA  36  28.421  -0.308 -14.663
  348   1HB   ALA  36          1HB       ALA  36  28.542   2.314 -13.278
  349   2HB   ALA  36          2HB       ALA  36  28.526   0.894 -12.205
  350   3HB   ALA  36          3HB       ALA  36  29.785   1.052 -13.453
  351    H    LYS  37           HN       LYS  37  25.741   1.782 -13.411
  352    HA   LYS  37           HA       LYS  37  24.684  -0.221 -11.738
  353   1HB   LYS  37          2HB       LYS  37  23.213   2.143 -12.929
  354   2HB   LYS  37          3HB       LYS  37  22.825   1.274 -11.458
  355   1HG   LYS  37          2HG       LYS  37  25.587   2.154 -11.317
  356   2HG   LYS  37          3HG       LYS  37  24.585   3.520 -11.766
  357   1HD   LYS  37          2HD       LYS  37  23.061   3.012  -9.826
  358   2HD   LYS  37          3HD       LYS  37  24.113   1.689  -9.365
  359   1HE   LYS  37          2HE       LYS  37  26.014   3.547  -9.398
  360   2HE   LYS  37          3HE       LYS  37  24.671   4.666  -9.274
  361   1HZ   LYS  37          1HZ       LYS  37  24.072   3.812  -7.244
  362   2HZ   LYS  37          2HZ       LYS  37  24.840   2.388  -7.459
  363   3HZ   LYS  37          3HZ       LYS  37  25.701   3.742  -7.158
  364    H    ASP  38           HN       ASP  38  24.890   0.005 -15.125
  365    HA   ASP  38           HA       ASP  38  22.535  -1.697 -15.374
  366   1HB   ASP  38          2HB       ASP  38  22.861   0.611 -16.687
  367   2HB   ASP  38          3HB       ASP  38  23.877  -0.360 -17.733
  368    H    CYS  39           HN       CYS  39  25.629  -2.072 -14.748
  369    HA   CYS  39           HA       CYS  39  26.708  -3.387 -16.987
  370   1HB   CYS  39          2HB       CYS  39  28.053  -2.397 -15.132
  371   2HB   CYS  39          3HB       CYS  39  27.493  -3.670 -14.068
  372    HA   PRO  40           HA       PRO  40  24.348  -7.053 -16.390
  373   1HB   PRO  40          2HB       PRO  40  25.197  -8.390 -18.618
  374   2HB   PRO  40          3HB       PRO  40  23.880  -7.234 -18.637
  375   1HG   PRO  40          2HG       PRO  40  26.646  -6.909 -19.626
  376   2HG   PRO  40          3HG       PRO  40  25.225  -5.956 -20.007
  377   1HD   PRO  40          2HD       PRO  40  27.358  -5.223 -18.234
  378   2HD   PRO  40          3HD       PRO  40  25.882  -4.324 -18.527
  379    H    LYS  41           HN       LYS  41  27.517  -6.561 -15.888
  380    HA   LYS  41           HA       LYS  41  28.131  -9.377 -15.519
  381   1HB   LYS  41          2HB       LYS  41  29.622  -7.070 -16.208
  382   2HB   LYS  41          3HB       LYS  41  30.195  -7.566 -14.628
  383   1HG   LYS  41          2HG       LYS  41  29.930  -9.999 -16.005
  384   2HG   LYS  41          3HG       LYS  41  30.516  -8.904 -17.239
  385   1HD   LYS  41          2HD       LYS  41  32.597  -9.208 -16.385
  386   2HD   LYS  41          3HD       LYS  41  32.090  -8.252 -15.007
  387   1HE   LYS  41          2HE       LYS  41  33.005 -10.412 -14.240
  388   2HE   LYS  41          3HE       LYS  41  31.299 -10.313 -13.847
  389   1HZ   LYS  41          1HZ       LYS  41  31.467 -11.385 -16.372
  390   2HZ   LYS  41          2HZ       LYS  41  32.595 -12.163 -15.485
  391   3HZ   LYS  41          3HZ       LYS  41  31.037 -12.153 -14.997
  392    H    LYS  42           HN       LYS  42  26.753  -6.728 -13.809
  393    HA   LYS  42           HA       LYS  42  27.514  -7.936 -11.248
  394   1HB   LYS  42          2HB       LYS  42  27.119  -5.847 -10.228
  395   2HB   LYS  42          3HB       LYS  42  28.023  -5.496 -11.686
  396   1HG   LYS  42          2HG       LYS  42  26.274  -4.370 -12.660
  397   2HG   LYS  42          3HG       LYS  42  25.083  -5.524 -12.097
  398   1HD   LYS  42          2HD       LYS  42  24.455  -4.035 -10.510
  399   2HD   LYS  42          3HD       LYS  42  26.016  -4.247  -9.743
  400   1HE   LYS  42          2HE       LYS  42  26.897  -2.501 -11.481
  401   2HE   LYS  42          3HE       LYS  42  25.210  -2.141 -11.787
  402   1HZ   LYS  42          1HZ       LYS  42  26.405  -0.837 -10.000
  403   2HZ   LYS  42          2HZ       LYS  42  24.920  -1.410  -9.633
  404   3HZ   LYS  42          3HZ       LYS  42  26.251  -2.162  -9.057
  405    HA   PRO  43           HA       PRO  43  23.465  -9.334 -10.735
  406   1HB   PRO  43          2HB       PRO  43  23.236  -9.423  -8.012
  407   2HB   PRO  43          3HB       PRO  43  24.063 -10.654  -8.945
  408   1HG   PRO  43          2HG       PRO  43  25.219  -8.514  -7.266
  409   2HG   PRO  43          3HG       PRO  43  25.977  -9.982  -7.850
  410   1HD   PRO  43          2HD       PRO  43  26.355  -7.331  -8.876
  411   2HD   PRO  43          3HD       PRO  43  27.021  -8.813  -9.531
  412    H    ARG  44           HN       ARG  44  21.251  -8.947  -9.801
  413    HA   ARG  44           HA       ARG  44  20.333  -6.608 -10.555
  414   1HB   ARG  44          2HB       ARG  44  18.466  -6.911  -8.860
  415   2HB   ARG  44          3HB       ARG  44  18.829  -8.359  -9.777
  416   1HG   ARG  44          2HG       ARG  44  20.446  -8.101  -7.302
  417   2HG   ARG  44          3HG       ARG  44  18.723  -8.196  -6.999
  418   1HD   ARG  44          2HD       ARG  44  18.530 -10.351  -7.929
  419   2HD   ARG  44          3HD       ARG  44  19.926 -10.147  -8.969
  420    HE   ARG  44           HE       ARG  44  21.071 -10.032  -6.481
  421   1HH1  ARG  44          2HH2      ARG  44  18.811 -12.303  -7.932
  422   2HH1  ARG  44          1HH2      ARG  44  19.359 -13.650  -6.991
  423   1HH2  ARG  44          2HH1      ARG  44  21.796 -11.807  -5.238
  424   2HH2  ARG  44          1HH1      ARG  44  21.070 -13.365  -5.448
  425    H    GLY  45           HN       GLY  45  19.944  -4.490  -9.661
  426   1HA   GLY  45          1HA       GLY  45  20.765  -3.847  -6.983
  427   2HA   GLY  45          2HA       GLY  45  21.910  -3.304  -8.192
  428    HA   PRO  46           HA       PRO  46  22.123  -1.711  -6.998
  429   1HB   PRO  46          2HB       PRO  46  21.777   0.424  -5.327
  430   2HB   PRO  46          3HB       PRO  46  22.496   0.560  -6.919
  431   1HG   PRO  46          2HG       PRO  46  19.790   1.355  -6.032
  432   2HG   PRO  46          3HG       PRO  46  20.667   1.854  -7.465
  433   1HD   PRO  46          2HD       PRO  46  18.527  -0.050  -7.341
  434   2HD   PRO  46          3HD       PRO  46  19.480   0.363  -8.751
  435    H    ARG  47           HN       ARG  47  22.737  -1.596  -4.500
  436    HA   ARG  47           HA       ARG  47  22.580  -2.854  -2.726
  437   1HB   ARG  47          2HB       ARG  47  20.105  -1.184  -2.828
  438   2HB   ARG  47          3HB       ARG  47  20.040  -2.506  -1.679
  439   1HG   ARG  47          2HG       ARG  47  22.451  -1.644  -0.966
  440   2HG   ARG  47          3HG       ARG  47  21.955  -0.159  -1.754
  441   1HD   ARG  47          2HD       ARG  47  19.743  -0.977  -0.130
  442   2HD   ARG  47          3HD       ARG  47  21.175  -1.181   0.858
  443    HE   ARG  47           HE       ARG  47  21.578   1.304  -0.273
  444   1HH1  ARG  47          2HH2      ARG  47  18.895  -0.133   1.493
  445   2HH1  ARG  47          1HH2      ARG  47  18.359   1.373   2.158
  446   1HH2  ARG  47          2HH1      ARG  47  20.872   3.292   0.605
  447   2HH2  ARG  47          1HH1      ARG  47  19.491   3.335   1.651
  448    H    GLY  48           HN       GLY  48  22.715  -5.006  -3.590
  449   1HA   GLY  48          1HA       GLY  48  20.114  -6.374  -3.938
  450   2HA   GLY  48          2HA       GLY  48  21.579  -6.779  -4.809
  451    HA   PRO  49           HA       PRO  49  21.683  -8.421  -0.335
  452   1HB   PRO  49          2HB       PRO  49  19.288  -9.421   0.520
  453   2HB   PRO  49          3HB       PRO  49  19.886  -7.840   0.981
  454   1HG   PRO  49          2HG       PRO  49  17.762  -8.526  -0.957
  455   2HG   PRO  49          3HG       PRO  49  18.080  -6.991  -0.175
  456   1HD   PRO  49          2HD       PRO  49  18.713  -7.703  -2.880
  457   2HD   PRO  49          3HD       PRO  49  19.135  -6.210  -2.063
  458    H    ARG  50           HN       ARG  50  21.469 -10.733   0.603
  459    HA   ARG  50           HA       ARG  50  21.411 -12.417  -1.770
  460   1HB   ARG  50          2HB       ARG  50  23.066 -12.583   0.788
  461   2HB   ARG  50          3HB       ARG  50  22.925 -13.947  -0.301
  462   1HG   ARG  50          2HG       ARG  50  23.941 -12.717  -2.128
  463   2HG   ARG  50          3HG       ARG  50  23.812 -11.196  -1.267
  464   1HD   ARG  50          2HD       ARG  50  25.412 -12.055   0.471
  465   2HD   ARG  50          3HD       ARG  50  25.553 -13.561  -0.413
  466    HE   ARG  50           HE       ARG  50  26.714 -10.962  -1.177
  467   1HH1  ARG  50          2HH2      ARG  50  25.889 -14.220  -2.219
  468   2HH1  ARG  50          1HH2      ARG  50  27.003 -14.216  -3.544
  469   1HH2  ARG  50          2HH1      ARG  50  28.186 -10.957  -2.925
  470   2HH2  ARG  50          1HH1      ARG  50  28.320 -12.347  -3.948
  471    HA   PRO  51           HA       PRO  51  18.302 -14.726   0.239
  472   1HB   PRO  51          2HB       PRO  51  18.498 -17.134  -1.038
  473   2HB   PRO  51          3HB       PRO  51  17.676 -15.748  -1.727
  474   1HG   PRO  51          2HG       PRO  51  20.320 -16.871  -2.427
  475   2HG   PRO  51          3HG       PRO  51  19.308 -15.784  -3.357
  476   1HD   PRO  51          2HD       PRO  51  21.657 -15.088  -1.865
  477   2HD   PRO  51          3HD       PRO  51  20.579 -13.985  -2.698
  478    H    GLN  52           HN       GLN  52  17.758 -16.818   1.447
  479    HA   GLN  52           HA       GLN  52  19.995 -17.148   3.225
  480   1HB   GLN  52          2HB       GLN  52  18.358 -18.274   4.701
  481   2HB   GLN  52          3HB       GLN  52  17.768 -16.708   4.183
  482   1HG   GLN  52          2HG       GLN  52  16.026 -17.609   2.998
  483   2HG   GLN  52          3HG       GLN  52  17.013 -18.897   2.335
  484   1HE2  GLN  52          1HE2      GLN  52  14.892 -19.986   2.799
  485   2HE2  GLN  52          2HE2      GLN  52  14.703 -20.773   4.331
  486    H    THR  53           HN       THR  53  20.999 -18.259   1.108
  487    HA   THR  53           HA       THR  53  20.474 -21.142   1.399
  488    HB   THR  53           HB       THR  53  20.983 -19.470  -1.115
  489    HG1  THR  53           HG1      THR  53  18.775 -19.629  -0.333
  490   1HG2  THR  53          1HG2      THR  53  21.533 -22.311  -0.561
  491   2HG2  THR  53          2HG2      THR  53  20.275 -22.117  -1.804
  492   3HG2  THR  53          3HG2      THR  53  21.874 -21.370  -2.034
  493    H    SER  54           HN       SER  54  22.168 -20.536   3.176
  494    HA   SER  54           HA       SER  54  24.793 -20.276   2.021
  495   1HB   SER  54          2HB       SER  54  24.375 -18.951   4.003
  496   2HB   SER  54          3HB       SER  54  23.757 -20.335   4.882
  497    HG   SER  54           HG       SER  54  26.481 -19.822   4.071
  498    H    LEU  55           HN       LEU  55  22.862 -22.572   4.061
  499    HA   LEU  55           HA       LEU  55  23.354 -24.656   4.736
  500   1HB   LEU  55          2HB       LEU  55  23.115 -26.194   3.000
  501   2HB   LEU  55          3HB       LEU  55  22.257 -24.755   2.484
  502    HG   LEU  55           HG       LEU  55  24.915 -24.546   1.483
  503   1HD1  LEU  55          1HD1      LEU  55  25.302 -26.520   0.266
  504   2HD1  LEU  55          2HD1      LEU  55  24.910 -27.056   1.917
  505   3HD1  LEU  55          3HD1      LEU  55  23.684 -27.167   0.630
  506   1HD2  LEU  55          1HD2      LEU  55  22.754 -23.626   0.567
  507   2HD2  LEU  55          2HD2      LEU  55  23.845 -24.364  -0.630
  508   3HD2  LEU  55          3HD2      LEU  55  22.413 -25.256  -0.062
  509    H    LEU  56           HN       LEU  56  25.407 -23.535   5.745
  510    HA   LEU  56           HA       LEU  56  27.714 -25.025   4.707
  511   1HB   LEU  56          2HB       LEU  56  27.391 -22.222   4.844
  512   2HB   LEU  56          3HB       LEU  56  28.504 -22.656   6.126
  513    HG   LEU  56           HG       LEU  56  29.003 -23.842   3.435
  514   1HD1  LEU  56          1HD1      LEU  56  29.146 -21.930   2.323
  515   2HD1  LEU  56          2HD1      LEU  56  28.651 -21.022   3.772
  516   3HD1  LEU  56          3HD1      LEU  56  30.373 -21.360   3.479
  517   1HD2  LEU  56          1HD2      LEU  56  30.454 -24.444   5.269
  518   2HD2  LEU  56          2HD2      LEU  56  31.354 -23.450   4.098
  519   3HD2  LEU  56          3HD2      LEU  56  30.780 -22.730   5.621
  Start of MODEL   16
    1   1H5*    C 504          1H5*        C 504  32.467  -6.251  -1.869
    2   2H5*    C 504          2H5*        C 504  33.896  -5.500  -2.580
    3    H4*    C 504           H4*        C 504  34.432  -7.770  -2.219
    4    H3*    C 504           H3*        C 504  33.755  -7.398  -5.159
    5    H2*    C 504           H2*        C 504  34.709  -9.493  -5.485
    6   2HO*    C 504          2HO*        C 504  35.915  -9.088  -2.902
    7    H1*    C 504           H1*        C 504  34.001 -10.232  -2.703
    8   1H4     C 504          1H4         C 504  31.020 -14.784  -5.996
    9   2H4     C 504          2H4         C 504  30.197 -13.584  -6.967
   10    H5     C 504           H5         C 504  30.553 -11.258  -6.767
   11    H6     C 504           H6         C 504  31.800  -9.493  -5.571
   12   1H5*    C 505          1H5*        C 505  37.091  -8.842  -5.955
   13   2H5*    C 505          2H5*        C 505  38.141  -7.554  -6.545
   14    H4*    C 505           H4*        C 505  38.411  -9.093  -8.204
   15    H3*    C 505           H3*        C 505  36.151  -7.298  -9.020
   16    H2*    C 505           H2*        C 505  35.845  -8.527 -11.022
   17   2HO*    C 505          2HO*        C 505  37.801 -10.420 -10.586
   18    H1*    C 505           H1*        C 505  36.022 -11.021  -9.663
   19   1H4     C 505          1H4         C 505  29.781 -10.082 -10.678
   20   2H4     C 505          2H4         C 505  29.720  -9.087  -9.240
   21    H5     C 505           H5         C 505  31.622  -8.476  -7.981
   22    H6     C 505           H6         C 505  34.076  -8.672  -7.790
   23   1H5*    U 506          1H5*        U 506  39.241  -2.872  -9.630
   24   2H5*    U 506          2H5*        U 506  37.994  -3.582  -8.604
   25    H4*    U 506           H4*        U 506  37.511  -2.235 -10.900
   26    H3*    U 506           H3*        U 506  35.878  -4.405  -9.570
   27    H2*    U 506           H2*        U 506  34.287  -4.177 -11.253
   28   2HO*    U 506          2HO*        U 506  35.629  -1.707 -11.878
   29    H1*    U 506           H1*        U 506  36.396  -3.381 -13.160
   30    H3     U 506           H3         U 506  35.806  -6.853 -15.937
   31    H5     U 506           H5         U 506  33.942  -8.158 -12.420
   32    H6     U 506           H6         U 506  34.729  -6.095 -11.354
   33   1H5*    C 507          1H5*        C 507  34.655   0.158 -10.703
   34   2H5*    C 507          2H5*        C 507  34.263   0.398  -9.001
   35    H4*    C 507           H4*        C 507  33.054   1.636 -11.140
   36    H3*    C 507           H3*        C 507  32.364   1.361  -8.245
   37    H2*    C 507           H2*        C 507  30.215   2.308  -8.591
   38   2HO*    C 507          2HO*        C 507  30.989   3.829 -10.132
   39    H1*    C 507           H1*        C 507  29.607   0.662 -10.757
   40   1H4     C 507          1H4         C 507  27.286  -2.325  -5.589
   41   2H4     C 507          2H4         C 507  28.799  -3.194  -5.464
   42    H5     C 507           H5         C 507  30.685  -2.752  -6.814
   43    H6     C 507           H6         C 507  31.594  -1.353  -8.634
   44   1H5*    C 508          1H5*        C 508  35.419   5.087  -6.775
   45   2H5*    C 508          2H5*        C 508  34.152   6.199  -7.294
   46    H4*    C 508           H4*        C 508  36.225   7.369  -7.331
   47    H3*    C 508           H3*        C 508  34.943   6.816  -9.944
   48    H2*    C 508           H2*        C 508  36.779   7.593 -11.212
   49   2HO*    C 508          2HO*        C 508  37.973   8.259  -8.683
   50    H1*    C 508           H1*        C 508  38.700   6.133  -9.981
   51   1H4     C 508          1H4         C 508  35.616   0.997 -12.555
   52   2H4     C 508          2H4         C 508  35.350   2.107 -13.880
   53    H5     C 508           H5         C 508  35.846   4.414 -13.786
   54    H6     C 508           H6         C 508  36.728   6.243 -12.381
   55   1H5*    G 509          1H5*        G 509  32.868  11.460 -10.685
   56   2H5*    G 509          2H5*        G 509  31.797  10.799  -9.449
   57    H4*    G 509           H4*        G 509  31.136  11.214 -12.066
   58    H3*    G 509           H3*        G 509  29.932   9.348 -10.012
   59    H2*    G 509           H2*        G 509  28.383   8.660 -11.611
   60   2HO*    G 509          2HO*        G 509  29.254  11.058 -12.950
   61    H1*    G 509           H1*        G 509  30.361   9.110 -13.749
   62    H8     G 509           H8         G 509  29.778   6.631 -10.868
   63    H1     G 509           H1         G 509  30.045   4.040 -16.791
   64   1H2     G 509          1H2         G 509  30.389   5.526 -18.179
   65   2H2     G 509          2H2         G 509  30.578   7.222 -17.793
   66   1H5*    U 510          1H5*        U 510  27.414  14.104 -10.620
   67   2H5*    U 510          2H5*        U 510  27.179  13.642  -8.934
   68    H4*    U 510           H4*        U 510  25.280  14.878  -9.447
   69    H3*    U 510           H3*        U 510  24.700  11.938  -9.607
   70    H2*    U 510           H2*        U 510  22.438  12.382 -10.145
   71   2HO*    U 510          2HO*        U 510  21.785  14.145  -9.063
   72    H1*    U 510           H1*        U 510  23.197  14.443 -11.991
   73    H3     U 510           H3         U 510  21.463  11.806 -15.153
   74    H5     U 510           H5         U 510  24.164   9.242 -13.240
   75    H6     U 510           H6         U 510  24.639  11.070 -11.675
   76   1H    ALA   1           HN       ALA   1  62.153  -0.910 -50.612
   77    HA   ALA   1           HA       ALA   1  60.463  -3.243 -50.025
   78   1HB   ALA   1          1HB       ALA   1  60.033  -1.166 -48.137
   79   2HB   ALA   1          2HB       ALA   1  60.854  -2.723 -47.876
   80   3HB   ALA   1          3HB       ALA   1  61.794  -1.291 -48.358
   81    H    THR   2           HN       THR   2  58.116  -2.699 -49.633
   82    HA   THR   2           HA       THR   2  57.239  -0.264 -50.977
   83    HB   THR   2           HB       THR   2  55.749  -1.610 -52.471
   84    HG1  THR   2           HG1      THR   2  56.360  -3.993 -52.407
   85   1HG2  THR   2          1HG2      THR   2  58.676  -2.515 -52.562
   86   2HG2  THR   2          2HG2      THR   2  57.498  -2.749 -53.876
   87   3HG2  THR   2          3HG2      THR   2  57.998  -1.105 -53.409
   88    H    VAL   3           HN       VAL   3  56.610   0.459 -48.899
   89    HA   VAL   3           HA       VAL   3  54.064  -0.683 -48.113
   90    HB   VAL   3           HB       VAL   3  55.731  -1.908 -46.796
   91   1HG1  VAL   3          1HG1      VAL   3  57.618  -0.787 -46.297
   92   2HG1  VAL   3          2HG1      VAL   3  56.818   0.799 -46.396
   93   3HG1  VAL   3          3HG1      VAL   3  56.702  -0.166 -44.903
   94   1HG2  VAL   3          1HG2      VAL   3  53.621  -0.199 -45.673
   95   2HG2  VAL   3          2HG2      VAL   3  53.948  -1.933 -45.430
   96   3HG2  VAL   3          3HG2      VAL   3  54.833  -0.718 -44.476
   97    H    VAL   4           HN       VAL   4  53.978   1.509 -49.484
   98    HA   VAL   4           HA       VAL   4  54.553   3.842 -47.914
   99    HB   VAL   4           HB       VAL   4  54.769   3.713 -50.381
  100   1HG1  VAL   4          1HG1      VAL   4  52.227   2.560 -50.276
  101   2HG1  VAL   4          2HG1      VAL   4  51.956   4.172 -50.981
  102   3HG1  VAL   4          3HG1      VAL   4  53.117   3.056 -51.736
  103   1HG2  VAL   4          1HG2      VAL   4  53.945   5.921 -50.817
  104   2HG2  VAL   4          2HG2      VAL   4  52.724   5.784 -49.529
  105   3HG2  VAL   4          3HG2      VAL   4  54.453   5.863 -49.111
  106    H    SER   5           HN       SER   5  53.206   4.885 -46.518
  107    HA   SER   5           HA       SER   5  50.458   4.912 -46.805
  108   1HB   SER   5          2HB       SER   5  49.688   3.458 -45.027
  109   2HB   SER   5          3HB       SER   5  50.679   2.502 -46.111
  110    HG   SER   5           HG       SER   5  51.256   2.056 -43.926
  111    H    GLY   6           HN       GLY   6  49.461   6.295 -45.163
  112   1HA   GLY   6          1HA       GLY   6  51.472   7.674 -43.488
  113   2HA   GLY   6          2HA       GLY   6  50.081   8.436 -44.233
  114    H    GLN   7           HN       GLN   7  51.101   7.853 -41.298
  115    HA   GLN   7           HA       GLN   7  48.442   7.355 -40.330
  116   1HB   GLN   7          2HB       GLN   7  50.771   5.496 -39.849
  117   2HB   GLN   7          3HB       GLN   7  49.601   5.728 -38.565
  118   1HG   GLN   7          2HG       GLN   7  48.248   4.229 -39.592
  119   2HG   GLN   7          3HG       GLN   7  48.040   5.370 -40.905
  120   1HE2  GLN   7          1HE2      GLN   7  47.856   2.773 -41.470
  121   2HE2  GLN   7          2HE2      GLN   7  49.224   2.193 -42.362
  122    H    LYS   8           HN       LYS   8  48.146   8.097 -38.096
  123    HA   LYS   8           HA       LYS   8  50.421   9.384 -36.857
  124   1HB   LYS   8          2HB       LYS   8  49.486  11.584 -36.804
  125   2HB   LYS   8          3HB       LYS   8  49.553  11.065 -38.475
  126   1HG   LYS   8          2HG       LYS   8  47.021  10.473 -36.961
  127   2HG   LYS   8          3HG       LYS   8  47.324  12.147 -37.380
  128   1HD   LYS   8          2HD       LYS   8  47.771  11.313 -39.792
  129   2HD   LYS   8          3HD       LYS   8  47.108   9.773 -39.280
  130   1HE   LYS   8          2HE       LYS   8  45.236  10.924 -40.193
  131   2HE   LYS   8          3HE       LYS   8  45.036  11.108 -38.462
  132   1HZ   LYS   8          1HZ       LYS   8  46.541  13.217 -39.076
  133   2HZ   LYS   8          2HZ       LYS   8  45.636  13.089 -40.430
  134   3HZ   LYS   8          3HZ       LYS   8  44.912  13.251 -38.976
  135    H    GLN   9           HN       GLN   9  49.697  10.339 -34.656
  136    HA   GLN   9           HA       GLN   9  47.281   9.191 -33.655
  137   1HB   GLN   9          2HB       GLN   9  49.125   7.363 -33.564
  138   2HB   GLN   9          3HB       GLN   9  49.870   8.336 -32.311
  139   1HG   GLN   9          2HG       GLN   9  48.515   6.897 -31.045
  140   2HG   GLN   9          3HG       GLN   9  47.487   8.309 -31.188
  141   1HE2  GLN   9          1HE2      GLN   9  47.326   5.155 -31.149
  142   2HE2  GLN   9          2HE2      GLN   9  46.070   4.806 -32.290
  143    H    ASP  10           HN       ASP  10  46.578  10.225 -31.718
  144    HA   ASP  10           HA       ASP  10  48.439  12.070 -30.517
  145   1HB   ASP  10          2HB       ASP  10  46.446  12.896 -32.395
  146   2HB   ASP  10          3HB       ASP  10  45.845  13.369 -30.819
  147    H    ARG  11           HN       ARG  11  48.246  11.518 -28.341
  148    HA   ARG  11           HA       ARG  11  45.635  11.485 -27.203
  149   1HB   ARG  11          2HB       ARG  11  47.127   8.984 -27.747
  150   2HB   ARG  11          3HB       ARG  11  46.685   9.145 -26.059
  151   1HG   ARG  11          2HG       ARG  11  44.447   9.932 -27.770
  152   2HG   ARG  11          3HG       ARG  11  45.008   8.330 -28.207
  153   1HD   ARG  11          2HD       ARG  11  45.029   8.079 -25.482
  154   2HD   ARG  11          3HD       ARG  11  43.757   9.272 -25.649
  155    HE   ARG  11           HE       ARG  11  43.658   6.473 -26.530
  156   1HH1  ARG  11          2HH2      ARG  11  42.246   9.676 -26.885
  157   2HH1  ARG  11          1HH2      ARG  11  40.734   9.083 -27.490
  158   1HH2  ARG  11          2HH1      ARG  11  41.665   5.689 -27.327
  159   2HH2  ARG  11          1HH1      ARG  11  40.402   6.800 -27.743
  160    H    GLN  12           HN       GLN  12  46.651  13.384 -26.162
  161    HA   GLN  12           HA       GLN  12  48.327  12.534 -23.948
  162   1HB   GLN  12          2HB       GLN  12  48.937  14.640 -26.004
  163   2HB   GLN  12          3HB       GLN  12  49.383  14.988 -24.345
  164   1HG   GLN  12          2HG       GLN  12  50.130  12.344 -25.654
  165   2HG   GLN  12          3HG       GLN  12  51.129  13.769 -25.857
  166   1HE2  GLN  12          1HE2      GLN  12  51.775  14.922 -23.860
  167   2HE2  GLN  12          2HE2      GLN  12  52.193  13.994 -22.459
  168    H    GLY  13           HN       GLY  13  47.148  12.942 -22.132
  169   1HA   GLY  13          1HA       GLY  13  45.475  15.384 -22.123
  170   2HA   GLY  13          2HA       GLY  13  45.040  13.881 -21.334
  171    H    GLY  14           HN       GLY  14  44.981  16.003 -19.691
  172   1HA   GLY  14          1HA       GLY  14  47.170  17.059 -18.507
  173   2HA   GLY  14          2HA       GLY  14  45.717  16.600 -17.640
  174    H    GLU  15           HN       GLU  15  45.613  14.581 -16.495
  175    HA   GLU  15           HA       GLU  15  47.685  12.712 -16.667
  176   1HB   GLU  15          2HB       GLU  15  48.774  13.055 -14.493
  177   2HB   GLU  15          3HB       GLU  15  48.971  14.481 -15.494
  178   1HG   GLU  15          2HG       GLU  15  47.868  15.782 -13.994
  179   2HG   GLU  15          3HG       GLU  15  46.496  14.691 -13.966
  180    H    ARG  16           HN       ARG  16  47.228  10.814 -15.361
  181    HA   ARG  16           HA       ARG  16  45.950   9.394 -14.356
  182   1HB   ARG  16          2HB       ARG  16  45.878  11.662 -12.677
  183   2HB   ARG  16          3HB       ARG  16  44.193  11.202 -12.821
  184   1HG   ARG  16          2HG       ARG  16  44.753   8.871 -12.141
  185   2HG   ARG  16          3HG       ARG  16  46.451   9.295 -12.043
  186   1HD   ARG  16          2HD       ARG  16  45.842  11.052 -10.298
  187   2HD   ARG  16          3HD       ARG  16  44.198  10.445 -10.327
  188    HE   ARG  16           HE       ARG  16  46.506   9.159  -9.082
  189   1HH1  ARG  16          2HH2      ARG  16  43.334   8.586 -10.495
  190   2HH1  ARG  16          1HH2      ARG  16  43.078   7.104  -9.634
  191   1HH2  ARG  16          2HH1      ARG  16  46.168   7.205  -7.947
  192   2HH2  ARG  16          1HH1      ARG  16  44.701   6.314  -8.176
  193    H    ARG  17           HN       ARG  17  44.607   8.494 -15.927
  194    HA   ARG  17           HA       ARG  17  42.334  10.065 -16.759
  195   1HB   ARG  17          2HB       ARG  17  44.071   8.144 -18.027
  196   2HB   ARG  17          3HB       ARG  17  42.456   7.465 -18.044
  197   1HG   ARG  17          2HG       ARG  17  41.992   8.797 -19.820
  198   2HG   ARG  17          3HG       ARG  17  42.062  10.173 -18.737
  199   1HD   ARG  17          2HD       ARG  17  44.456  10.488 -19.187
  200   2HD   ARG  17          3HD       ARG  17  44.529   8.997 -20.103
  201    HE   ARG  17           HE       ARG  17  42.518  10.723 -21.232
  202   1HH1  ARG  17          2HH2      ARG  17  46.009  10.365 -20.989
  203   2HH1  ARG  17          1HH2      ARG  17  46.327  11.203 -22.471
  204   1HH2  ARG  17          2HH1      ARG  17  42.935  11.827 -23.188
  205   2HH2  ARG  17          1HH1      ARG  17  44.567  12.040 -23.730
  206    H    ARG  18           HN       ARG  18  40.157   8.914 -16.948
  207    HA   ARG  18           HA       ARG  18  39.739   7.454 -14.525
  208   1HB   ARG  18          2HB       ARG  18  38.027   8.874 -16.549
  209   2HB   ARG  18          3HB       ARG  18  37.259   7.564 -15.673
  210   1HG   ARG  18          2HG       ARG  18  37.844   8.606 -13.512
  211   2HG   ARG  18          3HG       ARG  18  38.752   9.864 -14.327
  212   1HD   ARG  18          2HD       ARG  18  35.903   9.527 -15.205
  213   2HD   ARG  18          3HD       ARG  18  36.137  10.147 -13.582
  214    HE   ARG  18           HE       ARG  18  37.800  11.477 -15.608
  215   1HH1  ARG  18          2HH2      ARG  18  34.702  11.480 -13.938
  216   2HH1  ARG  18          1HH2      ARG  18  34.392  13.155 -14.249
  217   1HH2  ARG  18          2HH1      ARG  18  37.391  13.686 -16.019
  218   2HH2  ARG  18          1HH1      ARG  18  35.932  14.419 -15.441
  219    H    SER  19           HN       SER  19  41.299   5.862 -16.122
  220    HA   SER  19           HA       SER  19  41.452   4.020 -17.288
  221   1HB   SER  19          2HB       SER  19  39.854   2.172 -16.536
  222   2HB   SER  19          3HB       SER  19  40.735   2.984 -15.257
  223    HG   SER  19           HG       SER  19  38.012   3.560 -16.067
  224    H    GLN  20           HN       GLN  20  40.620   5.687 -19.117
  225    HA   GLN  20           HA       GLN  20  39.272   6.163 -20.794
  226   1HB   GLN  20          2HB       GLN  20  40.546   3.777 -21.175
  227   2HB   GLN  20          3HB       GLN  20  38.890   3.269 -21.432
  228   1HG   GLN  20          2HG       GLN  20  38.815   4.279 -23.466
  229   2HG   GLN  20          3HG       GLN  20  39.357   5.805 -22.794
  230   1HE2  GLN  20          1HE2      GLN  20  40.071   4.735 -25.310
  231   2HE2  GLN  20          2HE2      GLN  20  41.781   4.462 -25.347
  232    H    LEU  21           HN       LEU  21  37.730   6.192 -18.455
  233    HA   LEU  21           HA       LEU  21  35.333   4.664 -19.090
  234   1HB   LEU  21          2HB       LEU  21  36.288   4.622 -16.808
  235   2HB   LEU  21          3HB       LEU  21  36.009   6.348 -16.675
  236    HG   LEU  21           HG       LEU  21  34.297   4.381 -15.835
  237   1HD1  LEU  21          1HD1      LEU  21  32.579   6.439 -16.052
  238   2HD1  LEU  21          2HD1      LEU  21  33.878   6.366 -14.839
  239   3HD1  LEU  21          3HD1      LEU  21  34.111   7.299 -16.336
  240   1HD2  LEU  21          1HD2      LEU  21  32.331   4.401 -17.271
  241   2HD2  LEU  21          2HD2      LEU  21  33.188   5.410 -18.461
  242   3HD2  LEU  21          3HD2      LEU  21  33.741   3.749 -18.142
  243    H    ASP  22           HN       ASP  22  34.223   5.632 -20.743
  244    HA   ASP  22           HA       ASP  22  34.161   8.469 -20.902
  245   1HB   ASP  22          2HB       ASP  22  32.485   6.420 -22.424
  246   2HB   ASP  22          3HB       ASP  22  32.756   8.087 -22.892
  247    H    ARG  23           HN       ARG  23  31.847   9.540 -21.218
  248    HA   ARG  23           HA       ARG  23  30.423   9.067 -18.861
  249   1HB   ARG  23          2HB       ARG  23  30.186  10.888 -21.240
  250   2HB   ARG  23          3HB       ARG  23  28.721  10.650 -20.306
  251   1HG   ARG  23          2HG       ARG  23  31.410  11.622 -19.230
  252   2HG   ARG  23          3HG       ARG  23  29.964  12.591 -19.435
  253   1HD   ARG  23          2HD       ARG  23  29.099  10.400 -17.875
  254   2HD   ARG  23          3HD       ARG  23  30.687  10.776 -17.236
  255    HE   ARG  23           HE       ARG  23  29.420  13.260 -17.515
  256   1HH1  ARG  23          2HH2      ARG  23  28.774  10.271 -15.774
  257   2HH1  ARG  23          1HH2      ARG  23  27.920  11.055 -14.487
  258   1HH2  ARG  23          2HH1      ARG  23  28.292  14.295 -15.818
  259   2HH2  ARG  23          1HH1      ARG  23  27.644  13.359 -14.512
  260    H    ASP  24           HN       ASP  24  30.513   7.301 -21.703
  261    HA   ASP  24           HA       ASP  24  27.779   6.401 -21.269
  262   1HB   ASP  24          2HB       ASP  24  27.896   5.771 -23.802
  263   2HB   ASP  24          3HB       ASP  24  27.583   7.440 -23.373
  264    H    GLN  25           HN       GLN  25  30.636   5.591 -20.374
  265    HA   GLN  25           HA       GLN  25  30.620   2.926 -21.562
  266   1HB   GLN  25          2HB       GLN  25  32.673   4.509 -21.889
  267   2HB   GLN  25          3HB       GLN  25  33.026   4.185 -20.204
  268   1HG   GLN  25          2HG       GLN  25  33.154   1.764 -20.638
  269   2HG   GLN  25          3HG       GLN  25  32.629   1.994 -22.294
  270   1HE2  GLN  25          1HE2      GLN  25  33.964   3.496 -23.628
  271   2HE2  GLN  25          2HE2      GLN  25  35.688   3.424 -23.471
  272    H    CYS  26           HN       CYS  26  31.042   1.099 -20.115
  273    HA   CYS  26           HA       CYS  26  29.846   1.528 -17.563
  274   1HB   CYS  26          2HB       CYS  26  29.320  -0.477 -18.864
  275   2HB   CYS  26          3HB       CYS  26  31.000  -0.978 -18.833
  276    H    ALA  27           HN       ALA  27  30.916   1.761 -15.599
  277    HA   ALA  27           HA       ALA  27  33.837   1.736 -15.737
  278   1HB   ALA  27          1HB       ALA  27  32.460   3.773 -14.982
  279   2HB   ALA  27          2HB       ALA  27  32.087   2.835 -13.516
  280   3HB   ALA  27          3HB       ALA  27  33.774   3.247 -13.901
  281    H    TYR  28           HN       TYR  28  32.267  -0.758 -15.694
  282    HA   TYR  28           HA       TYR  28  33.192  -1.755 -13.085
  283   1HB   TYR  28          2HB       TYR  28  30.604  -1.465 -13.616
  284   2HB   TYR  28          3HB       TYR  28  30.826  -2.771 -14.762
  285    HD1  TYR  28           HD1      TYR  28  30.833  -1.877 -11.177
  286    HD2  TYR  28           HD2      TYR  28  31.101  -5.060 -14.023
  287    HE1  TYR  28           HE1      TYR  28  30.480  -3.576  -9.320
  288    HE2  TYR  28           HE2      TYR  28  30.747  -6.748 -12.156
  289    HH   TYR  28           HH       TYR  28  30.995  -6.928  -9.823
  290    H    CYS  29           HN       CYS  29  31.977  -2.946 -16.305
  291    HA   CYS  29           HA       CYS  29  33.976  -5.039 -16.164
  292   1HB   CYS  29          2HB       CYS  29  32.797  -5.990 -18.114
  293   2HB   CYS  29          3HB       CYS  29  31.731  -5.743 -16.746
  294    H    LYS  30           HN       LYS  30  33.165  -1.981 -17.773
  295    HA   LYS  30           HA       LYS  30  34.696  -0.632 -18.787
  296   1HB   LYS  30          2HB       LYS  30  36.470  -2.437 -18.065
  297   2HB   LYS  30          3HB       LYS  30  36.366  -2.942 -19.740
  298   1HG   LYS  30          2HG       LYS  30  37.518  -1.117 -20.474
  299   2HG   LYS  30          3HG       LYS  30  36.547  -0.015 -19.517
  300   1HD   LYS  30          2HD       LYS  30  38.752  -1.749 -18.313
  301   2HD   LYS  30          3HD       LYS  30  39.041  -0.127 -18.910
  302   1HE   LYS  30          2HE       LYS  30  38.401   0.654 -16.876
  303   2HE   LYS  30          3HE       LYS  30  36.766   0.156 -17.264
  304   1HZ   LYS  30          1HZ       LYS  30  37.497  -2.097 -16.443
  305   2HZ   LYS  30          2HZ       LYS  30  38.798  -1.350 -15.796
  306   3HZ   LYS  30          3HZ       LYS  30  37.294  -0.937 -15.312
  307    H    GLU  31           HN       GLU  31  32.249  -2.128 -19.654
  308    HA   GLU  31           HA       GLU  31  32.813  -2.308 -22.500
  309   1HB   GLU  31          2HB       GLU  31  30.544  -3.363 -20.772
  310   2HB   GLU  31          3HB       GLU  31  30.428  -3.331 -22.520
  311   1HG   GLU  31          2HG       GLU  31  32.861  -4.505 -22.314
  312   2HG   GLU  31          3HG       GLU  31  32.211  -4.999 -20.763
  313    H    LYS  32           HN       LYS  32  31.941  -0.847 -23.961
  314    HA   LYS  32           HA       LYS  32  30.592   1.430 -22.786
  315   1HB   LYS  32          2HB       LYS  32  31.083   2.547 -24.858
  316   2HB   LYS  32          3HB       LYS  32  32.529   1.728 -24.301
  317   1HG   LYS  32          2HG       LYS  32  30.852   0.014 -26.031
  318   2HG   LYS  32          3HG       LYS  32  31.376   1.478 -26.841
  319   1HD   LYS  32          2HD       LYS  32  33.621   0.890 -26.773
  320   2HD   LYS  32          3HD       LYS  32  33.470   0.039 -25.248
  321   1HE   LYS  32          2HE       LYS  32  31.863  -1.431 -27.075
  322   2HE   LYS  32          3HE       LYS  32  33.310  -1.019 -27.973
  323   1HZ   LYS  32          1HZ       LYS  32  33.621  -3.040 -26.768
  324   2HZ   LYS  32          2HZ       LYS  32  34.608  -1.903 -26.134
  325   3HZ   LYS  32          3HZ       LYS  32  33.243  -2.332 -25.345
  326    H    GLY  33           HN       GLY  33  28.488   2.097 -23.265
  327   1HA   GLY  33          1HA       GLY  33  26.647   1.827 -24.912
  328   2HA   GLY  33          2HA       GLY  33  26.873   0.099 -24.733
  329    H    HIS  34           HN       HIS  34  27.412   0.032 -21.872
  330    HA   HIS  34           HA       HIS  34  24.835   0.982 -20.853
  331   1HB   HIS  34          2HB       HIS  34  24.537  -1.040 -19.626
  332   2HB   HIS  34          3HB       HIS  34  24.837  -1.463 -21.300
  333    HD1  HIS  34           HD1      HIS  34  26.891  -2.900 -21.826
  334    HD2  HIS  34           HD2      HIS  34  26.728  -1.631 -17.832
  335    HE1  HIS  34           HE1      HIS  34  28.701  -4.204 -20.587
  336    H    TRP  35           HN       TRP  35  24.823   1.279 -18.433
  337    HA   TRP  35           HA       TRP  35  27.392   2.413 -17.648
  338   1HB   TRP  35          2HB       TRP  35  24.547   2.937 -17.016
  339   2HB   TRP  35          3HB       TRP  35  25.678   3.138 -15.691
  340    HD1  TRP  35           HD1      TRP  35  26.033   4.202 -19.448
  341    HE1  TRP  35           HE1      TRP  35  26.701   6.748 -19.621
  342    HE3  TRP  35           HE3      TRP  35  25.961   5.101 -14.444
  343    HZ2  TRP  35           HZ2      TRP  35  27.115   8.808 -17.689
  344    HZ3  TRP  35           HZ3      TRP  35  26.510   7.406 -13.671
  345    HH2  TRP  35           HH2      TRP  35  27.073   9.226 -15.202
  346    H    ALA  36           HN       ALA  36  28.069   2.040 -15.312
  347    HA   ALA  36           HA       ALA  36  28.287  -0.691 -14.811
  348   1HB   ALA  36          1HB       ALA  36  29.930   0.923 -14.037
  349   2HB   ALA  36          2HB       ALA  36  28.709   1.746 -13.037
  350   3HB   ALA  36          3HB       ALA  36  29.235   0.096 -12.625
  351    H    LYS  37           HN       LYS  37  25.936   1.782 -13.760
  352    HA   LYS  37           HA       LYS  37  24.807   0.228 -11.693
  353   1HB   LYS  37          2HB       LYS  37  23.985   2.682 -13.228
  354   2HB   LYS  37          3HB       LYS  37  22.843   1.897 -12.155
  355   1HG   LYS  37          2HG       LYS  37  23.813   2.982 -10.417
  356   2HG   LYS  37          3HG       LYS  37  25.250   2.010 -10.667
  357   1HD   LYS  37          2HD       LYS  37  25.861   3.767 -12.520
  358   2HD   LYS  37          3HD       LYS  37  24.643   4.777 -11.768
  359   1HE   LYS  37          2HE       LYS  37  26.677   5.404 -10.690
  360   2HE   LYS  37          3HE       LYS  37  25.874   4.365  -9.530
  361   1HZ   LYS  37          1HZ       LYS  37  28.259   3.884 -11.044
  362   2HZ   LYS  37          2HZ       LYS  37  27.825   3.318  -9.575
  363   3HZ   LYS  37          3HZ       LYS  37  27.259   2.598 -10.928
  364    H    ASP  38           HN       ASP  38  24.900  -0.221 -15.056
  365    HA   ASP  38           HA       ASP  38  22.539  -1.911 -14.839
  366   1HB   ASP  38          2HB       ASP  38  22.656   0.336 -16.427
  367   2HB   ASP  38          3HB       ASP  38  23.271  -0.865 -17.543
  368    H    CYS  39           HN       CYS  39  25.563  -2.288 -14.520
  369    HA   CYS  39           HA       CYS  39  26.572  -3.495 -16.836
  370   1HB   CYS  39          2HB       CYS  39  27.955  -2.624 -14.946
  371   2HB   CYS  39          3HB       CYS  39  27.416  -3.967 -13.959
  372    HA   PRO  40           HA       PRO  40  24.371  -7.263 -16.500
  373   1HB   PRO  40          2HB       PRO  40  25.595  -8.641 -18.518
  374   2HB   PRO  40          3HB       PRO  40  24.289  -7.505 -18.788
  375   1HG   PRO  40          2HG       PRO  40  27.179  -7.163 -19.308
  376   2HG   PRO  40          3HG       PRO  40  25.832  -6.242 -19.947
  377   1HD   PRO  40          2HD       PRO  40  27.629  -5.435 -17.861
  378   2HD   PRO  40          3HD       PRO  40  26.214  -4.565 -18.420
  379    H    LYS  41           HN       LYS  41  27.391  -6.709 -15.466
  380    HA   LYS  41           HA       LYS  41  27.908  -9.520 -14.882
  381   1HB   LYS  41          2HB       LYS  41  29.542  -7.249 -15.476
  382   2HB   LYS  41          3HB       LYS  41  29.928  -7.778 -13.851
  383   1HG   LYS  41          2HG       LYS  41  29.843 -10.211 -15.021
  384   2HG   LYS  41          3HG       LYS  41  30.209  -9.270 -16.453
  385   1HD   LYS  41          2HD       LYS  41  32.387  -9.285 -15.822
  386   2HD   LYS  41          3HD       LYS  41  31.952  -8.228 -14.494
  387   1HE   LYS  41          2HE       LYS  41  33.057 -10.112 -13.492
  388   2HE   LYS  41          3HE       LYS  41  31.353 -10.324 -13.143
  389   1HZ   LYS  41          1HZ       LYS  41  31.498 -12.256 -14.153
  390   2HZ   LYS  41          2HZ       LYS  41  31.812 -11.516 -15.575
  391   3HZ   LYS  41          3HZ       LYS  41  33.043 -11.991 -14.612
  392    H    LYS  42           HN       LYS  42  26.571  -6.608 -13.520
  393    HA   LYS  42           HA       LYS  42  27.176  -7.139 -10.816
  394   1HB   LYS  42          2HB       LYS  42  25.667  -5.193 -12.369
  395   2HB   LYS  42          3HB       LYS  42  24.807  -5.643 -10.911
  396   1HG   LYS  42          2HG       LYS  42  27.329  -5.382  -9.883
  397   2HG   LYS  42          3HG       LYS  42  27.439  -4.242 -11.209
  398   1HD   LYS  42          2HD       LYS  42  24.926  -4.055  -9.611
  399   2HD   LYS  42          3HD       LYS  42  26.386  -3.649  -8.731
  400   1HE   LYS  42          2HE       LYS  42  26.796  -2.313 -11.132
  401   2HE   LYS  42          3HE       LYS  42  25.057  -2.192 -10.955
  402   1HZ   LYS  42          1HZ       LYS  42  26.729  -0.553  -9.781
  403   2HZ   LYS  42          2HZ       LYS  42  25.267  -0.909  -9.147
  404   3HZ   LYS  42          3HZ       LYS  42  26.605  -1.658  -8.585
  405    HA   PRO  43           HA       PRO  43  24.376 -10.492 -10.486
  406   1HB   PRO  43          2HB       PRO  43  25.230 -11.384  -8.048
  407   2HB   PRO  43          3HB       PRO  43  25.964 -11.879  -9.561
  408   1HG   PRO  43          2HG       PRO  43  26.986  -9.982  -7.537
  409   2HG   PRO  43          3HG       PRO  43  27.863 -10.803  -8.813
  410   1HD   PRO  43          2HD       PRO  43  27.028  -8.058  -8.795
  411   2HD   PRO  43          3HD       PRO  43  27.801  -8.911 -10.117
  412    H    ARG  44           HN       ARG  44  22.817  -8.589 -10.475
  413    HA   ARG  44           HA       ARG  44  22.053  -7.773  -7.889
  414   1HB   ARG  44          2HB       ARG  44  21.519  -6.993 -10.587
  415   2HB   ARG  44          3HB       ARG  44  19.959  -7.397  -9.897
  416   1HG   ARG  44          2HG       ARG  44  20.785  -5.944  -7.839
  417   2HG   ARG  44          3HG       ARG  44  21.942  -5.292  -8.982
  418   1HD   ARG  44          2HD       ARG  44  20.307  -4.219 -10.252
  419   2HD   ARG  44          3HD       ARG  44  19.085  -5.427  -9.907
  420    HE   ARG  44           HE       ARG  44  19.655  -3.034  -8.336
  421   1HH1  ARG  44          2HH2      ARG  44  18.353  -6.300  -8.184
  422   2HH1  ARG  44          1HH2      ARG  44  17.372  -5.981  -6.793
  423   1HH2  ARG  44          2HH1      ARG  44  18.361  -2.612  -6.501
  424   2HH2  ARG  44          1HH1      ARG  44  17.377  -3.869  -5.829
  425    H    GLY  45           HN       GLY  45  20.431  -8.606  -6.545
  426   1HA   GLY  45          1HA       GLY  45  18.150  -9.845  -6.987
  427   2HA   GLY  45          2HA       GLY  45  19.254 -11.150  -7.374
  428    HA   PRO  46           HA       PRO  46  17.847 -12.318  -6.549
  429   1HB   PRO  46          2HB       PRO  46  15.912 -13.447  -4.982
  430   2HB   PRO  46          3HB       PRO  46  17.455 -14.213  -5.301
  431   1HG   PRO  46          2HG       PRO  46  16.530 -12.860  -2.841
  432   2HG   PRO  46          3HG       PRO  46  17.862 -13.981  -3.043
  433   1HD   PRO  46          2HD       PRO  46  18.044 -11.133  -2.758
  434   2HD   PRO  46          3HD       PRO  46  19.364 -12.240  -3.075
  435    H    ARG  47           HN       ARG  47  15.998 -10.762  -3.965
  436    HA   ARG  47           HA       ARG  47  13.837 -10.199  -5.543
  437   1HB   ARG  47          2HB       ARG  47  14.894  -9.367  -2.926
  438   2HB   ARG  47          3HB       ARG  47  14.041  -8.049  -3.705
  439   1HG   ARG  47          2HG       ARG  47  11.990  -9.148  -3.655
  440   2HG   ARG  47          3HG       ARG  47  12.711 -10.739  -3.803
  441   1HD   ARG  47          2HD       ARG  47  13.163 -10.909  -1.500
  442   2HD   ARG  47          3HD       ARG  47  13.249  -9.173  -1.278
  443    HE   ARG  47           HE       ARG  47  10.817 -10.825  -1.259
  444   1HH1  ARG  47          2HH2      ARG  47  12.120  -7.571  -1.575
  445   2HH1  ARG  47          1HH2      ARG  47  10.636  -6.796  -1.130
  446   1HH2  ARG  47          2HH1      ARG  47   8.860  -9.803  -0.671
  447   2HH2  ARG  47          1HH1      ARG  47   8.769  -8.075  -0.612
  448    H    GLY  48           HN       GLY  48  13.169  -8.272  -6.707
  449   1HA   GLY  48          1HA       GLY  48  14.887  -6.006  -6.960
  450   2HA   GLY  48          2HA       GLY  48  15.036  -7.079  -8.337
  451    HA   PRO  49           HA       PRO  49  11.493  -4.584  -9.414
  452   1HB   PRO  49          2HB       PRO  49  12.005  -4.457 -12.095
  453   2HB   PRO  49          3HB       PRO  49  12.598  -3.272 -10.949
  454   1HG   PRO  49          2HG       PRO  49  14.078  -5.442 -12.305
  455   2HG   PRO  49          3HG       PRO  49  14.710  -4.014 -11.508
  456   1HD   PRO  49          2HD       PRO  49  14.695  -6.690 -10.475
  457   2HD   PRO  49          3HD       PRO  49  15.219  -5.244  -9.634
  458    H    ARG  50           HN       ARG  50  10.844  -6.947  -8.594
  459    HA   ARG  50           HA       ARG  50   9.076  -7.755 -10.684
  460   1HB   ARG  50          2HB       ARG  50  11.518  -9.229 -10.159
  461   2HB   ARG  50          3HB       ARG  50  10.163 -10.221  -9.658
  462   1HG   ARG  50          2HG       ARG  50   9.151 -10.138 -11.845
  463   2HG   ARG  50          3HG       ARG  50  10.182  -8.816 -12.359
  464   1HD   ARG  50          2HD       ARG  50  11.990 -10.854 -11.586
  465   2HD   ARG  50          3HD       ARG  50  10.706 -11.706 -12.420
  466    HE   ARG  50           HE       ARG  50  11.579  -9.297 -13.836
  467   1HH1  ARG  50          2HH2      ARG  50  12.214 -12.721 -13.333
  468   2HH1  ARG  50          1HH2      ARG  50  13.031 -12.923 -14.848
  469   1HH2  ARG  50          2HH1      ARG  50  12.656  -9.563 -15.835
  470   2HH2  ARG  50          1HH1      ARG  50  13.283 -11.115 -16.279
  471    HA   PRO  51           HA       PRO  51   6.701  -8.565  -7.115
  472   1HB   PRO  51          2HB       PRO  51   4.667 -10.063  -8.157
  473   2HB   PRO  51          3HB       PRO  51   4.727  -8.315  -8.275
  474   1HG   PRO  51          2HG       PRO  51   5.263 -10.334 -10.368
  475   2HG   PRO  51          3HG       PRO  51   4.903  -8.628 -10.553
  476   1HD   PRO  51          2HD       PRO  51   7.476  -9.875 -10.788
  477   2HD   PRO  51          3HD       PRO  51   7.133  -8.158 -10.858
  478    H    GLN  52           HN       GLN  52   6.046 -10.080  -5.482
  479    HA   GLN  52           HA       GLN  52   7.650 -12.478  -5.826
  480   1HB   GLN  52          2HB       GLN  52   7.538 -12.647  -3.344
  481   2HB   GLN  52          3HB       GLN  52   8.224 -11.124  -3.871
  482   1HG   GLN  52          2HG       GLN  52   6.519  -9.908  -2.961
  483   2HG   GLN  52          3HG       GLN  52   5.290 -10.973  -3.614
  484   1HE2  GLN  52          1HE2      GLN  52   4.756 -10.058  -1.242
  485   2HE2  GLN  52          2HE2      GLN  52   4.992 -11.216   0.025
  486    H    THR  53           HN       THR  53   5.777 -13.202  -7.309
  487    HA   THR  53           HA       THR  53   3.217 -13.668  -6.430
  488    HB   THR  53           HB       THR  53   4.192 -13.940  -8.768
  489    HG1  THR  53           HG1      THR  53   2.841 -15.997  -9.016
  490   1HG2  THR  53          1HG2      THR  53   5.980 -15.709  -7.608
  491   2HG2  THR  53          2HG2      THR  53   4.724 -16.821  -8.205
  492   3HG2  THR  53          3HG2      THR  53   5.550 -15.720  -9.335
  493    H    SER  54           HN       SER  54   2.099 -15.344  -5.413
  494    HA   SER  54           HA       SER  54   3.717 -17.439  -4.274
  495   1HB   SER  54          2HB       SER  54   2.549 -15.187  -2.733
  496   2HB   SER  54          3HB       SER  54   2.153 -16.766  -2.088
  497    HG   SER  54           HG       SER  54   4.479 -15.401  -1.855
  498    H    LEU  55           HN       LEU  55   2.245 -19.142  -3.188
  499    HA   LEU  55           HA       LEU  55  -0.019 -19.537  -4.909
  500   1HB   LEU  55          2HB       LEU  55   1.811 -21.193  -3.838
  501   2HB   LEU  55          3HB       LEU  55   0.542 -21.364  -2.641
  502    HG   LEU  55           HG       LEU  55  -0.773 -21.600  -5.111
  503   1HD1  LEU  55          1HD1      LEU  55   1.386 -23.627  -5.292
  504   2HD1  LEU  55          2HD1      LEU  55   0.444 -22.822  -6.571
  505   3HD1  LEU  55          3HD1      LEU  55   1.801 -21.970  -5.794
  506   1HD2  LEU  55          1HD2      LEU  55   0.157 -23.822  -3.271
  507   2HD2  LEU  55          2HD2      LEU  55  -1.257 -22.779  -2.983
  508   3HD2  LEU  55          3HD2      LEU  55  -1.222 -23.860  -4.397
  509    H    LEU  56           HN       LEU  56  -2.014 -20.653  -3.554
  510    HA   LEU  56           HA       LEU  56  -3.289 -18.493  -2.355
  511   1HB   LEU  56          2HB       LEU  56  -4.129 -20.732  -3.459
  512   2HB   LEU  56          3HB       LEU  56  -4.116 -21.313  -1.806
  513    HG   LEU  56           HG       LEU  56  -6.330 -20.539  -2.443
  514   1HD1  LEU  56          1HD1      LEU  56  -5.643 -20.317  -0.102
  515   2HD1  LEU  56          2HD1      LEU  56  -5.043 -18.673  -0.429
  516   3HD1  LEU  56          3HD1      LEU  56  -6.781 -19.032  -0.577
  517   1HD2  LEU  56          1HD2      LEU  56  -5.811 -17.679  -2.525
  518   2HD2  LEU  56          2HD2      LEU  56  -4.988 -18.545  -3.845
  519   3HD2  LEU  56          3HD2      LEU  56  -6.748 -18.708  -3.634
  Start of MODEL   17
    1   1H5*    C 504          1H5*        C 504  37.643  -7.515  -1.498
    2   2H5*    C 504          2H5*        C 504  37.106  -6.601  -2.907
    3    H4*    C 504           H4*        C 504  38.807  -8.687  -3.015
    4    H3*    C 504           H3*        C 504  36.796  -7.921  -5.163
    5    H2*    C 504           H2*        C 504  38.030  -9.346  -6.559
    6   2HO*    C 504          2HO*        C 504  40.022  -9.290  -4.483
    7    H1*    C 504           H1*        C 504  38.461 -11.378  -4.829
    8   1H4     C 504          1H4         C 504  32.544 -12.749  -6.732
    9   2H4     C 504          2H4         C 504  31.908 -11.423  -5.783
   10    H5     C 504           H5         C 504  33.255  -9.912  -4.567
   11    H6     C 504           H6         C 504  35.566  -9.294  -3.955
   12   1H5*    C 505          1H5*        C 505  40.031  -7.408  -7.189
   13   2H5*    C 505          2H5*        C 505  40.011  -5.993  -8.239
   14    H4*    C 505           H4*        C 505  40.193  -7.960  -9.590
   15    H3*    C 505           H3*        C 505  37.602  -6.472  -9.770
   16    H2*    C 505           H2*        C 505  36.770  -8.005 -11.378
   17   2HO*    C 505          2HO*        C 505  38.893  -8.154 -12.353
   18    H1*    C 505           H1*        C 505  37.585 -10.254  -9.875
   19   1H4     C 505          1H4         C 505  31.378  -9.527  -8.541
   20   2H4     C 505          2H4         C 505  31.796  -8.333  -7.333
   21    H5     C 505           H5         C 505  33.989  -7.528  -6.983
   22    H6     C 505           H6         C 505  36.343  -7.673  -7.712
   23   1H5*    U 506          1H5*        U 506  39.320  -2.512  -9.687
   24   2H5*    U 506          2H5*        U 506  38.104  -2.886  -8.467
   25    H4*    U 506           H4*        U 506  37.327  -1.802 -10.648
   26    H3*    U 506           H3*        U 506  36.025  -4.284  -9.510
   27    H2*    U 506           H2*        U 506  34.373  -4.106 -11.155
   28   2HO*    U 506          2HO*        U 506  33.781  -2.010 -11.171
   29    H1*    U 506           H1*        U 506  36.325  -3.034 -13.058
   30    H3     U 506           H3         U 506  36.286  -6.596 -15.797
   31    H5     U 506           H5         U 506  34.557  -8.094 -12.290
   32    H6     U 506           H6         U 506  35.052  -5.933 -11.241
   33   1H5*    C 507          1H5*        C 507  34.532  -0.057 -10.369
   34   2H5*    C 507          2H5*        C 507  34.076   0.269  -8.696
   35    H4*    C 507           H4*        C 507  33.031   1.492 -10.915
   36    H3*    C 507           H3*        C 507  32.155   1.300  -8.066
   37    H2*    C 507           H2*        C 507  30.065   2.312  -8.559
   38   2HO*    C 507          2HO*        C 507  31.134   2.527 -11.225
   39    H1*    C 507           H1*        C 507  29.540   0.645 -10.736
   40   1H4     C 507          1H4         C 507  26.784  -2.072  -5.618
   41   2H4     C 507          2H4         C 507  28.195  -3.097  -5.479
   42    H5     C 507           H5         C 507  30.144  -2.837  -6.788
   43    H6     C 507           H6         C 507  31.229  -1.516  -8.570
   44   1H5*    C 508          1H5*        C 508  36.075   4.710  -6.975
   45   2H5*    C 508          2H5*        C 508  34.433   5.142  -6.499
   46    H4*    C 508           H4*        C 508  35.344   7.219  -6.673
   47    H3*    C 508           H3*        C 508  33.958   6.532  -9.162
   48    H2*    C 508           H2*        C 508  34.989   8.133 -10.533
   49   2HO*    C 508          2HO*        C 508  34.783   9.674  -8.751
   50    H1*    C 508           H1*        C 508  37.558   7.681  -9.886
   51   1H4     C 508          1H4         C 508  36.598   1.741 -12.418
   52   2H4     C 508          2H4         C 508  35.619   2.644 -13.553
   53    H5     C 508           H5         C 508  35.071   4.926 -13.294
   54    H6     C 508           H6         C 508  35.328   6.924 -11.866
   55   1H5*    G 509          1H5*        G 509  33.057   9.631 -10.088
   56   2H5*    G 509          2H5*        G 509  31.781  10.393  -9.138
   57    H4*    G 509           H4*        G 509  31.362  11.042 -11.343
   58    H3*    G 509           H3*        G 509  29.545   8.782 -10.529
   59    H2*    G 509           H2*        G 509  28.401   8.987 -12.599
   60   2HO*    G 509          2HO*        G 509  30.151  11.246 -12.971
   61    H1*    G 509           H1*        G 509  30.789   9.105 -14.090
   62    H8     G 509           H8         G 509  29.956   6.768 -11.154
   63    H1     G 509           H1         G 509  29.981   4.016 -17.011
   64   1H2     G 509          1H2         G 509  30.391   5.444 -18.441
   65   2H2     G 509          2H2         G 509  30.685   7.135 -18.104
   66   1H5*    U 510          1H5*        U 510  27.599  13.444 -10.994
   67   2H5*    U 510          2H5*        U 510  27.295  13.148  -9.282
   68    H4*    U 510           H4*        U 510  25.666  14.693  -9.897
   69    H3*    U 510           H3*        U 510  24.484  11.917  -9.909
   70    H2*    U 510           H2*        U 510  22.354  12.870 -10.305
   71   2HO*    U 510          2HO*        U 510  22.489  15.385 -10.276
   72    H1*    U 510           H1*        U 510  23.452  14.711 -12.218
   73    H3     U 510           H3         U 510  20.349  12.309 -14.541
   74    H5     U 510           H5         U 510  23.623   9.724 -14.169
   75    H6     U 510           H6         U 510  24.624  11.369 -12.652
   76   1H    ALA   1           HN       ALA   1  16.419  46.050 -27.846
   77    HA   ALA   1           HA       ALA   1  16.776  47.176 -25.348
   78   1HB   ALA   1          1HB       ALA   1  14.005  46.479 -25.941
   79   2HB   ALA   1          2HB       ALA   1  14.629  45.546 -24.559
   80   3HB   ALA   1          3HB       ALA   1  14.683  47.325 -24.531
   81    H    THR   2           HN       THR   2  17.879  45.710 -24.009
   82    HA   THR   2           HA       THR   2  17.685  42.913 -24.322
   83    HB   THR   2           HB       THR   2  18.840  43.510 -26.494
   84    HG1  THR   2           HG1      THR   2  20.574  41.948 -25.981
   85   1HG2  THR   2          1HG2      THR   2  21.023  44.454 -24.560
   86   2HG2  THR   2          2HG2      THR   2  21.271  44.153 -26.296
   87   3HG2  THR   2          3HG2      THR   2  20.189  45.462 -25.766
   88    H    VAL   3           HN       VAL   3  18.659  41.830 -22.632
   89    HA   VAL   3           HA       VAL   3  20.353  43.474 -20.897
   90    HB   VAL   3           HB       VAL   3  19.143  42.549 -18.952
   91   1HG1  VAL   3          1HG1      VAL   3  17.053  43.955 -19.265
   92   2HG1  VAL   3          2HG1      VAL   3  18.599  44.782 -19.572
   93   3HG1  VAL   3          3HG1      VAL   3  17.595  44.236 -20.937
   94   1HG2  VAL   3          1HG2      VAL   3  17.647  40.908 -19.145
   95   2HG2  VAL   3          2HG2      VAL   3  16.651  41.900 -20.237
   96   3HG2  VAL   3          3HG2      VAL   3  17.945  40.871 -20.900
   97    H    VAL   4           HN       VAL   4  21.817  42.221 -19.545
   98    HA   VAL   4           HA       VAL   4  21.940  39.381 -20.088
   99    HB   VAL   4           HB       VAL   4  24.273  39.493 -20.824
  100   1HG1  VAL   4          1HG1      VAL   4  22.311  39.450 -22.431
  101   2HG1  VAL   4          2HG1      VAL   4  22.558  41.200 -22.648
  102   3HG1  VAL   4          3HG1      VAL   4  23.845  40.057 -23.100
  103   1HG2  VAL   4          1HG2      VAL   4  24.589  42.100 -21.783
  104   2HG2  VAL   4          2HG2      VAL   4  23.965  42.303 -20.128
  105   3HG2  VAL   4          3HG2      VAL   4  25.444  41.353 -20.412
  106    H    SER   5           HN       SER   5  22.254  38.423 -18.151
  107    HA   SER   5           HA       SER   5  24.270  39.337 -16.425
  108   1HB   SER   5          2HB       SER   5  21.877  40.716 -16.091
  109   2HB   SER   5          3HB       SER   5  21.732  39.437 -14.902
  110    HG   SER   5           HG       SER   5  22.791  41.158 -13.890
  111    H    GLY   6           HN       GLY   6  24.877  37.645 -15.020
  112   1HA   GLY   6          1HA       GLY   6  23.105  35.597 -14.185
  113   2HA   GLY   6          2HA       GLY   6  24.021  35.063 -15.581
  114    H    GLN   7           HN       GLN   7  24.690  33.511 -13.649
  115    HA   GLN   7           HA       GLN   7  26.922  34.757 -12.254
  116   1HB   GLN   7          2HB       GLN   7  24.826  33.063 -11.340
  117   2HB   GLN   7          3HB       GLN   7  26.276  32.077 -11.310
  118   1HG   GLN   7          2HG       GLN   7  26.090  33.221  -9.166
  119   2HG   GLN   7          3HG       GLN   7  27.458  33.897 -10.029
  120   1HE2  GLN   7          1HE2      GLN   7  26.395  35.302  -8.015
  121   2HE2  GLN   7          2HE2      GLN   7  25.534  36.696  -8.575
  122    H    LYS   8           HN       LYS   8  28.882  33.269 -11.918
  123    HA   LYS   8           HA       LYS   8  29.160  31.205 -13.920
  124   1HB   LYS   8          2HB       LYS   8  30.122  33.896 -14.375
  125   2HB   LYS   8          3HB       LYS   8  31.474  32.786 -14.276
  126   1HG   LYS   8          2HG       LYS   8  30.298  31.271 -15.929
  127   2HG   LYS   8          3HG       LYS   8  29.024  32.466 -16.075
  128   1HD   LYS   8          2HD       LYS   8  31.733  33.612 -16.430
  129   2HD   LYS   8          3HD       LYS   8  31.353  32.377 -17.613
  130   1HE   LYS   8          2HE       LYS   8  29.117  33.609 -17.999
  131   2HE   LYS   8          3HE       LYS   8  29.765  34.914 -17.026
  132   1HZ   LYS   8          1HZ       LYS   8  30.485  35.550 -19.041
  133   2HZ   LYS   8          2HZ       LYS   8  31.753  34.586 -18.684
  134   3HZ   LYS   8          3HZ       LYS   8  30.562  34.039 -19.657
  135    H    GLN   9           HN       GLN   9  29.599  29.629 -12.425
  136    HA   GLN   9           HA       GLN   9  31.692  30.275 -10.506
  137   1HB   GLN   9          2HB       GLN   9  29.435  29.536  -9.625
  138   2HB   GLN   9          3HB       GLN   9  29.681  27.985 -10.404
  139   1HG   GLN   9          2HG       GLN   9  30.642  27.380  -8.418
  140   2HG   GLN   9          3HG       GLN   9  32.052  28.220  -9.033
  141   1HE2  GLN   9          1HE2      GLN   9  32.501  28.432  -6.729
  142   2HE2  GLN   9          2HE2      GLN   9  31.855  29.776  -5.848
  143    H    ASP  10           HN       ASP  10  33.675  29.310 -10.722
  144    HA   ASP  10           HA       ASP  10  33.768  27.049 -12.562
  145   1HB   ASP  10          2HB       ASP  10  34.978  28.873 -13.549
  146   2HB   ASP  10          3HB       ASP  10  35.707  29.327 -12.022
  147    H    ARG  11           HN       ARG  11  34.611  25.136 -11.674
  148    HA   ARG  11           HA       ARG  11  35.707  25.393  -9.000
  149   1HB   ARG  11          2HB       ARG  11  33.760  23.653 -10.117
  150   2HB   ARG  11          3HB       ARG  11  35.174  22.643  -9.892
  151   1HG   ARG  11          2HG       ARG  11  35.067  24.152  -7.520
  152   2HG   ARG  11          3HG       ARG  11  33.381  23.827  -7.871
  153   1HD   ARG  11          2HD       ARG  11  35.551  21.674  -7.816
  154   2HD   ARG  11          3HD       ARG  11  34.506  22.041  -6.459
  155    HE   ARG  11           HE       ARG  11  33.737  20.661  -8.945
  156   1HH1  ARG  11          2HH2      ARG  11  32.608  22.333  -6.061
  157   2HH1  ARG  11          1HH2      ARG  11  31.028  21.625  -6.114
  158   1HH2  ARG  11          2HH1      ARG  11  31.653  19.728  -9.015
  159   2HH2  ARG  11          1HH1      ARG  11  30.481  20.133  -7.805
  160    H    GLN  12           HN       GLN  12  37.941  25.500  -9.056
  161    HA   GLN  12           HA       GLN  12  39.544  24.861 -11.098
  162   1HB   GLN  12          2HB       GLN  12  41.364  24.571  -9.345
  163   2HB   GLN  12          3HB       GLN  12  40.425  26.043  -9.204
  164   1HG   GLN  12          2HG       GLN  12  39.503  25.422  -7.197
  165   2HG   GLN  12          3HG       GLN  12  39.258  23.763  -7.707
  166   1HE2  GLN  12          1HE2      GLN  12  41.300  26.015  -6.106
  167   2HE2  GLN  12          2HE2      GLN  12  42.529  24.927  -5.554
  168    H    GLY  13           HN       GLY  13  40.459  23.033 -12.024
  169   1HA   GLY  13          1HA       GLY  13  41.199  20.838 -12.052
  170   2HA   GLY  13          2HA       GLY  13  40.295  20.491 -10.591
  171    H    GLY  14           HN       GLY  14  39.722  18.527 -12.030
  172   1HA   GLY  14          1HA       GLY  14  37.068  18.950 -13.065
  173   2HA   GLY  14          2HA       GLY  14  38.241  18.560 -14.306
  174    H    GLU  15           HN       GLU  15  38.862  16.434 -14.617
  175    HA   GLU  15           HA       GLU  15  37.417  14.486 -13.183
  176   1HB   GLU  15          2HB       GLU  15  38.570  12.879 -14.657
  177   2HB   GLU  15          3HB       GLU  15  37.959  14.237 -15.580
  178   1HG   GLU  15          2HG       GLU  15  40.751  14.513 -14.520
  179   2HG   GLU  15          3HG       GLU  15  40.521  13.322 -15.784
  180    H    ARG  16           HN       ARG  16  38.306  12.710 -11.888
  181    HA   ARG  16           HA       ARG  16  40.707  13.593 -10.513
  182   1HB   ARG  16          2HB       ARG  16  38.266  13.006  -9.436
  183   2HB   ARG  16          3HB       ARG  16  38.983  11.407  -9.372
  184   1HG   ARG  16          2HG       ARG  16  40.812  12.162  -7.997
  185   2HG   ARG  16          3HG       ARG  16  40.472  13.849  -8.328
  186   1HD   ARG  16          2HD       ARG  16  39.384  13.774  -6.305
  187   2HD   ARG  16          3HD       ARG  16  38.067  13.104  -7.246
  188    HE   ARG  16           HE       ARG  16  38.521  10.957  -6.361
  189   1HH1  ARG  16          2HH2      ARG  16  41.053  13.225  -5.451
  190   2HH1  ARG  16          1HH2      ARG  16  41.762  12.162  -4.282
  191   1HH2  ARG  16          2HH1      ARG  16  39.457   9.554  -4.820
  192   2HH2  ARG  16          1HH1      ARG  16  40.848  10.058  -3.921
  193    H    ARG  17           HN       ARG  17  38.959  10.544 -11.487
  194    HA   ARG  17           HA       ARG  17  41.372   9.520 -12.566
  195   1HB   ARG  17          2HB       ARG  17  40.429   8.682  -9.867
  196   2HB   ARG  17          3HB       ARG  17  40.746   7.342 -10.952
  197   1HG   ARG  17          2HG       ARG  17  43.020   8.399 -11.456
  198   2HG   ARG  17          3HG       ARG  17  42.693   9.567 -10.190
  199   1HD   ARG  17          2HD       ARG  17  43.593   8.065  -8.735
  200   2HD   ARG  17          3HD       ARG  17  42.129   7.124  -8.937
  201    HE   ARG  17           HE       ARG  17  44.101   6.644 -11.050
  202   1HH1  ARG  17          2HH2      ARG  17  43.053   5.713  -7.821
  203   2HH1  ARG  17          1HH2      ARG  17  43.791   4.147  -7.895
  204   1HH2  ARG  17          2HH1      ARG  17  45.074   4.579 -11.147
  205   2HH2  ARG  17          1HH1      ARG  17  44.948   3.497  -9.800
  206    H    ARG  18           HN       ARG  18  40.094   9.371 -14.501
  207    HA   ARG  18           HA       ARG  18  38.061   7.295 -14.332
  208   1HB   ARG  18          2HB       ARG  18  37.986   9.993 -15.700
  209   2HB   ARG  18          3HB       ARG  18  37.131   8.664 -16.456
  210   1HG   ARG  18          2HG       ARG  18  35.846   8.266 -14.368
  211   2HG   ARG  18          3HG       ARG  18  36.742   9.532 -13.553
  212   1HD   ARG  18          2HD       ARG  18  35.704  10.663 -15.990
  213   2HD   ARG  18          3HD       ARG  18  34.394   9.783 -15.229
  214    HE   ARG  18           HE       ARG  18  35.944  11.497 -13.399
  215   1HH1  ARG  18          2HH2      ARG  18  33.146  11.254 -15.521
  216   2HH1  ARG  18          1HH2      ARG  18  32.302  12.566 -14.769
  217   1HH2  ARG  18          2HH1      ARG  18  34.830  13.228 -12.407
  218   2HH2  ARG  18          1HH1      ARG  18  33.267  13.697 -12.986
  219    H    SER  19           HN       SER  19  40.317   6.161 -14.827
  220    HA   SER  19           HA       SER  19  41.736   6.443 -17.051
  221   1HB   SER  19          2HB       SER  19  41.221   4.343 -15.168
  222   2HB   SER  19          3HB       SER  19  41.199   3.614 -16.762
  223    HG   SER  19           HG       SER  19  43.348   3.604 -16.007
  224    H    GLN  20           HN       GLN  20  40.791   7.053 -19.009
  225    HA   GLN  20           HA       GLN  20  39.373   7.047 -20.696
  226   1HB   GLN  20          2HB       GLN  20  41.191   5.130 -21.010
  227   2HB   GLN  20          3HB       GLN  20  39.801   4.065 -20.928
  228   1HG   GLN  20          2HG       GLN  20  38.900   4.839 -22.931
  229   2HG   GLN  20          3HG       GLN  20  39.548   6.455 -22.728
  230   1HE2  GLN  20          1HE2      GLN  20  40.601   3.085 -23.159
  231   2HE2  GLN  20          2HE2      GLN  20  41.928   3.401 -24.226
  232    H    LEU  21           HN       LEU  21  37.723   7.180 -18.605
  233    HA   LEU  21           HA       LEU  21  35.763   5.030 -18.998
  234   1HB   LEU  21          2HB       LEU  21  36.630   5.215 -16.733
  235   2HB   LEU  21          3HB       LEU  21  36.187   6.909 -16.671
  236    HG   LEU  21           HG       LEU  21  34.687   4.978 -15.608
  237   1HD1  LEU  21          1HD1      LEU  21  33.210   7.201 -16.981
  238   2HD1  LEU  21          2HD1      LEU  21  33.021   6.552 -15.334
  239   3HD1  LEU  21          3HD1      LEU  21  34.426   7.570 -15.733
  240   1HD2  LEU  21          1HD2      LEU  21  34.432   3.972 -17.960
  241   2HD2  LEU  21          2HD2      LEU  21  32.972   4.145 -16.955
  242   3HD2  LEU  21          3HD2      LEU  21  33.297   5.310 -18.261
  243    H    ASP  22           HN       ASP  22  34.923   5.919 -20.968
  244    HA   ASP  22           HA       ASP  22  34.227   8.529 -21.318
  245   1HB   ASP  22          2HB       ASP  22  32.571   6.195 -22.356
  246   2HB   ASP  22          3HB       ASP  22  32.819   7.748 -23.129
  247    H    ARG  23           HN       ARG  23  31.953   9.501 -21.340
  248    HA   ARG  23           HA       ARG  23  30.724   9.048 -18.877
  249   1HB   ARG  23          2HB       ARG  23  30.066  10.717 -21.328
  250   2HB   ARG  23          3HB       ARG  23  28.892  10.594 -20.032
  251   1HG   ARG  23          2HG       ARG  23  31.795  11.415 -19.566
  252   2HG   ARG  23          3HG       ARG  23  30.517  12.573 -19.876
  253   1HD   ARG  23          2HD       ARG  23  30.484  10.547 -17.586
  254   2HD   ARG  23          3HD       ARG  23  30.977  12.219 -17.416
  255    HE   ARG  23           HE       ARG  23  28.431  12.283 -18.633
  256   1HH1  ARG  23          2HH2      ARG  23  29.819  11.171 -15.598
  257   2HH1  ARG  23          1HH2      ARG  23  28.362  11.417 -14.693
  258   1HH2  ARG  23          2HH1      ARG  23  26.508  12.608 -17.441
  259   2HH2  ARG  23          1HH1      ARG  23  26.466  12.240 -15.750
  260    H    ASP  24           HN       ASP  24  30.623   7.252 -21.722
  261    HA   ASP  24           HA       ASP  24  27.969   6.268 -21.033
  262   1HB   ASP  24          2HB       ASP  24  29.236   6.716 -23.762
  263   2HB   ASP  24          3HB       ASP  24  27.921   5.575 -23.560
  264    H    GLN  25           HN       GLN  25  30.896   5.553 -20.329
  265    HA   GLN  25           HA       GLN  25  30.901   2.877 -21.492
  266   1HB   GLN  25          2HB       GLN  25  32.890   4.242 -22.083
  267   2HB   GLN  25          3HB       GLN  25  33.232   4.503 -20.385
  268   1HG   GLN  25          2HG       GLN  25  33.753   2.186 -20.013
  269   2HG   GLN  25          3HG       GLN  25  33.009   1.691 -21.520
  270   1HE2  GLN  25          1HE2      GLN  25  34.535   0.916 -22.767
  271   2HE2  GLN  25          2HE2      GLN  25  36.053   1.659 -23.145
  272    H    CYS  26           HN       CYS  26  30.677   1.135 -20.121
  273    HA   CYS  26           HA       CYS  26  29.823   1.527 -17.529
  274   1HB   CYS  26          2HB       CYS  26  29.300  -0.482 -18.828
  275   2HB   CYS  26          3HB       CYS  26  30.981  -0.975 -18.802
  276    H    ALA  27           HN       ALA  27  30.910   1.781 -15.580
  277    HA   ALA  27           HA       ALA  27  33.829   1.769 -15.739
  278   1HB   ALA  27          1HB       ALA  27  31.745   3.200 -14.124
  279   2HB   ALA  27          2HB       ALA  27  33.331   2.905 -13.369
  280   3HB   ALA  27          3HB       ALA  27  33.226   3.827 -14.887
  281    H    TYR  28           HN       TYR  28  32.276  -0.735 -15.684
  282    HA   TYR  28           HA       TYR  28  33.230  -1.726 -13.083
  283   1HB   TYR  28          2HB       TYR  28  30.635  -1.455 -13.592
  284   2HB   TYR  28          3HB       TYR  28  30.859  -2.760 -14.740
  285    HD1  TYR  28           HD1      TYR  28  30.644  -1.865 -11.200
  286    HD2  TYR  28           HD2      TYR  28  31.400  -5.045 -13.960
  287    HE1  TYR  28           HE1      TYR  28  30.318  -3.566  -9.339
  288    HE2  TYR  28           HE2      TYR  28  31.073  -6.737 -12.089
  289    HH   TYR  28           HH       TYR  28  29.543  -6.173  -9.400
  290    H    CYS  29           HN       CYS  29  31.995  -2.927 -16.292
  291    HA   CYS  29           HA       CYS  29  34.009  -5.007 -16.169
  292   1HB   CYS  29          2HB       CYS  29  32.822  -5.958 -18.118
  293   2HB   CYS  29          3HB       CYS  29  31.767  -5.726 -16.738
  294    H    LYS  30           HN       LYS  30  33.085  -2.012 -17.886
  295    HA   LYS  30           HA       LYS  30  34.620  -0.629 -18.882
  296   1HB   LYS  30          2HB       LYS  30  36.444  -2.327 -18.132
  297   2HB   LYS  30          3HB       LYS  30  36.309  -2.966 -19.757
  298   1HG   LYS  30          2HG       LYS  30  37.423  -1.195 -20.658
  299   2HG   LYS  30          3HG       LYS  30  36.447  -0.032 -19.783
  300   1HD   LYS  30          2HD       LYS  30  38.511  -1.608 -18.240
  301   2HD   LYS  30          3HD       LYS  30  39.068  -0.314 -19.282
  302   1HE   LYS  30          2HE       LYS  30  37.138   1.083 -18.071
  303   2HE   LYS  30          3HE       LYS  30  37.299  -0.147 -16.833
  304   1HZ   LYS  30          1HZ       LYS  30  39.620   1.295 -17.892
  305   2HZ   LYS  30          2HZ       LYS  30  38.758   1.850 -16.622
  306   3HZ   LYS  30          3HZ       LYS  30  39.528   0.413 -16.521
  307    H    GLU  31           HN       GLU  31  32.178  -2.094 -19.722
  308    HA   GLU  31           HA       GLU  31  32.738  -2.320 -22.569
  309   1HB   GLU  31          2HB       GLU  31  30.638  -3.507 -20.753
  310   2HB   GLU  31          3HB       GLU  31  30.263  -3.303 -22.453
  311   1HG   GLU  31          2HG       GLU  31  31.186  -5.494 -22.320
  312   2HG   GLU  31          3HG       GLU  31  32.496  -4.514 -22.949
  313    H    LYS  32           HN       LYS  32  32.061  -0.710 -23.927
  314    HA   LYS  32           HA       LYS  32  30.590   1.476 -22.786
  315   1HB   LYS  32          2HB       LYS  32  31.023   2.564 -24.934
  316   2HB   LYS  32          3HB       LYS  32  32.492   1.905 -24.242
  317   1HG   LYS  32          2HG       LYS  32  31.136  -0.074 -25.939
  318   2HG   LYS  32          3HG       LYS  32  31.467   1.400 -26.827
  319   1HD   LYS  32          2HD       LYS  32  33.690   0.942 -26.919
  320   2HD   LYS  32          3HD       LYS  32  33.776   0.698 -25.185
  321   1HE   LYS  32          2HE       LYS  32  33.358  -1.615 -25.344
  322   2HE   LYS  32          3HE       LYS  32  32.512  -1.468 -26.872
  323   1HZ   LYS  32          1HZ       LYS  32  34.899  -2.348 -26.825
  324   2HZ   LYS  32          2HZ       LYS  32  34.469  -1.312 -28.013
  325   3HZ   LYS  32          3HZ       LYS  32  35.339  -0.778 -26.737
  326    H    GLY  33           HN       GLY  33  28.464   2.052 -23.163
  327   1HA   GLY  33          1HA       GLY  33  26.641   1.791 -24.875
  328   2HA   GLY  33          2HA       GLY  33  26.881   0.066 -24.677
  329    H    HIS  34           HN       HIS  34  27.356  -0.080 -21.855
  330    HA   HIS  34           HA       HIS  34  24.786   0.899 -20.839
  331   1HB   HIS  34          2HB       HIS  34  24.495  -1.122 -19.609
  332   2HB   HIS  34          3HB       HIS  34  24.816  -1.549 -21.279
  333    HD1  HIS  34           HD1      HIS  34  26.814  -3.053 -21.750
  334    HD2  HIS  34           HD2      HIS  34  26.749  -1.599 -17.816
  335    HE1  HIS  34           HE1      HIS  34  28.642  -4.311 -20.493
  336    H    TRP  35           HN       TRP  35  24.741   1.325 -18.479
  337    HA   TRP  35           HA       TRP  35  27.292   2.455 -17.667
  338   1HB   TRP  35          2HB       TRP  35  24.439   2.938 -17.067
  339   2HB   TRP  35          3HB       TRP  35  25.537   3.135 -15.714
  340    HD1  TRP  35           HD1      TRP  35  26.175   4.199 -19.422
  341    HE1  TRP  35           HE1      TRP  35  26.744   6.772 -19.559
  342    HE3  TRP  35           HE3      TRP  35  25.484   5.151 -14.475
  343    HZ2  TRP  35           HZ2      TRP  35  26.838   8.870 -17.626
  344    HZ3  TRP  35           HZ3      TRP  35  25.835   7.488 -13.683
  345    HH2  TRP  35           HH2      TRP  35  26.488   9.315 -15.169
  346    H    ALA  36           HN       ALA  36  27.981   2.105 -15.334
  347    HA   ALA  36           HA       ALA  36  28.255  -0.616 -14.816
  348   1HB   ALA  36          1HB       ALA  36  29.861   1.039 -14.048
  349   2HB   ALA  36          2HB       ALA  36  28.619   1.838 -13.052
  350   3HB   ALA  36          3HB       ALA  36  29.181   0.202 -12.632
  351    H    LYS  37           HN       LYS  37  25.845   1.807 -13.784
  352    HA   LYS  37           HA       LYS  37  24.750   0.263 -11.701
  353   1HB   LYS  37          2HB       LYS  37  23.928   2.679 -13.269
  354   2HB   LYS  37          3HB       LYS  37  22.718   1.859 -12.303
  355   1HG   LYS  37          2HG       LYS  37  23.594   2.658 -10.361
  356   2HG   LYS  37          3HG       LYS  37  25.211   2.141 -10.793
  357   1HD   LYS  37          2HD       LYS  37  25.680   4.174 -11.970
  358   2HD   LYS  37          3HD       LYS  37  23.985   4.608 -12.077
  359   1HE   LYS  37          2HE       LYS  37  25.010   5.995 -10.354
  360   2HE   LYS  37          3HE       LYS  37  23.926   4.867  -9.564
  361   1HZ   LYS  37          1HZ       LYS  37  25.998   4.906  -8.435
  362   2HZ   LYS  37          2HZ       LYS  37  25.861   3.448  -9.159
  363   3HZ   LYS  37          3HZ       LYS  37  26.841   4.587  -9.798
  364    H    ASP  38           HN       ASP  38  24.826  -0.198 -15.085
  365    HA   ASP  38           HA       ASP  38  22.556  -2.005 -14.820
  366   1HB   ASP  38          2HB       ASP  38  22.501   0.219 -16.403
  367   2HB   ASP  38          3HB       ASP  38  23.244  -0.903 -17.527
  368    H    CYS  39           HN       CYS  39  25.549  -2.322 -14.473
  369    HA   CYS  39           HA       CYS  39  26.639  -3.457 -16.792
  370   1HB   CYS  39          2HB       CYS  39  27.975  -2.581 -14.884
  371   2HB   CYS  39          3HB       CYS  39  27.435  -3.926 -13.900
  372    HA   PRO  40           HA       PRO  40  24.443  -7.248 -16.513
  373   1HB   PRO  40          2HB       PRO  40  25.511  -8.468 -18.712
  374   2HB   PRO  40          3HB       PRO  40  24.164  -7.351 -18.797
  375   1HG   PRO  40          2HG       PRO  40  26.989  -6.905 -19.543
  376   2HG   PRO  40          3HG       PRO  40  25.574  -5.980 -20.002
  377   1HD   PRO  40          2HD       PRO  40  27.531  -5.257 -18.035
  378   2HD   PRO  40          3HD       PRO  40  26.055  -4.391 -18.412
  379    H    LYS  41           HN       LYS  41  27.535  -6.682 -15.719
  380    HA   LYS  41           HA       LYS  41  28.098  -9.520 -15.294
  381   1HB   LYS  41          2HB       LYS  41  29.685  -7.576 -16.345
  382   2HB   LYS  41          3HB       LYS  41  30.151  -7.480 -14.659
  383   1HG   LYS  41          2HG       LYS  41  30.057 -10.238 -15.099
  384   2HG   LYS  41          3HG       LYS  41  30.657  -9.632 -16.630
  385   1HD   LYS  41          2HD       LYS  41  32.701  -9.237 -15.734
  386   2HD   LYS  41          3HD       LYS  41  32.005  -8.213 -14.493
  387   1HE   LYS  41          2HE       LYS  41  33.038  -9.951 -13.251
  388   2HE   LYS  41          3HE       LYS  41  31.350 -10.422 -13.274
  389   1HZ   LYS  41          1HZ       LYS  41  32.968 -11.366 -15.468
  390   2HZ   LYS  41          2HZ       LYS  41  33.279 -12.026 -14.006
  391   3HZ   LYS  41          3HZ       LYS  41  31.780 -12.128 -14.645
  392    H    LYS  42           HN       LYS  42  26.946  -6.641 -13.749
  393    HA   LYS  42           HA       LYS  42  27.939  -7.040 -11.173
  394   1HB   LYS  42          2HB       LYS  42  26.002  -5.349 -12.516
  395   2HB   LYS  42          3HB       LYS  42  25.389  -5.865 -10.957
  396   1HG   LYS  42          2HG       LYS  42  27.760  -5.228 -10.037
  397   2HG   LYS  42          3HG       LYS  42  27.970  -4.372 -11.552
  398   1HD   LYS  42          2HD       LYS  42  25.507  -3.427 -10.861
  399   2HD   LYS  42          3HD       LYS  42  26.134  -3.760  -9.259
  400   1HE   LYS  42          2HE       LYS  42  28.141  -2.368  -9.728
  401   2HE   LYS  42          3HE       LYS  42  27.581  -2.080 -11.363
  402   1HZ   LYS  42          1HZ       LYS  42  26.868  -0.262 -10.165
  403   2HZ   LYS  42          2HZ       LYS  42  25.518  -1.178 -10.241
  404   3HZ   LYS  42          3HZ       LYS  42  26.397  -1.132  -8.866
  405    HA   PRO  43           HA       PRO  43  25.634 -10.395  -9.743
  406   1HB   PRO  43          2HB       PRO  43  25.570  -9.931  -7.050
  407   2HB   PRO  43          3HB       PRO  43  26.959 -10.611  -7.872
  408   1HG   PRO  43          2HG       PRO  43  26.582  -7.872  -6.825
  409   2HG   PRO  43          3HG       PRO  43  28.073  -8.687  -7.253
  410   1HD   PRO  43          2HD       PRO  43  26.707  -6.686  -8.790
  411   2HD   PRO  43          3HD       PRO  43  28.133  -7.585  -9.270
  412    H    ARG  44           HN       ARG  44  23.584 -10.872 -10.178
  413    HA   ARG  44           HA       ARG  44  21.653  -9.013 -10.222
  414   1HB   ARG  44          2HB       ARG  44  20.029 -10.956 -10.079
  415   2HB   ARG  44          3HB       ARG  44  21.330 -11.214 -11.225
  416   1HG   ARG  44          2HG       ARG  44  22.040 -13.049 -10.098
  417   2HG   ARG  44          3HG       ARG  44  22.197 -12.133  -8.612
  418   1HD   ARG  44          2HD       ARG  44  20.115 -12.783  -7.819
  419   2HD   ARG  44          3HD       ARG  44  19.392 -12.814  -9.415
  420    HE   ARG  44           HE       ARG  44  21.411 -14.908  -8.965
  421   1HH1  ARG  44          2HH2      ARG  44  18.003 -14.054  -8.773
  422   2HH1  ARG  44          1HH2      ARG  44  17.457 -15.697  -8.802
  423   1HH2  ARG  44          2HH1      ARG  44  20.692 -17.077  -9.004
  424   2HH2  ARG  44          1HH1      ARG  44  18.998 -17.429  -8.934
  425    H    GLY  45           HN       GLY  45  20.500  -7.868  -8.686
  426   1HA   GLY  45          1HA       GLY  45  19.803  -7.163  -6.668
  427   2HA   GLY  45          2HA       GLY  45  19.414  -8.843  -6.358
  428    HA   PRO  46           HA       PRO  46  18.963  -8.107  -4.516
  429   1HB   PRO  46          2HB       PRO  46  18.915  -6.821  -2.106
  430   2HB   PRO  46          3HB       PRO  46  18.961  -8.566  -2.259
  431   1HG   PRO  46          2HG       PRO  46  21.136  -6.715  -1.497
  432   2HG   PRO  46          3HG       PRO  46  21.031  -8.447  -1.250
  433   1HD   PRO  46          2HD       PRO  46  22.588  -7.088  -3.239
  434   2HD   PRO  46          3HD       PRO  46  22.391  -8.820  -3.066
  435    H    ARG  47           HN       ARG  47  21.231  -5.913  -5.270
  436    HA   ARG  47           HA       ARG  47  21.074  -4.007  -6.299
  437   1HB   ARG  47          2HB       ARG  47  18.771  -4.878  -7.099
  438   2HB   ARG  47          3HB       ARG  47  18.059  -3.933  -5.807
  439   1HG   ARG  47          2HG       ARG  47  17.983  -2.287  -7.409
  440   2HG   ARG  47          3HG       ARG  47  19.641  -2.011  -6.915
  441   1HD   ARG  47          2HD       ARG  47  20.168  -3.911  -8.730
  442   2HD   ARG  47          3HD       ARG  47  18.609  -3.437  -9.375
  443    HE   ARG  47           HE       ARG  47  20.412  -1.182  -8.802
  444   1HH1  ARG  47          2HH2      ARG  47  19.330  -3.514 -11.205
  445   2HH1  ARG  47          1HH2      ARG  47  19.859  -2.563 -12.552
  446   1HH2  ARG  47          2HH1      ARG  47  21.111   0.072 -10.579
  447   2HH2  ARG  47          1HH1      ARG  47  20.879  -0.509 -12.194
  448    H    GLY  48           HN       GLY  48  22.248  -3.069  -4.491
  449   1HA   GLY  48          1HA       GLY  48  21.467  -0.767  -3.419
  450   2HA   GLY  48          2HA       GLY  48  20.707  -1.897  -2.315
  451    HA   PRO  49           HA       PRO  49  25.458  -2.132  -1.965
  452   1HB   PRO  49          2HB       PRO  49  26.795   0.191  -2.500
  453   2HB   PRO  49          3HB       PRO  49  26.662  -1.125  -3.650
  454   1HG   PRO  49          2HG       PRO  49  25.243   1.468  -3.629
  455   2HG   PRO  49          3HG       PRO  49  25.451   0.341  -4.955
  456   1HD   PRO  49          2HD       PRO  49  23.082   0.723  -3.386
  457   2HD   PRO  49          3HD       PRO  49  23.330  -0.482  -4.633
  458    H    ARG  50           HN       ARG  50  24.047  -2.150   0.043
  459    HA   ARG  50           HA       ARG  50  23.856  -1.612   2.126
  460   1HB   ARG  50          2HB       ARG  50  26.541  -0.514   1.449
  461   2HB   ARG  50          3HB       ARG  50  25.820   0.212   2.872
  462   1HG   ARG  50          2HG       ARG  50  25.365  -2.631   3.023
  463   2HG   ARG  50          3HG       ARG  50  27.052  -2.388   2.617
  464   1HD   ARG  50          2HD       ARG  50  27.311  -2.117   4.884
  465   2HD   ARG  50          3HD       ARG  50  26.765  -0.482   4.570
  466    HE   ARG  50           HE       ARG  50  24.836  -0.978   5.772
  467   1HH1  ARG  50          2HH2      ARG  50  26.114  -3.975   4.445
  468   2HH1  ARG  50          1HH2      ARG  50  24.906  -4.969   5.189
  469   1HH2  ARG  50          2HH1      ARG  50  23.243  -2.288   6.756
  470   2HH2  ARG  50          1HH1      ARG  50  23.262  -4.003   6.513
  471    HA   PRO  51           HA       PRO  51  21.658   2.179   1.772
  472   1HB   PRO  51          2HB       PRO  51  20.114   1.931   4.013
  473   2HB   PRO  51          3HB       PRO  51  19.693   1.206   2.474
  474   1HG   PRO  51          2HG       PRO  51  20.764  -0.093   4.904
  475   2HG   PRO  51          3HG       PRO  51  19.951  -0.825   3.536
  476   1HD   PRO  51          2HD       PRO  51  22.767  -0.864   4.080
  477   2HD   PRO  51          3HD       PRO  51  21.966  -1.494   2.655
  478    H    GLN  52           HN       GLN  52  24.078   2.858   2.224
  479    HA   GLN  52           HA       GLN  52  23.833   5.015   3.916
  480   1HB   GLN  52          2HB       GLN  52  24.107   2.808   5.493
  481   2HB   GLN  52          3HB       GLN  52  25.800   3.179   5.228
  482   1HG   GLN  52          2HG       GLN  52  24.683   5.694   5.759
  483   2HG   GLN  52          3HG       GLN  52  23.790   4.635   6.832
  484   1HE2  GLN  52          1HE2      GLN  52  24.798   3.571   8.488
  485   2HE2  GLN  52          2HE2      GLN  52  26.411   3.913   9.019
  486    H    THR  53           HN       THR  53  24.849   6.156   2.255
  487    HA   THR  53           HA       THR  53  27.129   5.205   0.899
  488    HB   THR  53           HB       THR  53  25.738   7.902   1.227
  489    HG1  THR  53           HG1      THR  53  24.982   5.881  -0.031
  490   1HG2  THR  53          1HG2      THR  53  27.911   8.655   0.604
  491   2HG2  THR  53          2HG2      THR  53  28.261   7.165  -0.305
  492   3HG2  THR  53          3HG2      THR  53  27.129   8.367  -0.969
  493    H    SER  54           HN       SER  54  28.825   4.542   2.156
  494    HA   SER  54           HA       SER  54  29.730   6.352   4.201
  495   1HB   SER  54          2HB       SER  54  31.305   4.538   4.786
  496   2HB   SER  54          3HB       SER  54  29.662   3.937   4.690
  497    HG   SER  54           HG       SER  54  30.409   2.506   3.294
  498    H    LEU  55           HN       LEU  55  31.644   7.576   4.093
  499    HA   LEU  55           HA       LEU  55  33.567   7.087   2.043
  500   1HB   LEU  55          2HB       LEU  55  33.273   8.943   0.686
  501   2HB   LEU  55          3HB       LEU  55  31.670   8.255   0.855
  502    HG   LEU  55           HG       LEU  55  32.486  10.469   2.704
  503   1HD1  LEU  55          1HD1      LEU  55  31.371  11.970   0.833
  504   2HD1  LEU  55          2HD1      LEU  55  33.119  11.635   0.844
  505   3HD1  LEU  55          3HD1      LEU  55  32.044  10.720  -0.240
  506   1HD2  LEU  55          1HD2      LEU  55  30.177   8.992   2.360
  507   2HD2  LEU  55          2HD2      LEU  55  30.316  10.549   3.211
  508   3HD2  LEU  55          3HD2      LEU  55  29.823  10.511   1.502
  509    H    LEU  56           HN       LEU  56  35.436   8.615   2.255
  510    HA   LEU  56           HA       LEU  56  36.274   8.838   4.828
  511   1HB   LEU  56          2HB       LEU  56  38.086  10.030   4.015
  512   2HB   LEU  56          3HB       LEU  56  37.571   9.034   2.668
  513    HG   LEU  56           HG       LEU  56  38.035  11.066   1.662
  514   1HD1  LEU  56          1HD1      LEU  56  35.085  11.339   2.296
  515   2HD1  LEU  56          2HD1      LEU  56  35.952  11.987   0.882
  516   3HD1  LEU  56          3HD1      LEU  56  35.770  10.228   1.084
  517   1HD2  LEU  56          1HD2      LEU  56  38.441  12.805   2.986
  518   2HD2  LEU  56          2HD2      LEU  56  36.694  13.141   2.944
  519   3HD2  LEU  56          3HD2      LEU  56  37.382  12.172   4.269
  Start of MODEL   18
    1   1H5*    C 504          1H5*        C 504  36.243  -4.644  -2.278
    2   2H5*    C 504          2H5*        C 504  36.706  -3.986  -3.848
    3    H4*    C 504           H4*        C 504  38.137  -5.859  -3.029
    4    H3*    C 504           H3*        C 504  36.684  -6.229  -5.667
    5    H2*    C 504           H2*        C 504  38.177  -8.031  -6.066
    6   2HO*    C 504          2HO*        C 504  40.145  -7.747  -5.184
    7    H1*    C 504           H1*        C 504  37.854  -8.676  -3.198
    8   1H4     C 504          1H4         C 504  35.752 -13.905  -6.192
    9   2H4     C 504          2H4         C 504  34.338 -13.023  -6.726
   10    H5     C 504           H5         C 504  34.010 -10.714  -6.358
   11    H6     C 504           H6         C 504  34.968  -8.661  -5.375
   12   1H5*    C 505          1H5*        C 505  39.877  -7.468  -7.195
   13   2H5*    C 505          2H5*        C 505  40.394  -6.219  -8.326
   14    H4*    C 505           H4*        C 505  40.335  -8.119  -9.642
   15    H3*    C 505           H3*        C 505  37.812  -6.542  -9.995
   16    H2*    C 505           H2*        C 505  36.983  -8.133 -11.553
   17   2HO*    C 505          2HO*        C 505  38.867 -10.007 -11.588
   18    H1*    C 505           H1*        C 505  37.659 -10.309  -9.867
   19   1H4     C 505          1H4         C 505  31.391  -9.326  -9.034
   20   2H4     C 505          2H4         C 505  31.774  -8.159  -7.789
   21    H5     C 505           H5         C 505  33.969  -7.448  -7.282
   22    H6     C 505           H6         C 505  36.360  -7.685  -7.851
   23   1H5*    U 506          1H5*        U 506  39.578  -2.638 -10.176
   24   2H5*    U 506          2H5*        U 506  38.432  -2.881  -8.856
   25    H4*    U 506           H4*        U 506  37.476  -1.863 -10.934
   26    H3*    U 506           H3*        U 506  36.309  -4.432  -9.843
   27    H2*    U 506           H2*        U 506  34.568  -4.234 -11.398
   28   2HO*    U 506          2HO*        U 506  35.280  -1.713 -12.340
   29    H1*    U 506           H1*        U 506  36.391  -3.080 -13.366
   30    H3     U 506           H3         U 506  36.397  -6.630 -16.127
   31    H5     U 506           H5         U 506  34.817  -8.196 -12.580
   32    H6     U 506           H6         U 506  35.281  -6.028 -11.532
   33   1H5*    C 507          1H5*        C 507  34.768  -0.339 -10.380
   34   2H5*    C 507          2H5*        C 507  34.346   0.053  -8.713
   35    H4*    C 507           H4*        C 507  33.327   1.267 -10.936
   36    H3*    C 507           H3*        C 507  32.425   1.128  -8.089
   37    H2*    C 507           H2*        C 507  30.379   2.216  -8.612
   38   2HO*    C 507          2HO*        C 507  30.319   3.393 -10.496
   39    H1*    C 507           H1*        C 507  29.812   0.548 -10.777
   40   1H4     C 507          1H4         C 507  26.910  -2.014  -5.659
   41   2H4     C 507          2H4         C 507  28.281  -3.089  -5.499
   42    H5     C 507           H5         C 507  30.249  -2.916  -6.792
   43    H6     C 507           H6         C 507  31.399  -1.655  -8.576
   44   1H5*    C 508          1H5*        C 508  33.902   5.704  -6.816
   45   2H5*    C 508          2H5*        C 508  33.387   5.969  -8.482
   46    H4*    C 508           H4*        C 508  35.149   7.534  -7.210
   47    H3*    C 508           H3*        C 508  34.810   6.920 -10.118
   48    H2*    C 508           H2*        C 508  36.732   8.214 -10.668
   49   2HO*    C 508          2HO*        C 508  36.731   9.870  -9.242
   50    H1*    C 508           H1*        C 508  38.344   6.958  -8.770
   51   1H4     C 508          1H4         C 508  39.451   3.321 -13.865
   52   2H4     C 508          2H4         C 508  37.768   2.850 -13.937
   53    H5     C 508           H5         C 508  36.108   3.672 -12.471
   54    H6     C 508           H6         C 508  35.652   5.162 -10.556
   55   1H5*    G 509          1H5*        G 509  31.989  11.339 -10.413
   56   2H5*    G 509          2H5*        G 509  30.690  10.438  -9.631
   57    H4*    G 509           H4*        G 509  30.593  11.431 -12.156
   58    H3*    G 509           H3*        G 509  29.098   9.143 -10.884
   59    H2*    G 509           H2*        G 509  27.933   8.816 -12.920
   60   2HO*    G 509          2HO*        G 509  27.579  10.712 -13.911
   61    H1*    G 509           H1*        G 509  30.332   9.124 -14.448
   62    H8     G 509           H8         G 509  29.849   6.895 -11.365
   63    H1     G 509           H1         G 509  29.808   3.821 -17.060
   64   1H2     G 509          1H2         G 509  29.963   5.198 -18.587
   65   2H2     G 509          2H2         G 509  30.084   6.929 -18.359
   66   1H5*    U 510          1H5*        U 510  26.382  13.726  -8.817
   67   2H5*    U 510          2H5*        U 510  26.311  12.138  -8.053
   68    H4*    U 510           H4*        U 510  24.182  13.500  -8.036
   69    H3*    U 510           H3*        U 510  24.284  10.667  -9.048
   70    H2*    U 510           H2*        U 510  21.936  10.689  -9.323
   71   2HO*    U 510          2HO*        U 510  21.103  11.802  -7.649
   72    H1*    U 510           H1*        U 510  22.017  13.345 -10.425
   73    H3     U 510           H3         U 510  20.138  10.955 -13.788
   74    H5     U 510           H5         U 510  24.129   9.684 -13.755
   75    H6     U 510           H6         U 510  24.425  10.991 -11.702
   76   1H    ALA   1           HN       ALA   1  15.864   0.779  11.043
   77    HA   ALA   1           HA       ALA   1  13.743  -1.245  10.799
   78   1HB   ALA   1          1HB       ALA   1  14.445  -1.468   8.442
   79   2HB   ALA   1          2HB       ALA   1  13.923   0.195   8.802
   80   3HB   ALA   1          3HB       ALA   1  15.657  -0.187   8.678
   81    H    THR   2           HN       THR   2  17.282  -0.701  10.130
   82    HA   THR   2           HA       THR   2  17.795  -3.236  11.520
   83    HB   THR   2           HB       THR   2  18.672  -2.369   8.725
   84    HG1  THR   2           HG1      THR   2  17.542  -4.773   9.976
   85   1HG2  THR   2          1HG2      THR   2  19.700  -4.695  10.436
   86   2HG2  THR   2          2HG2      THR   2  20.054  -4.450   8.709
   87   3HG2  THR   2          3HG2      THR   2  20.672  -3.297   9.916
   88    H    VAL   3           HN       VAL   3  19.932  -3.438  12.427
   89    HA   VAL   3           HA       VAL   3  20.922  -0.824  13.211
   90    HB   VAL   3           HB       VAL   3  21.462  -3.637  14.176
   91   1HG1  VAL   3          1HG1      VAL   3  23.152  -2.931  15.479
   92   2HG1  VAL   3          2HG1      VAL   3  23.232  -1.535  14.376
   93   3HG1  VAL   3          3HG1      VAL   3  22.319  -1.415  15.900
   94   1HG2  VAL   3          1HG2      VAL   3  19.247  -2.863  14.771
   95   2HG2  VAL   3          2HG2      VAL   3  20.280  -2.841  16.221
   96   3HG2  VAL   3          3HG2      VAL   3  19.904  -1.322  15.373
   97    H    VAL   4           HN       VAL   4  21.871  -0.207  11.158
   98    HA   VAL   4           HA       VAL   4  24.106  -1.874  10.298
   99    HB   VAL   4           HB       VAL   4  22.368  -1.067   8.698
  100   1HG1  VAL   4          1HG1      VAL   4  22.251   1.237   9.890
  101   2HG1  VAL   4          2HG1      VAL   4  23.646   1.660   8.869
  102   3HG1  VAL   4          3HG1      VAL   4  22.106   1.180   8.116
  103   1HG2  VAL   4          1HG2      VAL   4  25.158  -0.014   8.129
  104   2HG2  VAL   4          2HG2      VAL   4  24.673  -1.723   8.013
  105   3HG2  VAL   4          3HG2      VAL   4  23.933  -0.513   6.939
  106    H    SER   5           HN       SER   5  26.127  -1.447  11.007
  107    HA   SER   5           HA       SER   5  26.619   1.299  11.860
  108   1HB   SER   5          2HB       SER   5  27.468  -1.334  13.103
  109   2HB   SER   5          3HB       SER   5  28.394   0.124  13.399
  110    HG   SER   5           HG       SER   5  26.338   1.129  14.128
  111    H    GLY   6           HN       GLY   6  27.912   2.232  10.311
  112   1HA   GLY   6          1HA       GLY   6  29.723   0.571   8.753
  113   2HA   GLY   6          2HA       GLY   6  29.326   2.258   8.496
  114    H    GLN   7           HN       GLN   7  30.935   0.119  10.957
  115    HA   GLN   7           HA       GLN   7  32.467   2.299  11.924
  116   1HB   GLN   7          2HB       GLN   7  31.690   0.244  13.252
  117   2HB   GLN   7          3HB       GLN   7  32.940  -0.667  12.429
  118   1HG   GLN   7          2HG       GLN   7  34.663   0.379  13.573
  119   2HG   GLN   7          3HG       GLN   7  33.825   1.915  13.658
  120   1HE2  GLN   7          1HE2      GLN   7  34.427   2.056  15.845
  121   2HE2  GLN   7          2HE2      GLN   7  33.581   1.200  17.092
  122    H    LYS   8           HN       LYS   8  33.768   3.168  10.278
  123    HA   LYS   8           HA       LYS   8  36.149   1.734   9.719
  124   1HB   LYS   8          2HB       LYS   8  35.958   1.444   7.359
  125   2HB   LYS   8          3HB       LYS   8  34.585   0.650   8.103
  126   1HG   LYS   8          2HG       LYS   8  33.062   2.337   7.417
  127   2HG   LYS   8          3HG       LYS   8  34.326   3.531   7.201
  128   1HD   LYS   8          2HD       LYS   8  34.275   1.023   5.487
  129   2HD   LYS   8          3HD       LYS   8  33.268   2.396   5.076
  130   1HE   LYS   8          2HE       LYS   8  35.788   3.548   5.598
  131   2HE   LYS   8          3HE       LYS   8  36.177   2.059   4.759
  132   1HZ   LYS   8          1HZ       LYS   8  35.487   2.972   2.898
  133   2HZ   LYS   8          2HZ       LYS   8  34.004   3.284   3.506
  134   3HZ   LYS   8          3HZ       LYS   8  35.201   4.384   3.667
  135    H    GLN   9           HN       GLN   9  37.785   3.130   8.846
  136    HA   GLN   9           HA       GLN   9  36.906   5.880   8.511
  137   1HB   GLN   9          2HB       GLN   9  38.936   4.817  10.478
  138   2HB   GLN   9          3HB       GLN   9  39.191   6.404   9.782
  139   1HG   GLN   9          2HG       GLN   9  37.205   7.292  10.726
  140   2HG   GLN   9          3HG       GLN   9  36.475   5.711  10.932
  141   1HE2  GLN   9          1HE2      GLN   9  36.281   5.174  12.956
  142   2HE2  GLN   9          2HE2      GLN   9  37.403   5.471  14.241
  143    H    ASP  10           HN       ASP  10  37.426   6.326   6.410
  144    HA   ASP  10           HA       ASP  10  39.152   4.923   4.881
  145   1HB   ASP  10          2HB       ASP  10  39.266   7.050   3.460
  146   2HB   ASP  10          3HB       ASP  10  37.656   6.468   3.830
  147    H    ARG  11           HN       ARG  11  41.390   5.343   4.151
  148    HA   ARG  11           HA       ARG  11  42.824   7.285   5.744
  149   1HB   ARG  11          2HB       ARG  11  42.917   4.730   6.582
  150   2HB   ARG  11          3HB       ARG  11  44.104   4.579   5.303
  151   1HG   ARG  11          2HG       ARG  11  44.383   6.930   7.163
  152   2HG   ARG  11          3HG       ARG  11  44.768   5.348   7.811
  153   1HD   ARG  11          2HD       ARG  11  46.188   5.074   5.581
  154   2HD   ARG  11          3HD       ARG  11  46.096   6.823   5.519
  155    HE   ARG  11           HE       ARG  11  46.879   6.301   8.136
  156   1HH1  ARG  11          2HH2      ARG  11  48.131   5.436   4.963
  157   2HH1  ARG  11          1HH2      ARG  11  49.777   5.353   5.495
  158   1HH2  ARG  11          2HH1      ARG  11  49.051   6.191   8.838
  159   2HH2  ARG  11          1HH1      ARG  11  50.304   5.785   7.713
  160    H    GLN  12           HN       GLN  12  44.712   8.139   4.666
  161    HA   GLN  12           HA       GLN  12  46.094   8.552   3.029
  162   1HB   GLN  12          2HB       GLN  12  46.124   5.917   2.841
  163   2HB   GLN  12          3HB       GLN  12  45.186   6.180   1.384
  164   1HG   GLN  12          2HG       GLN  12  47.486   8.004   1.508
  165   2HG   GLN  12          3HG       GLN  12  47.997   6.333   1.634
  166   1HE2  GLN  12          1HE2      GLN  12  47.680   8.689  -0.475
  167   2HE2  GLN  12          2HE2      GLN  12  47.235   7.855  -1.927
  168    H    GLY  13           HN       GLY  13  43.152   7.033   1.508
  169   1HA   GLY  13          1HA       GLY  13  41.499   8.735   0.726
  170   2HA   GLY  13          2HA       GLY  13  42.847   9.510  -0.083
  171    H    GLY  14           HN       GLY  14  43.412   8.853  -2.139
  172   1HA   GLY  14          1HA       GLY  14  43.353   6.315  -3.176
  173   2HA   GLY  14          2HA       GLY  14  41.740   6.941  -3.452
  174    H    GLU  15           HN       GLU  15  41.456   8.931  -4.729
  175    HA   GLU  15           HA       GLU  15  41.797   9.978  -6.617
  176   1HB   GLU  15          2HB       GLU  15  44.171  10.626  -4.907
  177   2HB   GLU  15          3HB       GLU  15  44.246  11.154  -6.577
  178   1HG   GLU  15          2HG       GLU  15  42.849  12.879  -6.126
  179   2HG   GLU  15          3HG       GLU  15  41.604  11.764  -5.597
  180    H    ARG  16           HN       ARG  16  41.772   8.425  -8.264
  181    HA   ARG  16           HA       ARG  16  44.404   7.759  -9.253
  182   1HB   ARG  16          2HB       ARG  16  42.161   5.769  -8.686
  183   2HB   ARG  16          3HB       ARG  16  43.451   5.402  -9.813
  184   1HG   ARG  16          2HG       ARG  16  44.380   6.461  -7.187
  185   2HG   ARG  16          3HG       ARG  16  43.555   4.917  -7.092
  186   1HD   ARG  16          2HD       ARG  16  45.404   3.859  -7.874
  187   2HD   ARG  16          3HD       ARG  16  45.334   4.794  -9.355
  188    HE   ARG  16           HE       ARG  16  46.434   6.453  -7.300
  189   1HH1  ARG  16          2HH2      ARG  16  47.274   3.622  -9.212
  190   2HH1  ARG  16          1HH2      ARG  16  48.980   3.913  -9.129
  191   1HH2  ARG  16          2HH1      ARG  16  48.683   6.839  -7.189
  192   2HH2  ARG  16          1HH1      ARG  16  49.786   5.756  -7.970
  193    H    ARG  17           HN       ARG  17  44.444   7.414 -11.589
  194    HA   ARG  17           HA       ARG  17  42.487   8.898 -12.913
  195   1HB   ARG  17          2HB       ARG  17  44.760   7.110 -13.888
  196   2HB   ARG  17          3HB       ARG  17  43.731   7.984 -15.004
  197   1HG   ARG  17          2HG       ARG  17  44.757   9.686 -12.807
  198   2HG   ARG  17          3HG       ARG  17  46.034   8.990 -13.786
  199   1HD   ARG  17          2HD       ARG  17  45.597  10.443 -15.476
  200   2HD   ARG  17          3HD       ARG  17  43.928   9.915 -15.553
  201    HE   ARG  17           HE       ARG  17  44.073  11.575 -13.289
  202   1HH1  ARG  17          2HH2      ARG  17  44.662  11.910 -16.742
  203   2HH1  ARG  17          1HH2      ARG  17  44.256  13.594 -16.778
  204   1HH2  ARG  17          2HH1      ARG  17  43.537  13.796 -13.335
  205   2HH2  ARG  17          1HH1      ARG  17  43.611  14.674 -14.827
  206    H    ARG  18           HN       ARG  18  41.172   8.067 -14.830
  207    HA   ARG  18           HA       ARG  18  40.427   5.289 -14.394
  208   1HB   ARG  18          2HB       ARG  18  38.048   5.975 -14.947
  209   2HB   ARG  18          3HB       ARG  18  38.642   6.653 -13.443
  210   1HG   ARG  18          2HG       ARG  18  39.391   8.500 -15.495
  211   2HG   ARG  18          3HG       ARG  18  37.735   8.040 -15.838
  212   1HD   ARG  18          2HD       ARG  18  36.932   8.854 -13.762
  213   2HD   ARG  18          3HD       ARG  18  38.502   8.743 -12.992
  214    HE   ARG  18           HE       ARG  18  37.519  10.955 -14.650
  215   1HH1  ARG  18          2HH2      ARG  18  40.375   9.369 -13.342
  216   2HH1  ARG  18          1HH2      ARG  18  41.374  10.778 -13.473
  217   1HH2  ARG  18          2HH1      ARG  18  38.836  12.814 -14.823
  218   2HH2  ARG  18          1HH1      ARG  18  40.493  12.750 -14.322
  219    H    SER  19           HN       SER  19  42.349   5.890 -16.278
  220    HA   SER  19           HA       SER  19  42.872   5.950 -18.398
  221   1HB   SER  19          2HB       SER  19  40.591   4.016 -18.196
  222   2HB   SER  19          3HB       SER  19  41.092   4.458 -19.816
  223    HG   SER  19           HG       SER  19  42.222   2.632 -18.274
  224    H    GLN  20           HN       GLN  20  39.476   5.542 -19.408
  225    HA   GLN  20           HA       GLN  20  39.240   8.364 -19.928
  226   1HB   GLN  20          2HB       GLN  20  40.160   6.615 -21.952
  227   2HB   GLN  20          3HB       GLN  20  38.469   6.881 -22.328
  228   1HG   GLN  20          2HG       GLN  20  39.503   8.689 -23.423
  229   2HG   GLN  20          3HG       GLN  20  38.993   9.421 -21.915
  230   1HE2  GLN  20          1HE2      GLN  20  41.704   7.780 -23.498
  231   2HE2  GLN  20          2HE2      GLN  20  42.984   8.604 -22.672
  232    H    LEU  21           HN       LEU  21  37.863   6.926 -18.009
  233    HA   LEU  21           HA       LEU  21  35.648   5.531 -18.634
  234   1HB   LEU  21          2HB       LEU  21  36.644   6.446 -16.387
  235   2HB   LEU  21          3HB       LEU  21  35.462   7.721 -16.605
  236    HG   LEU  21           HG       LEU  21  34.995   4.776 -16.172
  237   1HD1  LEU  21          1HD1      LEU  21  33.422   5.720 -14.424
  238   2HD1  LEU  21          2HD1      LEU  21  35.162   5.978 -14.143
  239   3HD1  LEU  21          3HD1      LEU  21  34.151   7.309 -14.755
  240   1HD2  LEU  21          1HD2      LEU  21  32.481   5.577 -16.447
  241   2HD2  LEU  21          2HD2      LEU  21  33.229   6.727 -17.583
  242   3HD2  LEU  21          3HD2      LEU  21  33.435   4.975 -17.824
  243    H    ASP  22           HN       ASP  22  34.529   5.958 -20.516
  244    HA   ASP  22           HA       ASP  22  33.896   8.574 -21.281
  245   1HB   ASP  22          2HB       ASP  22  32.431   6.041 -22.131
  246   2HB   ASP  22          3HB       ASP  22  32.600   7.526 -23.048
  247    H    ARG  23           HN       ARG  23  31.663   9.517 -21.379
  248    HA   ARG  23           HA       ARG  23  30.305   9.143 -18.976
  249   1HB   ARG  23          2HB       ARG  23  29.657  10.650 -21.546
  250   2HB   ARG  23          3HB       ARG  23  28.539  10.643 -20.196
  251   1HG   ARG  23          2HG       ARG  23  31.465  11.463 -19.916
  252   2HG   ARG  23          3HG       ARG  23  30.187  12.609 -20.270
  253   1HD   ARG  23          2HD       ARG  23  29.898  10.748 -17.892
  254   2HD   ARG  23          3HD       ARG  23  30.912  12.170 -17.753
  255    HE   ARG  23           HE       ARG  23  28.492  13.067 -18.888
  256   1HH1  ARG  23          2HH2      ARG  23  29.517  11.523 -15.897
  257   2HH1  ARG  23          1HH2      ARG  23  28.243  12.218 -14.951
  258   1HH2  ARG  23          2HH1      ARG  23  26.811  13.984 -17.642
  259   2HH2  ARG  23          1HH1      ARG  23  26.693  13.628 -15.951
  260    H    ASP  24           HN       ASP  24  30.391   7.205 -21.718
  261    HA   ASP  24           HA       ASP  24  27.757   6.153 -21.072
  262   1HB   ASP  24          2HB       ASP  24  27.966   7.483 -23.327
  263   2HB   ASP  24          3HB       ASP  24  28.897   6.110 -23.892
  264    H    GLN  25           HN       GLN  25  30.643   5.518 -20.314
  265    HA   GLN  25           HA       GLN  25  30.771   2.865 -21.525
  266   1HB   GLN  25          2HB       GLN  25  32.729   4.014 -22.243
  267   2HB   GLN  25          3HB       GLN  25  32.968   4.779 -20.684
  268   1HG   GLN  25          2HG       GLN  25  33.381   2.468 -19.691
  269   2HG   GLN  25          3HG       GLN  25  33.311   1.811 -21.313
  270   1HE2  GLN  25          1HE2      GLN  25  35.142   3.542 -18.985
  271   2HE2  GLN  25          2HE2      GLN  25  36.609   3.743 -19.883
  272    H    CYS  26           HN       CYS  26  30.569   1.138 -20.144
  273    HA   CYS  26           HA       CYS  26  29.794   1.511 -17.531
  274   1HB   CYS  26          2HB       CYS  26  29.290  -0.511 -18.834
  275   2HB   CYS  26          3HB       CYS  26  30.980  -0.974 -18.813
  276    H    ALA  27           HN       ALA  27  30.916   1.612 -15.562
  277    HA   ALA  27           HA       ALA  27  33.832   1.738 -15.814
  278   1HB   ALA  27          1HB       ALA  27  31.812   2.954 -13.907
  279   2HB   ALA  27          2HB       ALA  27  33.554   2.920 -13.541
  280   3HB   ALA  27          3HB       ALA  27  32.964   3.784 -14.980
  281    H    TYR  28           HN       TYR  28  32.326  -0.803 -15.762
  282    HA   TYR  28           HA       TYR  28  33.423  -1.833 -13.237
  283   1HB   TYR  28          2HB       TYR  28  30.798  -1.551 -13.571
  284   2HB   TYR  28          3HB       TYR  28  30.945  -2.848 -14.740
  285    HD1  TYR  28           HD1      TYR  28  30.845  -1.986 -11.207
  286    HD2  TYR  28           HD2      TYR  28  31.658  -5.130 -13.993
  287    HE1  TYR  28           HE1      TYR  28  30.646  -3.701  -9.341
  288    HE2  TYR  28           HE2      TYR  28  31.457  -6.834 -12.118
  289    HH   TYR  28           HH       TYR  28  30.518  -7.082 -10.007
  290    H    CYS  29           HN       CYS  29  31.952  -3.000 -16.357
  291    HA   CYS  29           HA       CYS  29  33.965  -5.079 -16.414
  292   1HB   CYS  29          2HB       CYS  29  32.651  -6.004 -18.276
  293   2HB   CYS  29          3HB       CYS  29  31.666  -5.749 -16.850
  294    H    LYS  30           HN       LYS  30  33.650  -1.849 -17.329
  295    HA   LYS  30           HA       LYS  30  34.884  -0.531 -18.608
  296   1HB   LYS  30          2HB       LYS  30  36.472  -3.054 -18.775
  297   2HB   LYS  30          3HB       LYS  30  36.822  -1.800 -19.947
  298   1HG   LYS  30          2HG       LYS  30  36.677  -1.279 -16.943
  299   2HG   LYS  30          3HG       LYS  30  38.168  -1.675 -17.774
  300   1HD   LYS  30          2HD       LYS  30  38.262   0.370 -18.899
  301   2HD   LYS  30          3HD       LYS  30  36.520   0.561 -18.929
  302   1HE   LYS  30          2HE       LYS  30  37.200   2.179 -17.341
  303   2HE   LYS  30          3HE       LYS  30  36.688   0.839 -16.335
  304   1HZ   LYS  30          1HZ       LYS  30  39.387   0.548 -17.051
  305   2HZ   LYS  30          2HZ       LYS  30  39.150   2.014 -16.369
  306   3HZ   LYS  30          3HZ       LYS  30  38.726   0.659 -15.561
  307    H    GLU  31           HN       GLU  31  32.451  -2.144 -19.472
  308    HA   GLU  31           HA       GLU  31  32.906  -2.451 -22.282
  309   1HB   GLU  31          2HB       GLU  31  31.435  -4.022 -21.042
  310   2HB   GLU  31          3HB       GLU  31  30.362  -2.704 -20.618
  311   1HG   GLU  31          2HG       GLU  31  29.681  -2.371 -22.900
  312   2HG   GLU  31          3HG       GLU  31  31.018  -3.317 -23.524
  313    H    LYS  32           HN       LYS  32  31.135  -1.427 -23.811
  314    HA   LYS  32           HA       LYS  32  30.620   1.320 -22.917
  315   1HB   LYS  32          2HB       LYS  32  32.043   0.358 -25.376
  316   2HB   LYS  32          3HB       LYS  32  31.061   1.805 -25.480
  317   1HG   LYS  32          2HG       LYS  32  32.839   2.941 -24.635
  318   2HG   LYS  32          3HG       LYS  32  32.482   2.186 -23.095
  319   1HD   LYS  32          2HD       LYS  32  34.262   0.745 -23.236
  320   2HD   LYS  32          3HD       LYS  32  34.003   0.429 -24.940
  321   1HE   LYS  32          2HE       LYS  32  35.308   2.254 -25.629
  322   2HE   LYS  32          3HE       LYS  32  35.007   3.165 -24.163
  323   1HZ   LYS  32          1HZ       LYS  32  37.251   1.946 -24.562
  324   2HZ   LYS  32          2HZ       LYS  32  36.617   2.051 -23.060
  325   3HZ   LYS  32          3HZ       LYS  32  36.460   0.670 -23.918
  326    H    GLY  33           HN       GLY  33  28.530   1.948 -23.142
  327   1HA   GLY  33          1HA       GLY  33  26.695   1.918 -24.874
  328   2HA   GLY  33          2HA       GLY  33  26.785   0.174 -24.737
  329    H    HIS  34           HN       HIS  34  27.250  -0.108 -21.922
  330    HA   HIS  34           HA       HIS  34  24.720   0.965 -20.901
  331   1HB   HIS  34          2HB       HIS  34  24.423  -1.029 -19.635
  332   2HB   HIS  34          3HB       HIS  34  24.757  -1.493 -21.291
  333    HD1  HIS  34           HD1      HIS  34  26.944  -2.798 -21.772
  334    HD2  HIS  34           HD2      HIS  34  26.481  -1.668 -17.758
  335    HE1  HIS  34           HE1      HIS  34  28.715  -4.081 -20.457
  336    H    TRP  35           HN       TRP  35  24.705   1.191 -18.432
  337    HA   TRP  35           HA       TRP  35  27.242   2.428 -17.673
  338   1HB   TRP  35          2HB       TRP  35  24.385   2.893 -17.037
  339   2HB   TRP  35          3HB       TRP  35  25.521   3.148 -15.728
  340    HD1  TRP  35           HD1      TRP  35  25.899   4.131 -19.500
  341    HE1  TRP  35           HE1      TRP  35  26.468   6.698 -19.728
  342    HE3  TRP  35           HE3      TRP  35  25.649   5.165 -14.528
  343    HZ2  TRP  35           HZ2      TRP  35  26.744   8.825 -17.845
  344    HZ3  TRP  35           HZ3      TRP  35  26.082   7.512 -13.806
  345    HH2  TRP  35           HH2      TRP  35  26.613   9.311 -15.373
  346    H    ALA  36           HN       ALA  36  27.969   2.070 -15.369
  347    HA   ALA  36           HA       ALA  36  28.224  -0.643 -14.830
  348   1HB   ALA  36          1HB       ALA  36  29.867   0.914 -14.047
  349   2HB   ALA  36          2HB       ALA  36  28.647   1.861 -13.164
  350   3HB   ALA  36          3HB       ALA  36  29.090   0.233 -12.598
  351    H    LYS  37           HN       LYS  37  25.881   1.824 -13.696
  352    HA   LYS  37           HA       LYS  37  24.776   0.264 -11.645
  353   1HB   LYS  37          2HB       LYS  37  24.067   2.746 -13.123
  354   2HB   LYS  37          3HB       LYS  37  22.749   1.915 -12.322
  355   1HG   LYS  37          2HG       LYS  37  23.481   3.199 -10.539
  356   2HG   LYS  37          3HG       LYS  37  24.505   1.799 -10.291
  357   1HD   LYS  37          2HD       LYS  37  26.200   3.346 -10.304
  358   2HD   LYS  37          3HD       LYS  37  26.075   3.186 -12.044
  359   1HE   LYS  37          2HE       LYS  37  25.719   5.441 -12.057
  360   2HE   LYS  37          3HE       LYS  37  24.093   5.058 -11.528
  361   1HZ   LYS  37          1HZ       LYS  37  26.183   6.276 -10.082
  362   2HZ   LYS  37          2HZ       LYS  37  24.592   6.197  -9.724
  363   3HZ   LYS  37          3HZ       LYS  37  25.594   4.990  -9.266
  364    H    ASP  38           HN       ASP  38  24.779  -0.134 -15.047
  365    HA   ASP  38           HA       ASP  38  22.495  -1.921 -14.766
  366   1HB   ASP  38          2HB       ASP  38  22.543   0.332 -16.370
  367   2HB   ASP  38          3HB       ASP  38  23.122  -0.882 -17.493
  368    H    CYS  39           HN       CYS  39  25.449  -2.345 -14.421
  369    HA   CYS  39           HA       CYS  39  26.495  -3.468 -16.782
  370   1HB   CYS  39          2HB       CYS  39  27.878  -2.608 -14.897
  371   2HB   CYS  39          3HB       CYS  39  27.344  -3.952 -13.907
  372    HA   PRO  40           HA       PRO  40  24.340  -7.267 -16.493
  373   1HB   PRO  40          2HB       PRO  40  25.576  -8.601 -18.532
  374   2HB   PRO  40          3HB       PRO  40  24.254  -7.478 -18.783
  375   1HG   PRO  40          2HG       PRO  40  27.139  -7.094 -19.305
  376   2HG   PRO  40          3HG       PRO  40  25.780  -6.180 -19.928
  377   1HD   PRO  40          2HD       PRO  40  27.573  -5.381 -17.835
  378   2HD   PRO  40          3HD       PRO  40  26.147  -4.520 -18.379
  379    H    LYS  41           HN       LYS  41  27.357  -6.690 -15.459
  380    HA   LYS  41           HA       LYS  41  27.831  -9.512 -14.842
  381   1HB   LYS  41          2HB       LYS  41  29.638  -8.259 -15.986
  382   2HB   LYS  41          3HB       LYS  41  29.700  -7.130 -14.648
  383   1HG   LYS  41          2HG       LYS  41  30.481  -8.798 -13.116
  384   2HG   LYS  41          3HG       LYS  41  29.995 -10.117 -14.164
  385   1HD   LYS  41          2HD       LYS  41  31.721  -9.355 -15.853
  386   2HD   LYS  41          3HD       LYS  41  32.246  -8.127 -14.719
  387   1HE   LYS  41          2HE       LYS  41  33.729  -9.761 -14.061
  388   2HE   LYS  41          3HE       LYS  41  32.380 -10.294 -13.076
  389   1HZ   LYS  41          1HZ       LYS  41  33.195 -12.115 -14.317
  390   2HZ   LYS  41          2HZ       LYS  41  31.738 -11.732 -14.944
  391   3HZ   LYS  41          3HZ       LYS  41  33.103 -11.310 -15.734
  392    H    LYS  42           HN       LYS  42  26.613  -6.537 -13.564
  393    HA   LYS  42           HA       LYS  42  27.398  -6.872 -10.882
  394   1HB   LYS  42          2HB       LYS  42  25.787  -5.059 -12.457
  395   2HB   LYS  42          3HB       LYS  42  24.949  -5.464 -10.972
  396   1HG   LYS  42          2HG       LYS  42  27.447  -5.083  -9.955
  397   2HG   LYS  42          3HG       LYS  42  27.563  -4.035 -11.355
  398   1HD   LYS  42          2HD       LYS  42  25.009  -3.718  -9.890
  399   2HD   LYS  42          3HD       LYS  42  26.410  -3.358  -8.901
  400   1HE   LYS  42          2HE       LYS  42  27.121  -2.047 -11.202
  401   2HE   LYS  42          3HE       LYS  42  25.376  -1.929 -11.321
  402   1HZ   LYS  42          1HZ       LYS  42  26.804  -0.245  -9.936
  403   2HZ   LYS  42          2HZ       LYS  42  25.275  -0.630  -9.506
  404   3HZ   LYS  42          3HZ       LYS  42  26.539  -1.332  -8.747
  405    HA   PRO  43           HA       PRO  43  24.754 -10.206  -9.958
  406   1HB   PRO  43          2HB       PRO  43  25.498 -10.542  -7.350
  407   2HB   PRO  43          3HB       PRO  43  26.375 -11.244  -8.694
  408   1HG   PRO  43          2HG       PRO  43  27.099  -8.916  -7.022
  409   2HG   PRO  43          3HG       PRO  43  28.126  -9.881  -8.064
  410   1HD   PRO  43          2HD       PRO  43  27.082  -7.269  -8.627
  411   2HD   PRO  43          3HD       PRO  43  28.012  -8.282  -9.712
  412    H    ARG  44           HN       ARG  44  22.721  -9.349 -10.255
  413    HA   ARG  44           HA       ARG  44  20.798  -8.596  -9.622
  414   1HB   ARG  44          2HB       ARG  44  21.770 -10.014  -7.336
  415   2HB   ARG  44          3HB       ARG  44  21.027  -8.556  -6.710
  416   1HG   ARG  44          2HG       ARG  44  18.906  -9.066  -7.699
  417   2HG   ARG  44          3HG       ARG  44  19.598 -10.248  -8.791
  418   1HD   ARG  44          2HD       ARG  44  20.083 -11.775  -6.914
  419   2HD   ARG  44          3HD       ARG  44  19.565 -10.570  -5.752
  420    HE   ARG  44           HE       ARG  44  17.305 -11.009  -6.297
  421   1HH1  ARG  44          2HH2      ARG  44  19.457 -12.668  -8.534
  422   2HH1  ARG  44          1HH2      ARG  44  18.201 -13.648  -9.215
  423   1HH2  ARG  44          2HH1      ARG  44  15.649 -12.302  -7.196
  424   2HH2  ARG  44          1HH1      ARG  44  16.021 -13.438  -8.448
  425    H    GLY  45           HN       GLY  45  20.971  -6.418 -10.310
  426   1HA   GLY  45          1HA       GLY  45  21.716  -4.488  -8.195
  427   2HA   GLY  45          2HA       GLY  45  22.190  -4.293  -9.870
  428    HA   PRO  46           HA       PRO  46  22.059  -2.312  -9.281
  429   1HB   PRO  46          2HB       PRO  46  21.314   0.121  -8.284
  430   2HB   PRO  46          3HB       PRO  46  21.531  -0.187  -9.995
  431   1HG   PRO  46          2HG       PRO  46  19.017   0.109  -8.470
  432   2HG   PRO  46          3HG       PRO  46  19.272   0.227 -10.199
  433   1HD   PRO  46          2HD       PRO  46  18.128  -1.987  -8.779
  434   2HD   PRO  46          3HD       PRO  46  18.489  -1.915 -10.492
  435    H    ARG  47           HN       ARG  47  23.431  -1.642  -7.465
  436    HA   ARG  47           HA       ARG  47  22.670  -3.203  -5.261
  437   1HB   ARG  47          2HB       ARG  47  25.063  -2.164  -6.280
  438   2HB   ARG  47          3HB       ARG  47  24.852  -1.243  -4.805
  439   1HG   ARG  47          2HG       ARG  47  24.349  -4.191  -4.594
  440   2HG   ARG  47          3HG       ARG  47  26.012  -3.716  -4.880
  441   1HD   ARG  47          2HD       ARG  47  26.244  -3.112  -2.705
  442   2HD   ARG  47          3HD       ARG  47  24.939  -1.953  -2.861
  443    HE   ARG  47           HE       ARG  47  24.001  -4.717  -2.590
  444   1HH1  ARG  47          2HH2      ARG  47  24.990  -1.824  -0.848
  445   2HH1  ARG  47          1HH2      ARG  47  24.129  -2.244   0.595
  446   1HH2  ARG  47          2HH1      ARG  47  22.864  -5.270  -0.686
  447   2HH2  ARG  47          1HH1      ARG  47  22.911  -4.217   0.688
  448    H    GLY  48           HN       GLY  48  22.850  -2.225  -2.913
  449   1HA   GLY  48          1HA       GLY  48  20.774  -0.505  -2.423
  450   2HA   GLY  48          2HA       GLY  48  22.118  -0.797  -1.337
  451    HA   PRO  49           HA       PRO  49  22.267   3.496  -3.174
  452   1HB   PRO  49          2HB       PRO  49  20.799   4.984  -1.413
  453   2HB   PRO  49          3HB       PRO  49  20.167   4.412  -2.944
  454   1HG   PRO  49          2HG       PRO  49  19.613   3.408  -0.220
  455   2HG   PRO  49          3HG       PRO  49  18.698   3.149  -1.691
  456   1HD   PRO  49          2HD       PRO  49  20.457   1.278  -0.415
  457   2HD   PRO  49          3HD       PRO  49  19.632   1.064  -1.946
  458    H    ARG  50           HN       ARG  50  24.381   2.550  -2.311
  459    HA   ARG  50           HA       ARG  50  25.182   2.914   0.210
  460   1HB   ARG  50          2HB       ARG  50  26.512   2.899  -2.454
  461   2HB   ARG  50          3HB       ARG  50  27.453   3.690  -1.204
  462   1HG   ARG  50          2HG       ARG  50  27.050   1.626   0.267
  463   2HG   ARG  50          3HG       ARG  50  26.346   0.846  -1.135
  464   1HD   ARG  50          2HD       ARG  50  28.577   1.472  -2.362
  465   2HD   ARG  50          3HD       ARG  50  29.219   1.776  -0.760
  466    HE   ARG  50           HE       ARG  50  29.168  -0.537  -0.300
  467   1HH1  ARG  50          2HH2      ARG  50  27.426   0.141  -3.281
  468   2HH1  ARG  50          1HH2      ARG  50  27.294  -1.526  -3.733
  469   1HH2  ARG  50          2HH1      ARG  50  28.994  -2.736  -0.896
  470   2HH2  ARG  50          1HH1      ARG  50  28.192  -3.173  -2.368
  471    HA   PRO  51           HA       PRO  51  25.300   7.232   0.844
  472   1HB   PRO  51          2HB       PRO  51  26.912   7.374   3.046
  473   2HB   PRO  51          3HB       PRO  51  25.208   6.973   3.131
  474   1HG   PRO  51          2HG       PRO  51  27.547   5.187   3.403
  475   2HG   PRO  51          3HG       PRO  51  25.889   4.906   3.894
  476   1HD   PRO  51          2HD       PRO  51  27.201   3.820   1.587
  477   2HD   PRO  51          3HD       PRO  51  25.512   3.634   2.017
  478    H    GLN  52           HN       GLN  52  26.155   8.212  -0.931
  479    HA   GLN  52           HA       GLN  52  28.945   8.841  -0.552
  480   1HB   GLN  52          2HB       GLN  52  27.892   7.090  -2.695
  481   2HB   GLN  52          3HB       GLN  52  28.866   8.416  -3.297
  482   1HG   GLN  52          2HG       GLN  52  29.948   6.947  -0.914
  483   2HG   GLN  52          3HG       GLN  52  29.930   6.064  -2.428
  484   1HE2  GLN  52          1HE2      GLN  52  31.826   7.815  -0.530
  485   2HE2  GLN  52          2HE2      GLN  52  32.883   8.589  -1.663
  486    H    THR  53           HN       THR  53  29.377  10.973  -1.072
  487    HA   THR  53           HA       THR  53  27.285  12.378  -2.602
  488    HB   THR  53           HB       THR  53  27.227  12.862  -0.132
  489    HG1  THR  53           HG1      THR  53  27.633  15.245  -0.580
  490   1HG2  THR  53          1HG2      THR  53  30.143  13.269  -0.636
  491   2HG2  THR  53          2HG2      THR  53  29.355  14.585   0.269
  492   3HG2  THR  53          3HG2      THR  53  29.299  12.918   0.892
  493    H    SER  54           HN       SER  54  27.937  14.010  -4.042
  494    HA   SER  54           HA       SER  54  30.811  13.967  -4.544
  495   1HB   SER  54          2HB       SER  54  29.610  12.710  -6.292
  496   2HB   SER  54          3HB       SER  54  28.529  14.063  -6.566
  497    HG   SER  54           HG       SER  54  31.238  13.716  -7.347
  498    H    LEU  55           HN       LEU  55  31.629  15.995  -5.655
  499    HA   LEU  55           HA       LEU  55  30.674  18.267  -4.315
  500   1HB   LEU  55          2HB       LEU  55  32.965  17.513  -5.649
  501   2HB   LEU  55          3HB       LEU  55  32.297  18.743  -6.703
  502    HG   LEU  55           HG       LEU  55  32.197  19.652  -3.962
  503   1HD1  LEU  55          1HD1      LEU  55  34.187  17.928  -4.008
  504   2HD1  LEU  55          2HD1      LEU  55  35.038  19.264  -4.820
  505   3HD1  LEU  55          3HD1      LEU  55  34.351  19.503  -3.194
  506   1HD2  LEU  55          1HD2      LEU  55  32.508  20.720  -6.491
  507   2HD2  LEU  55          2HD2      LEU  55  32.648  21.601  -4.950
  508   3HD2  LEU  55          3HD2      LEU  55  34.106  20.964  -5.746
  509    H    LEU  56           HN       LEU  56  28.655  19.056  -4.671
  510    HA   LEU  56           HA       LEU  56  27.929  19.476  -7.487
  511   1HB   LEU  56          2HB       LEU  56  26.627  17.888  -5.559
  512   2HB   LEU  56          3HB       LEU  56  25.647  19.329  -5.737
  513    HG   LEU  56           HG       LEU  56  26.093  18.730  -8.353
  514   1HD1  LEU  56          1HD1      LEU  56  27.005  16.437  -7.003
  515   2HD1  LEU  56          2HD1      LEU  56  25.414  16.010  -7.679
  516   3HD1  LEU  56          3HD1      LEU  56  26.696  16.632  -8.747
  517   1HD2  LEU  56          1HD2      LEU  56  23.898  19.027  -8.087
  518   2HD2  LEU  56          2HD2      LEU  56  23.813  17.272  -7.804
  519   3HD2  LEU  56          3HD2      LEU  56  23.922  18.391  -6.425
  Start of MODEL   19
    1   1H5*    C 504          1H5*        C 504  36.717  -9.463  -3.831
    2   2H5*    C 504          2H5*        C 504  38.143  -8.509  -4.240
    3    H4*    C 504           H4*        C 504  38.627 -10.714  -4.898
    4    H3*    C 504           H3*        C 504  38.030  -8.871  -7.164
    5    H2*    C 504           H2*        C 504  37.300 -10.686  -8.373
    6   2HO*    C 504          2HO*        C 504  39.198 -11.018  -9.369
    7    H1*    C 504           H1*        C 504  38.274 -12.989  -7.041
    8   1H4     C 504          1H4         C 504  32.086 -14.007  -5.960
    9   2H4     C 504          2H4         C 504  31.746 -12.304  -6.167
   10    H5     C 504           H5         C 504  33.406 -10.666  -6.541
   11    H6     C 504           H6         C 504  35.827 -10.258  -6.812
   12   1H5*    C 505          1H5*        C 505  38.612  -7.648  -8.633
   13   2H5*    C 505          2H5*        C 505  39.620  -9.037  -9.037
   14    H4*    C 505           H4*        C 505  40.861  -6.683 -10.088
   15    H3*    C 505           H3*        C 505  37.915  -6.657 -10.364
   16    H2*    C 505           H2*        C 505  37.947  -6.419 -12.715
   17   2HO*    C 505          2HO*        C 505  40.806  -6.374 -12.571
   18    H1*    C 505           H1*        C 505  39.681  -8.468 -13.226
   19   1H4     C 505          1H4         C 505  34.200 -11.676 -12.879
   20   2H4     C 505          2H4         C 505  34.085 -11.350 -11.164
   21    H5     C 505           H5         C 505  35.633 -10.025  -9.970
   22    H6     C 505           H6         C 505  37.692  -8.673 -10.129
   23   1H5*    U 506          1H5*        U 506  40.263  -2.515 -10.446
   24   2H5*    U 506          2H5*        U 506  39.622  -1.210  -9.448
   25    H4*    U 506           H4*        U 506  38.329  -0.862 -11.260
   26    H3*    U 506           H3*        U 506  36.845  -3.058  -9.807
   27    H2*    U 506           H2*        U 506  35.265  -3.078 -11.496
   28   2HO*    U 506          2HO*        U 506  34.621  -1.006 -11.668
   29    H1*    U 506           H1*        U 506  37.302  -2.023 -13.396
   30    H3     U 506           H3         U 506  36.851  -5.318 -16.394
   31    H5     U 506           H5         U 506  35.192  -7.003 -12.936
   32    H6     U 506           H6         U 506  35.849  -4.963 -11.746
   33   1H5*    C 507          1H5*        C 507  34.828   1.057 -10.714
   34   2H5*    C 507          2H5*        C 507  34.537   1.469  -9.025
   35    H4*    C 507           H4*        C 507  32.947   2.252 -11.030
   36    H3*    C 507           H3*        C 507  32.271   1.674  -8.155
   37    H2*    C 507           H2*        C 507  30.012   2.270  -8.578
   38   2HO*    C 507          2HO*        C 507  31.043   2.946 -11.183
   39    H1*    C 507           H1*        C 507  29.859   0.720 -10.914
   40   1H4     C 507          1H4         C 507  27.502  -2.862  -6.140
   41   2H4     C 507          2H4         C 507  29.082  -3.598  -5.994
   42    H5     C 507           H5         C 507  30.991  -2.868  -7.178
   43    H6     C 507           H6         C 507  31.861  -1.232  -8.810
   44   1H5*    C 508          1H5*        C 508  33.770   6.303  -5.957
   45   2H5*    C 508          2H5*        C 508  32.151   6.834  -6.410
   46    H4*    C 508           H4*        C 508  33.345   8.766  -6.697
   47    H3*    C 508           H3*        C 508  33.161   7.345  -9.314
   48    H2*    C 508           H2*        C 508  34.522   8.975 -10.390
   49   2HO*    C 508          2HO*        C 508  34.666  10.940  -9.398
   50    H1*    C 508           H1*        C 508  36.521   8.839  -8.440
   51   1H4     C 508          1H4         C 508  38.708   3.984 -11.958
   52   2H4     C 508          2H4         C 508  37.201   3.958 -12.847
   53    H5     C 508           H5         C 508  35.338   5.310 -12.318
   54    H6     C 508           H6         C 508  34.452   7.034 -10.790
   55   1H5*    G 509          1H5*        G 509  31.497  10.497 -10.410
   56   2H5*    G 509          2H5*        G 509  30.202  11.591  -9.921
   57    H4*    G 509           H4*        G 509  29.826  11.543 -12.160
   58    H3*    G 509           H3*        G 509  28.250   9.208 -11.072
   59    H2*    G 509           H2*        G 509  27.381   8.851 -13.248
   60   2HO*    G 509          2HO*        G 509  27.121  11.101 -13.647
   61    H1*    G 509           H1*        G 509  29.957   9.252 -14.433
   62    H8     G 509           H8         G 509  28.991   6.980 -11.491
   63    H1     G 509           H1         G 509  30.196   3.956 -17.084
   64   1H2     G 509          1H2         G 509  30.613   5.351 -18.545
   65   2H2     G 509          2H2         G 509  30.631   7.082 -18.292
   66   1H5*    U 510          1H5*        U 510  25.277  12.126  -8.795
   67   2H5*    U 510          2H5*        U 510  25.730  10.960  -7.551
   68    H4*    U 510           H4*        U 510  23.248  11.259  -8.044
   69    H3*    U 510           H3*        U 510  24.571   8.543  -7.985
   70    H2*    U 510           H2*        U 510  22.436   7.562  -8.142
   71   2HO*    U 510          2HO*        U 510  21.311   8.801  -6.695
   72    H1*    U 510           H1*        U 510  21.557   9.604  -9.995
   73    H3     U 510           H3         U 510  20.796   5.943 -12.511
   74    H5     U 510           H5         U 510  24.958   5.942 -12.045
   75    H6     U 510           H6         U 510  24.688   7.834 -10.508
   76   1H    ALA   1           HN       ALA   1  35.717 -27.330 -12.786
   77    HA   ALA   1           HA       ALA   1  35.651 -29.750 -14.372
   78   1HB   ALA   1          1HB       ALA   1  35.995 -28.712 -16.334
   79   2HB   ALA   1          2HB       ALA   1  36.057 -27.124 -15.533
   80   3HB   ALA   1          3HB       ALA   1  37.537 -28.101 -15.690
   81    H    THR   2           HN       THR   2  37.416 -31.056 -13.920
   82    HA   THR   2           HA       THR   2  39.414 -29.863 -12.113
   83    HB   THR   2           HB       THR   2  37.814 -31.575 -11.125
   84    HG1  THR   2           HG1      THR   2  40.105 -31.263 -10.456
   85   1HG2  THR   2          1HG2      THR   2  38.586 -34.003 -11.764
   86   2HG2  THR   2          2HG2      THR   2  37.411 -33.200 -12.833
   87   3HG2  THR   2          3HG2      THR   2  39.130 -33.266 -13.290
   88    H    VAL   3           HN       VAL   3  41.597 -30.258 -12.435
   89    HA   VAL   3           HA       VAL   3  43.407 -30.525 -13.679
   90    HB   VAL   3           HB       VAL   3  41.982 -33.048 -14.551
   91   1HG1  VAL   3          1HG1      VAL   3  44.968 -32.732 -14.323
   92   2HG1  VAL   3          2HG1      VAL   3  44.021 -33.908 -15.266
   93   3HG1  VAL   3          3HG1      VAL   3  44.118 -32.212 -15.798
   94   1HG2  VAL   3          1HG2      VAL   3  44.004 -33.398 -12.507
   95   2HG2  VAL   3          2HG2      VAL   3  42.757 -32.249 -11.966
   96   3HG2  VAL   3          3HG2      VAL   3  42.290 -33.881 -12.504
   97    H    VAL   4           HN       VAL   4  42.814 -28.587 -14.917
   98    HA   VAL   4           HA       VAL   4  42.319 -29.305 -17.712
   99    HB   VAL   4           HB       VAL   4  40.228 -28.503 -16.634
  100   1HG1  VAL   4          1HG1      VAL   4  40.783 -26.956 -15.002
  101   2HG1  VAL   4          2HG1      VAL   4  41.972 -26.128 -16.038
  102   3HG1  VAL   4          3HG1      VAL   4  40.229 -25.898 -16.321
  103   1HG2  VAL   4          1HG2      VAL   4  39.945 -28.089 -18.833
  104   2HG2  VAL   4          2HG2      VAL   4  40.159 -26.386 -18.363
  105   3HG2  VAL   4          3HG2      VAL   4  41.539 -27.314 -18.997
  106    H    SER   5           HN       SER   5  43.524 -28.104 -19.209
  107    HA   SER   5           HA       SER   5  45.943 -27.223 -18.470
  108   1HB   SER   5          2HB       SER   5  46.148 -26.266 -20.667
  109   2HB   SER   5          3HB       SER   5  45.084 -27.651 -20.819
  110    HG   SER   5           HG       SER   5  44.565 -25.184 -21.619
  111    H    GLY   6           HN       GLY   6  46.587 -25.588 -17.121
  112   1HA   GLY   6          1HA       GLY   6  44.811 -23.260 -16.825
  113   2HA   GLY   6          2HA       GLY   6  46.020 -23.809 -15.682
  114    H    GLN   7           HN       GLN   7  45.809 -21.102 -16.680
  115    HA   GLN   7           HA       GLN   7  48.310 -20.997 -18.180
  116   1HB   GLN   7          2HB       GLN   7  47.501 -18.957 -19.293
  117   2HB   GLN   7          3HB       GLN   7  46.406 -20.290 -19.596
  118   1HG   GLN   7          2HG       GLN   7  45.223 -19.324 -17.360
  119   2HG   GLN   7          3HG       GLN   7  46.000 -17.845 -17.888
  120   1HE2  GLN   7          1HE2      GLN   7  43.216 -18.327 -17.746
  121   2HE2  GLN   7          2HE2      GLN   7  42.538 -18.208 -19.336
  122    H    LYS   8           HN       LYS   8  49.890 -19.529 -17.444
  123    HA   LYS   8           HA       LYS   8  49.211 -18.242 -14.895
  124   1HB   LYS   8          2HB       LYS   8  51.427 -19.910 -15.751
  125   2HB   LYS   8          3HB       LYS   8  52.008 -18.360 -15.174
  126   1HG   LYS   8          2HG       LYS   8  49.853 -19.590 -13.512
  127   2HG   LYS   8          3HG       LYS   8  51.361 -20.481 -13.538
  128   1HD   LYS   8          2HD       LYS   8  52.213 -19.018 -12.032
  129   2HD   LYS   8          3HD       LYS   8  52.114 -17.755 -13.244
  130   1HE   LYS   8          2HE       LYS   8  49.493 -17.835 -12.434
  131   2HE   LYS   8          3HE       LYS   8  50.281 -18.334 -10.950
  132   1HZ   LYS   8          1HZ       LYS   8  51.414 -16.363 -10.818
  133   2HZ   LYS   8          2HZ       LYS   8  51.284 -16.018 -12.409
  134   3HZ   LYS   8          3HZ       LYS   8  49.985 -15.862 -11.433
  135    H    GLN   9           HN       GLN   9  50.802 -16.251 -14.508
  136    HA   GLN   9           HA       GLN   9  51.313 -14.210 -15.041
  137   1HB   GLN   9          2HB       GLN   9  52.750 -15.568 -16.786
  138   2HB   GLN   9          3HB       GLN   9  51.631 -14.919 -17.968
  139   1HG   GLN   9          2HG       GLN   9  52.173 -12.614 -16.669
  140   2HG   GLN   9          3HG       GLN   9  53.647 -13.470 -16.261
  141   1HE2  GLN   9          1HE2      GLN   9  54.972 -14.313 -17.947
  142   2HE2  GLN   9          2HE2      GLN   9  54.998 -13.583 -19.518
  143    H    ASP  10           HN       ASP  10  49.969 -12.453 -15.194
  144    HA   ASP  10           HA       ASP  10  48.174 -12.267 -17.396
  145   1HB   ASP  10          2HB       ASP  10  46.212 -11.860 -15.702
  146   2HB   ASP  10          3HB       ASP  10  46.625 -13.506 -16.139
  147    H    ARG  11           HN       ARG  11  47.943 -10.047 -17.847
  148    HA   ARG  11           HA       ARG  11  49.436  -8.210 -16.531
  149   1HB   ARG  11          2HB       ARG  11  47.891  -8.225 -18.808
  150   2HB   ARG  11          3HB       ARG  11  46.917  -7.184 -17.790
  151   1HG   ARG  11          2HG       ARG  11  49.759  -6.485 -17.579
  152   2HG   ARG  11          3HG       ARG  11  49.232  -6.453 -19.250
  153   1HD   ARG  11          2HD       ARG  11  47.481  -5.147 -17.155
  154   2HD   ARG  11          3HD       ARG  11  48.928  -4.310 -17.681
  155    HE   ARG  11           HE       ARG  11  47.663  -5.125 -20.048
  156   1HH1  ARG  11          2HH2      ARG  11  46.822  -3.119 -17.282
  157   2HH1  ARG  11          1HH2      ARG  11  45.747  -2.102 -18.184
  158   1HH2  ARG  11          2HH1      ARG  11  46.246  -3.785 -21.238
  159   2HH2  ARG  11          1HH1      ARG  11  45.418  -2.484 -20.450
  160    H    GLN  12           HN       GLN  12  49.058  -6.671 -14.864
  161    HA   GLN  12           HA       GLN  12  46.485  -6.204 -13.861
  162   1HB   GLN  12          2HB       GLN  12  46.828  -8.487 -12.912
  163   2HB   GLN  12          3HB       GLN  12  48.294  -7.942 -12.123
  164   1HG   GLN  12          2HG       GLN  12  47.115  -7.074 -10.390
  165   2HG   GLN  12          3HG       GLN  12  46.135  -6.106 -11.476
  166   1HE2  GLN  12          1HE2      GLN  12  44.279  -6.438 -10.302
  167   2HE2  GLN  12          2HE2      GLN  12  43.407  -7.936 -10.285
  168    H    GLY  13           HN       GLY  13  46.914  -4.009 -13.829
  169   1HA   GLY  13          1HA       GLY  13  48.018  -2.693 -11.787
  170   2HA   GLY  13          2HA       GLY  13  49.437  -3.045 -12.753
  171    H    GLY  14           HN       GLY  14  47.392  -0.604 -12.124
  172   1HA   GLY  14          1HA       GLY  14  47.819   0.616 -14.736
  173   2HA   GLY  14          2HA       GLY  14  46.152   0.427 -14.229
  174    H    GLU  15           HN       GLU  15  47.952   2.880 -14.603
  175    HA   GLU  15           HA       GLU  15  48.063   3.856 -11.890
  176   1HB   GLU  15          2HB       GLU  15  49.363   4.514 -14.454
  177   2HB   GLU  15          3HB       GLU  15  48.836   5.943 -13.588
  178   1HG   GLU  15          2HG       GLU  15  50.352   5.641 -11.883
  179   2HG   GLU  15          3HG       GLU  15  50.147   3.900 -11.866
  180    H    ARG  16           HN       ARG  16  46.717   4.931 -15.100
  181    HA   ARG  16           HA       ARG  16  45.127   6.892 -13.889
  182   1HB   ARG  16          2HB       ARG  16  45.029   5.585 -16.652
  183   2HB   ARG  16          3HB       ARG  16  44.006   6.933 -16.202
  184   1HG   ARG  16          2HG       ARG  16  46.521   7.834 -15.418
  185   2HG   ARG  16          3HG       ARG  16  46.901   6.899 -16.849
  186   1HD   ARG  16          2HD       ARG  16  46.259   8.704 -18.077
  187   2HD   ARG  16          3HD       ARG  16  44.609   8.337 -17.614
  188    HE   ARG  16           HE       ARG  16  45.463   9.759 -15.442
  189   1HH1  ARG  16          2HH2      ARG  16  45.728  10.394 -18.893
  190   2HH1  ARG  16          1HH2      ARG  16  45.715  12.115 -18.707
  191   1HH2  ARG  16          2HH1      ARG  16  45.447  12.031 -15.197
  192   2HH2  ARG  16          1HH1      ARG  16  45.555  13.053 -16.590
  193    H    ARG  17           HN       ARG  17  42.776   6.919 -13.635
  194    HA   ARG  17           HA       ARG  17  41.750   4.235 -13.265
  195   1HB   ARG  17          2HB       ARG  17  40.878   6.946 -12.156
  196   2HB   ARG  17          3HB       ARG  17  39.945   5.482 -11.909
  197   1HG   ARG  17          2HG       ARG  17  42.811   5.127 -11.266
  198   2HG   ARG  17          3HG       ARG  17  42.054   6.375 -10.298
  199   1HD   ARG  17          2HD       ARG  17  41.032   4.800  -9.022
  200   2HD   ARG  17          3HD       ARG  17  40.216   4.155 -10.433
  201    HE   ARG  17           HE       ARG  17  41.777   2.413 -10.510
  202   1HH1  ARG  17          2HH2      ARG  17  43.057   5.014  -8.516
  203   2HH1  ARG  17          1HH2      ARG  17  44.434   4.104  -7.989
  204   1HH2  ARG  17          2HH1      ARG  17  43.593   1.212  -9.815
  205   2HH2  ARG  17          1HH1      ARG  17  44.741   1.928  -8.732
  206    H    ARG  18           HN       ARG  18  40.436   7.517 -14.171
  207    HA   ARG  18           HA       ARG  18  38.564   6.147 -15.894
  208   1HB   ARG  18          2HB       ARG  18  38.711   9.088 -15.054
  209   2HB   ARG  18          3HB       ARG  18  37.416   8.379 -15.998
  210   1HG   ARG  18          2HG       ARG  18  36.500   7.264 -14.180
  211   2HG   ARG  18          3HG       ARG  18  38.054   7.000 -13.415
  212   1HD   ARG  18          2HD       ARG  18  36.817   8.607 -12.063
  213   2HD   ARG  18          3HD       ARG  18  38.145   9.459 -12.827
  214    HE   ARG  18           HE       ARG  18  35.665   9.519 -14.394
  215   1HH1  ARG  18          2HH2      ARG  18  37.525  11.102 -11.862
  216   2HH1  ARG  18          1HH2      ARG  18  36.749  12.636 -12.072
  217   1HH2  ARG  18          2HH1      ARG  18  34.640  11.543 -14.673
  218   2HH2  ARG  18          1HH1      ARG  18  35.096  12.888 -13.683
  219    H    SER  19           HN       SER  19  41.418   6.317 -16.618
  220    HA   SER  19           HA       SER  19  42.307   8.270 -18.111
  221   1HB   SER  19          2HB       SER  19  42.909   5.600 -17.875
  222   2HB   SER  19          3HB       SER  19  42.405   5.659 -19.552
  223    HG   SER  19           HG       SER  19  44.785   6.325 -18.604
  224    H    GLN  20           HN       GLN  20  39.897   5.814 -19.281
  225    HA   GLN  20           HA       GLN  20  39.037   7.813 -21.206
  226   1HB   GLN  20          2HB       GLN  20  40.132   5.117 -21.765
  227   2HB   GLN  20          3HB       GLN  20  38.600   5.429 -22.557
  228   1HG   GLN  20          2HG       GLN  20  39.640   6.722 -24.100
  229   2HG   GLN  20          3HG       GLN  20  40.191   7.807 -22.839
  230   1HE2  GLN  20          1HE2      GLN  20  41.287   6.313 -25.365
  231   2HE2  GLN  20          2HE2      GLN  20  42.874   5.808 -24.887
  232    H    LEU  21           HN       LEU  21  37.776   7.587 -18.800
  233    HA   LEU  21           HA       LEU  21  35.711   5.599 -18.924
  234   1HB   LEU  21          2HB       LEU  21  36.887   6.616 -16.862
  235   2HB   LEU  21          3HB       LEU  21  35.795   7.969 -17.079
  236    HG   LEU  21           HG       LEU  21  35.272   5.243 -16.064
  237   1HD1  LEU  21          1HD1      LEU  21  34.889   7.950 -15.261
  238   2HD1  LEU  21          2HD1      LEU  21  33.295   7.160 -15.330
  239   3HD1  LEU  21          3HD1      LEU  21  34.596   6.457 -14.339
  240   1HD2  LEU  21          1HD2      LEU  21  34.010   5.014 -18.086
  241   2HD2  LEU  21          2HD2      LEU  21  32.872   5.322 -16.753
  242   3HD2  LEU  21          3HD2      LEU  21  33.290   6.629 -17.886
  243    H    ASP  22           HN       ASP  22  34.846   6.108 -21.064
  244    HA   ASP  22           HA       ASP  22  33.940   8.566 -21.801
  245   1HB   ASP  22          2HB       ASP  22  33.803   5.918 -22.768
  246   2HB   ASP  22          3HB       ASP  22  32.124   6.395 -22.621
  247    H    ARG  23           HN       ARG  23  31.655   9.423 -21.856
  248    HA   ARG  23           HA       ARG  23  30.464   9.224 -19.355
  249   1HB   ARG  23          2HB       ARG  23  30.365  11.192 -21.000
  250   2HB   ARG  23          3HB       ARG  23  29.182  10.283 -21.921
  251   1HG   ARG  23          2HG       ARG  23  28.053  11.853 -20.380
  252   2HG   ARG  23          3HG       ARG  23  27.672  10.196 -19.953
  253   1HD   ARG  23          2HD       ARG  23  28.581  10.449 -17.884
  254   2HD   ARG  23          3HD       ARG  23  30.096  11.016 -18.558
  255    HE   ARG  23           HE       ARG  23  28.535  13.236 -18.844
  256   1HH1  ARG  23          2HH2      ARG  23  29.033  11.087 -16.104
  257   2HH1  ARG  23          1HH2      ARG  23  28.745  12.318 -14.921
  258   1HH2  ARG  23          2HH1      ARG  23  28.155  14.863 -17.285
  259   2HH2  ARG  23          1HH1      ARG  23  28.242  14.481 -15.597
  260    H    ASP  24           HN       ASP  24  30.419   7.083 -21.984
  261    HA   ASP  24           HA       ASP  24  27.908   5.965 -21.025
  262   1HB   ASP  24          2HB       ASP  24  28.602   6.852 -23.708
  263   2HB   ASP  24          3HB       ASP  24  28.345   5.119 -23.729
  264    H    GLN  25           HN       GLN  25  30.853   5.517 -20.398
  265    HA   GLN  25           HA       GLN  25  31.123   2.826 -21.485
  266   1HB   GLN  25          2HB       GLN  25  33.001   5.007 -21.157
  267   2HB   GLN  25          3HB       GLN  25  33.539   3.653 -20.186
  268   1HG   GLN  25          2HG       GLN  25  33.105   2.181 -22.287
  269   2HG   GLN  25          3HG       GLN  25  32.974   3.685 -23.178
  270   1HE2  GLN  25          1HE2      GLN  25  34.748   3.870 -24.326
  271   2HE2  GLN  25          2HE2      GLN  25  36.378   3.751 -23.751
  272    H    CYS  26           HN       CYS  26  30.670   1.173 -20.100
  273    HA   CYS  26           HA       CYS  26  29.880   1.552 -17.511
  274   1HB   CYS  26          2HB       CYS  26  29.365  -0.461 -18.816
  275   2HB   CYS  26          3HB       CYS  26  31.044  -0.957 -18.765
  276    H    ALA  27           HN       ALA  27  30.955   1.720 -15.534
  277    HA   ALA  27           HA       ALA  27  33.876   1.765 -15.700
  278   1HB   ALA  27          1HB       ALA  27  33.148   2.763 -13.223
  279   2HB   ALA  27          2HB       ALA  27  33.452   3.741 -14.680
  280   3HB   ALA  27          3HB       ALA  27  31.789   3.267 -14.257
  281    H    TYR  28           HN       TYR  28  32.315  -0.754 -15.682
  282    HA   TYR  28           HA       TYR  28  33.320  -1.797 -13.123
  283   1HB   TYR  28          2HB       TYR  28  30.720  -1.514 -13.544
  284   2HB   TYR  28          3HB       TYR  28  30.902  -2.770 -14.753
  285    HD1  TYR  28           HD1      TYR  28  30.793  -2.028 -11.173
  286    HD2  TYR  28           HD2      TYR  28  31.454  -5.090 -14.087
  287    HE1  TYR  28           HE1      TYR  28  30.512  -3.806  -9.379
  288    HE2  TYR  28           HE2      TYR  28  31.171  -6.858 -12.283
  289    HH   TYR  28           HH       TYR  28  31.385  -7.046  -9.901
  290    H    CYS  29           HN       CYS  29  31.994  -2.956 -16.310
  291    HA   CYS  29           HA       CYS  29  34.000  -5.040 -16.277
  292   1HB   CYS  29          2HB       CYS  29  32.776  -5.930 -18.233
  293   2HB   CYS  29          3HB       CYS  29  31.746  -5.725 -16.831
  294    H    LYS  30           HN       LYS  30  33.192  -1.928 -17.768
  295    HA   LYS  30           HA       LYS  30  34.664  -0.560 -18.812
  296   1HB   LYS  30          2HB       LYS  30  36.442  -2.466 -18.134
  297   2HB   LYS  30          3HB       LYS  30  36.426  -2.718 -19.867
  298   1HG   LYS  30          2HG       LYS  30  37.738  -0.896 -20.151
  299   2HG   LYS  30          3HG       LYS  30  36.491   0.119 -19.456
  300   1HD   LYS  30          2HD       LYS  30  37.442  -0.826 -17.143
  301   2HD   LYS  30          3HD       LYS  30  38.874  -1.154 -18.099
  302   1HE   LYS  30          2HE       LYS  30  38.187   1.456 -18.868
  303   2HE   LYS  30          3HE       LYS  30  37.802   1.435 -17.159
  304   1HZ   LYS  30          1HZ       LYS  30  39.940   1.473 -16.701
  305   2HZ   LYS  30          2HZ       LYS  30  40.248   0.144 -17.600
  306   3HZ   LYS  30          3HZ       LYS  30  40.288   1.624 -18.289
  307    H    GLU  31           HN       GLU  31  32.248  -2.062 -19.696
  308    HA   GLU  31           HA       GLU  31  32.836  -2.214 -22.543
  309   1HB   GLU  31          2HB       GLU  31  31.570  -4.060 -20.997
  310   2HB   GLU  31          3HB       GLU  31  30.181  -3.107 -21.481
  311   1HG   GLU  31          2HG       GLU  31  31.967  -3.602 -23.759
  312   2HG   GLU  31          3HG       GLU  31  31.477  -5.106 -23.006
  313    H    LYS  32           HN       LYS  32  31.973  -0.716 -23.953
  314    HA   LYS  32           HA       LYS  32  30.470   1.443 -22.747
  315   1HB   LYS  32          2HB       LYS  32  30.918   2.618 -24.838
  316   2HB   LYS  32          3HB       LYS  32  32.396   1.970 -24.151
  317   1HG   LYS  32          2HG       LYS  32  32.579   0.273 -25.785
  318   2HG   LYS  32          3HG       LYS  32  30.865   0.292 -26.151
  319   1HD   LYS  32          2HD       LYS  32  31.069   2.458 -27.292
  320   2HD   LYS  32          3HD       LYS  32  32.740   2.617 -26.788
  321   1HE   LYS  32          2HE       LYS  32  32.789   1.845 -29.074
  322   2HE   LYS  32          3HE       LYS  32  33.257   0.478 -28.082
  323   1HZ   LYS  32          1HZ       LYS  32  30.906   0.839 -29.661
  324   2HZ   LYS  32          2HZ       LYS  32  31.646  -0.540 -29.193
  325   3HZ   LYS  32          3HZ       LYS  32  30.609   0.214 -28.181
  326    H    GLY  33           HN       GLY  33  28.335   1.960 -23.179
  327   1HA   GLY  33          1HA       GLY  33  26.564   1.671 -24.933
  328   2HA   GLY  33          2HA       GLY  33  26.868  -0.048 -24.779
  329    H    HIS  34           HN       HIS  34  27.452   0.280 -21.784
  330    HA   HIS  34           HA       HIS  34  24.773   0.957 -20.861
  331   1HB   HIS  34          2HB       HIS  34  24.488  -1.081 -19.674
  332   2HB   HIS  34          3HB       HIS  34  24.870  -1.491 -21.335
  333    HD1  HIS  34           HD1      HIS  34  27.028  -2.819 -21.784
  334    HD2  HIS  34           HD2      HIS  34  26.581  -1.650 -17.780
  335    HE1  HIS  34           HE1      HIS  34  28.812  -4.082 -20.467
  336    H    TRP  35           HN       TRP  35  24.697   1.322 -18.481
  337    HA   TRP  35           HA       TRP  35  27.217   2.498 -17.630
  338   1HB   TRP  35          2HB       TRP  35  24.344   2.897 -17.015
  339   2HB   TRP  35          3HB       TRP  35  25.465   3.152 -15.692
  340    HD1  TRP  35           HD1      TRP  35  26.151   4.156 -19.394
  341    HE1  TRP  35           HE1      TRP  35  26.560   6.755 -19.593
  342    HE3  TRP  35           HE3      TRP  35  25.132   5.220 -14.527
  343    HZ2  TRP  35           HZ2      TRP  35  26.417   8.916 -17.734
  344    HZ3  TRP  35           HZ3      TRP  35  25.291   7.599 -13.801
  345    HH2  TRP  35           HH2      TRP  35  25.907   9.416 -15.315
  346    H    ALA  36           HN       ALA  36  27.936   2.104 -15.335
  347    HA   ALA  36           HA       ALA  36  28.197  -0.626 -14.843
  348   1HB   ALA  36          1HB       ALA  36  29.815   1.058 -14.104
  349   2HB   ALA  36          2HB       ALA  36  28.598   1.788 -13.029
  350   3HB   ALA  36          3HB       ALA  36  29.204   0.147 -12.701
  351    H    LYS  37           HN       LYS  37  25.803   1.799 -13.802
  352    HA   LYS  37           HA       LYS  37  24.735   0.251 -11.696
  353   1HB   LYS  37          2HB       LYS  37  23.787   2.641 -13.272
  354   2HB   LYS  37          3HB       LYS  37  22.746   1.864 -12.095
  355   1HG   LYS  37          2HG       LYS  37  25.180   2.094 -10.723
  356   2HG   LYS  37          3HG       LYS  37  25.118   3.573 -11.662
  357   1HD   LYS  37          2HD       LYS  37  22.910   4.138 -10.740
  358   2HD   LYS  37          3HD       LYS  37  22.807   2.589  -9.926
  359   1HE   LYS  37          2HE       LYS  37  24.896   3.217  -8.608
  360   2HE   LYS  37          3HE       LYS  37  24.823   4.808  -9.339
  361   1HZ   LYS  37          1HZ       LYS  37  23.718   4.734  -7.209
  362   2HZ   LYS  37          2HZ       LYS  37  22.649   5.099  -8.389
  363   3HZ   LYS  37          3HZ       LYS  37  22.672   3.599  -7.742
  364    H    ASP  38           HN       ASP  38  24.810  -0.250 -15.047
  365    HA   ASP  38           HA       ASP  38  22.485  -1.981 -14.788
  366   1HB   ASP  38          2HB       ASP  38  22.598   0.245 -16.438
  367   2HB   ASP  38          3HB       ASP  38  23.151  -1.013 -17.525
  368    H    CYS  39           HN       CYS  39  25.551  -2.243 -14.523
  369    HA   CYS  39           HA       CYS  39  26.579  -3.464 -16.800
  370   1HB   CYS  39          2HB       CYS  39  27.928  -2.589 -14.892
  371   2HB   CYS  39          3HB       CYS  39  27.387  -3.938 -13.913
  372    HA   PRO  40           HA       PRO  40  24.422  -7.262 -16.518
  373   1HB   PRO  40          2HB       PRO  40  25.689  -8.609 -18.530
  374   2HB   PRO  40          3HB       PRO  40  24.371  -7.488 -18.810
  375   1HG   PRO  40          2HG       PRO  40  27.262  -7.106 -19.290
  376   2HG   PRO  40          3HG       PRO  40  25.913  -6.197 -19.939
  377   1HD   PRO  40          2HD       PRO  40  27.673  -5.382 -17.826
  378   2HD   PRO  40          3HD       PRO  40  26.254  -4.526 -18.396
  379    H    LYS  41           HN       LYS  41  27.422  -6.677 -15.445
  380    HA   LYS  41           HA       LYS  41  27.929  -9.490 -14.838
  381   1HB   LYS  41          2HB       LYS  41  29.588  -7.184 -15.408
  382   2HB   LYS  41          3HB       LYS  41  30.024  -7.879 -13.860
  383   1HG   LYS  41          2HG       LYS  41  29.799 -10.185 -15.248
  384   2HG   LYS  41          3HG       LYS  41  30.136  -9.122 -16.601
  385   1HD   LYS  41          2HD       LYS  41  32.336  -9.353 -16.071
  386   2HD   LYS  41          3HD       LYS  41  32.019  -8.299 -14.708
  387   1HE   LYS  41          2HE       LYS  41  33.104 -10.339 -13.895
  388   2HE   LYS  41          3HE       LYS  41  31.455 -10.302 -13.302
  389   1HZ   LYS  41          1HZ       LYS  41  32.647 -12.054 -15.245
  390   2HZ   LYS  41          2HZ       LYS  41  31.456 -12.348 -14.168
  391   3HZ   LYS  41          3HZ       LYS  41  31.118 -11.586 -15.572
  392    H    LYS  42           HN       LYS  42  26.638  -6.539 -13.528
  393    HA   LYS  42           HA       LYS  42  27.291  -6.964 -10.827
  394   1HB   LYS  42          2HB       LYS  42  25.440  -5.233 -12.384
  395   2HB   LYS  42          3HB       LYS  42  25.021  -5.499 -10.703
  396   1HG   LYS  42          2HG       LYS  42  27.845  -5.033 -10.760
  397   2HG   LYS  42          3HG       LYS  42  27.130  -3.829 -11.811
  398   1HD   LYS  42          2HD       LYS  42  25.868  -4.349  -9.109
  399   2HD   LYS  42          3HD       LYS  42  27.330  -3.387  -9.192
  400   1HE   LYS  42          2HE       LYS  42  25.792  -2.285 -11.240
  401   2HE   LYS  42          3HE       LYS  42  24.574  -2.703 -10.051
  402   1HZ   LYS  42          1HZ       LYS  42  26.703  -0.777  -9.870
  403   2HZ   LYS  42          2HZ       LYS  42  25.207  -0.742  -9.218
  404   3HZ   LYS  42          3HZ       LYS  42  26.391  -1.609  -8.500
  405    HA   PRO  43           HA       PRO  43  24.608 -10.388 -10.308
  406   1HB   PRO  43          2HB       PRO  43  25.558 -11.171  -7.869
  407   2HB   PRO  43          3HB       PRO  43  26.263 -11.695  -9.385
  408   1HG   PRO  43          2HG       PRO  43  27.285  -9.702  -7.456
  409   2HG   PRO  43          3HG       PRO  43  28.150 -10.541  -8.730
  410   1HD   PRO  43          2HD       PRO  43  27.233  -7.823  -8.779
  411   2HD   PRO  43          3HD       PRO  43  27.993  -8.696 -10.095
  412    H    ARG  44           HN       ARG  44  25.208  -8.055  -7.749
  413    HA   ARG  44           HA       ARG  44  23.903  -7.260  -6.204
  414   1HB   ARG  44          2HB       ARG  44  21.781  -6.280  -6.982
  415   2HB   ARG  44          3HB       ARG  44  22.988  -6.118  -8.243
  416   1HG   ARG  44          2HG       ARG  44  22.046  -7.899  -9.541
  417   2HG   ARG  44          3HG       ARG  44  21.119  -8.516  -8.188
  418   1HD   ARG  44          2HD       ARG  44  19.354  -7.261  -8.867
  419   2HD   ARG  44          3HD       ARG  44  20.274  -5.813  -8.507
  420    HE   ARG  44           HE       ARG  44  19.834  -6.993 -11.158
  421   1HH1  ARG  44          2HH2      ARG  44  21.846  -4.827  -9.251
  422   2HH1  ARG  44          1HH2      ARG  44  22.418  -3.941 -10.625
  423   1HH2  ARG  44          2HH1      ARG  44  20.588  -5.825 -12.972
  424   2HH2  ARG  44          1HH1      ARG  44  21.697  -4.512 -12.755
  425    H    GLY  45           HN       GLY  45  21.294  -7.459  -5.340
  426   1HA   GLY  45          1HA       GLY  45  19.563  -9.137  -5.062
  427   2HA   GLY  45          2HA       GLY  45  20.812 -10.367  -5.087
  428    HA   PRO  46           HA       PRO  46  19.378 -11.325  -3.949
  429   1HB   PRO  46          2HB       PRO  46  17.481 -12.044  -2.118
  430   2HB   PRO  46          3HB       PRO  46  19.056 -12.805  -2.214
  431   1HG   PRO  46          2HG       PRO  46  18.060 -10.851  -0.231
  432   2HG   PRO  46          3HG       PRO  46  19.438 -11.927  -0.116
  433   1HD   PRO  46          2HD       PRO  46  19.501  -9.109  -0.649
  434   2HD   PRO  46          3HD       PRO  46  20.867 -10.206  -0.648
  435    H    ARG  47           HN       ARG  47  17.350  -9.303  -1.866
  436    HA   ARG  47           HA       ARG  47  15.746  -7.933  -2.354
  437   1HB   ARG  47          2HB       ARG  47  17.333  -7.268  -4.321
  438   2HB   ARG  47          3HB       ARG  47  16.280  -8.226  -5.343
  439   1HG   ARG  47          2HG       ARG  47  14.912  -6.263  -3.539
  440   2HG   ARG  47          3HG       ARG  47  15.878  -5.570  -4.827
  441   1HD   ARG  47          2HD       ARG  47  14.072  -7.841  -5.601
  442   2HD   ARG  47          3HD       ARG  47  13.283  -6.338  -5.165
  443    HE   ARG  47           HE       ARG  47  15.440  -5.729  -6.942
  444   1HH1  ARG  47          2HH2      ARG  47  12.294  -7.306  -6.972
  445   2HH1  ARG  47          1HH2      ARG  47  11.996  -6.962  -8.643
  446   1HH2  ARG  47          2HH1      ARG  47  15.046  -5.275  -9.146
  447   2HH2  ARG  47          1HH1      ARG  47  13.571  -5.799  -9.888
  448    H    GLY  48           HN       GLY  48  13.681  -8.700  -2.032
  449   1HA   GLY  48          1HA       GLY  48  11.745  -9.791  -2.373
  450   2HA   GLY  48          2HA       GLY  48  12.180  -9.953  -4.062
  451    HA   PRO  49           HA       PRO  49  12.644 -13.988  -1.756
  452   1HB   PRO  49          2HB       PRO  49  10.174 -15.134  -1.993
  453   2HB   PRO  49          3HB       PRO  49  10.712 -14.308  -0.544
  454   1HG   PRO  49          2HG       PRO  49   8.814 -13.379  -2.610
  455   2HG   PRO  49          3HG       PRO  49   9.039 -12.780  -0.978
  456   1HD   PRO  49          2HD       PRO  49   9.965 -11.552  -3.399
  457   2HD   PRO  49          3HD       PRO  49  10.289 -11.018  -1.761
  458    H    ARG  50           HN       ARG  50  12.880 -16.142  -2.638
  459    HA   ARG  50           HA       ARG  50  13.541 -17.347  -4.319
  460   1HB   ARG  50          2HB       ARG  50  10.806 -16.406  -5.261
  461   2HB   ARG  50          3HB       ARG  50  11.744 -17.506  -6.252
  462   1HG   ARG  50          2HG       ARG  50  11.948 -19.035  -4.209
  463   2HG   ARG  50          3HG       ARG  50  10.820 -17.979  -3.381
  464   1HD   ARG  50          2HD       ARG  50  10.211 -19.356  -6.041
  465   2HD   ARG  50          3HD       ARG  50   9.741 -20.001  -4.481
  466    HE   ARG  50           HE       ARG  50   8.852 -17.263  -4.728
  467   1HH1  ARG  50          2HH2      ARG  50   8.113 -20.524  -5.825
  468   2HH1  ARG  50          1HH2      ARG  50   6.432 -20.193  -6.084
  469   1HH2  ARG  50          2HH1      ARG  50   6.636 -16.826  -5.070
  470   2HH2  ARG  50          1HH1      ARG  50   5.586 -18.076  -5.651
  471    HA   PRO  51           HA       PRO  51  15.295 -14.133  -6.897
  472   1HB   PRO  51          2HB       PRO  51  17.826 -15.158  -7.003
  473   2HB   PRO  51          3HB       PRO  51  17.300 -14.029  -5.770
  474   1HG   PRO  51          2HG       PRO  51  17.756 -16.941  -5.545
  475   2HG   PRO  51          3HG       PRO  51  17.650 -15.744  -4.268
  476   1HD   PRO  51          2HD       PRO  51  15.624 -17.627  -5.029
  477   2HD   PRO  51          3HD       PRO  51  15.478 -16.355  -3.832
  478    H    GLN  52           HN       GLN  52  14.745 -14.040  -8.972
  479    HA   GLN  52           HA       GLN  52  14.323 -14.752 -10.986
  480   1HB   GLN  52          2HB       GLN  52  16.831 -14.633 -11.048
  481   2HB   GLN  52          3HB       GLN  52  16.907 -16.341 -10.658
  482   1HG   GLN  52          2HG       GLN  52  15.122 -16.258 -12.825
  483   2HG   GLN  52          3HG       GLN  52  16.305 -15.033 -13.236
  484   1HE2  GLN  52          1HE2      GLN  52  18.587 -15.615 -13.104
  485   2HE2  GLN  52          2HE2      GLN  52  19.088 -17.222 -13.511
  486    H    THR  53           HN       THR  53  12.385 -15.931 -10.457
  487    HA   THR  53           HA       THR  53  12.771 -18.849 -10.578
  488    HB   THR  53           HB       THR  53  12.145 -18.343  -8.295
  489    HG1  THR  53           HG1      THR  53  10.840 -19.993  -9.350
  490   1HG2  THR  53          1HG2      THR  53   9.894 -17.073  -7.954
  491   2HG2  THR  53          2HG2      THR  53  11.321 -16.079  -8.334
  492   3HG2  THR  53          3HG2      THR  53  10.135 -16.456  -9.606
  493    H    SER  54           HN       SER  54  12.658 -17.709 -12.955
  494    HA   SER  54           HA       SER  54   9.851 -18.031 -13.678
  495   1HB   SER  54          2HB       SER  54  11.075 -15.667 -13.910
  496   2HB   SER  54          3HB       SER  54  11.724 -16.380 -15.373
  497    HG   SER  54           HG       SER  54   9.388 -15.202 -15.150
  498    H    LEU  55           HN       LEU  55   9.581 -18.801 -16.029
  499    HA   LEU  55           HA       LEU  55  11.599 -20.843 -16.518
  500   1HB   LEU  55          2HB       LEU  55   8.766 -20.723 -16.650
  501   2HB   LEU  55          3HB       LEU  55   9.350 -20.988 -18.281
  502    HG   LEU  55           HG       LEU  55  10.811 -22.866 -17.171
  503   1HD1  LEU  55          1HD1      LEU  55   8.749 -23.547 -15.300
  504   2HD1  LEU  55          2HD1      LEU  55  10.493 -23.319 -15.026
  505   3HD1  LEU  55          3HD1      LEU  55   9.385 -21.931 -14.910
  506   1HD2  LEU  55          1HD2      LEU  55   7.975 -22.854 -18.058
  507   2HD2  LEU  55          2HD2      LEU  55   9.385 -23.727 -18.705
  508   3HD2  LEU  55          3HD2      LEU  55   8.561 -24.326 -17.245
  509    H    LEU  56           HN       LEU  56  13.159 -19.116 -17.212
  510    HA   LEU  56           HA       LEU  56  12.572 -17.634 -19.556
  511   1HB   LEU  56          2HB       LEU  56  15.054 -18.207 -17.963
  512   2HB   LEU  56          3HB       LEU  56  15.134 -17.345 -19.486
  513    HG   LEU  56           HG       LEU  56  13.266 -16.398 -17.328
  514   1HD1  LEU  56          1HD1      LEU  56  16.015 -16.709 -16.887
  515   2HD1  LEU  56          2HD1      LEU  56  15.788 -14.985 -17.264
  516   3HD1  LEU  56          3HD1      LEU  56  14.866 -15.735 -15.939
  517   1HD2  LEU  56          1HD2      LEU  56  12.903 -15.249 -19.329
  518   2HD2  LEU  56          2HD2      LEU  56  13.968 -14.168 -18.398
  519   3HD2  LEU  56          3HD2      LEU  56  14.639 -15.166 -19.711
  Start of MODEL   20
    1   1H5*    C 504          1H5*        C 504  33.995 -14.537  -5.985
    2   2H5*    C 504          2H5*        C 504  34.197 -12.898  -6.603
    3    H4*    C 504           H4*        C 504  35.230 -15.107  -7.766
    4    H3*    C 504           H3*        C 504  34.322 -12.598  -9.229
    5    H2*    C 504           H2*        C 504  35.591 -13.436 -11.016
    6   2HO*    C 504          2HO*        C 504  37.372 -13.820  -9.546
    7    H1*    C 504           H1*        C 504  34.939 -16.172 -10.271
    8   1H4     C 504          1H4         C 504  31.947 -15.356 -15.842
    9   2H4     C 504          2H4         C 504  30.812 -14.265 -15.077
   10    H5     C 504           H5         C 504  30.969 -13.570 -12.826
   11    H6     C 504           H6         C 504  32.267 -13.750 -10.732
   12   1H5*    C 505          1H5*        C 505  38.500  -9.032  -7.048
   13   2H5*    C 505          2H5*        C 505  36.820  -8.701  -7.467
   14    H4*    C 505           H4*        C 505  39.057  -8.111  -8.988
   15    H3*    C 505           H3*        C 505  36.110  -8.151  -9.581
   16    H2*    C 505           H2*        C 505  36.508  -7.864 -11.848
   17   2HO*    C 505          2HO*        C 505  38.305  -6.621 -12.418
   18    H1*    C 505           H1*        C 505  39.116  -9.246 -11.579
   19   1H4     C 505          1H4         C 505  36.191 -12.744 -16.021
   20   2H4     C 505          2H4         C 505  34.903 -13.126 -14.901
   21    H5     C 505           H5         C 505  34.753 -12.238 -12.717
   22    H6     C 505           H6         C 505  35.813 -10.752 -11.056
   23   1H5*    U 506          1H5*        U 506  38.505  -4.268  -9.035
   24   2H5*    U 506          2H5*        U 506  37.902  -2.818  -8.233
   25    H4*    U 506           H4*        U 506  36.966  -2.405 -10.228
   26    H3*    U 506           H3*        U 506  35.020  -4.396  -9.053
   27    H2*    U 506           H2*        U 506  33.823  -4.366 -11.023
   28   2HO*    U 506          2HO*        U 506  33.608  -2.067 -10.768
   29    H1*    U 506           H1*        U 506  36.260  -3.444 -12.483
   30    H3     U 506           H3         U 506  36.092  -6.616 -15.630
   31    H5     U 506           H5         U 506  33.797  -8.285 -12.550
   32    H6     U 506           H6         U 506  34.358  -6.317 -11.199
   33   1H5*    C 507          1H5*        C 507  33.704  -0.178 -10.059
   34   2H5*    C 507          2H5*        C 507  33.259   0.395  -8.452
   35    H4*    C 507           H4*        C 507  32.149   1.389 -10.616
   36    H3*    C 507           H3*        C 507  30.886   0.864  -7.947
   37    H2*    C 507           H2*        C 507  28.800   1.693  -8.741
   38   2HO*    C 507          2HO*        C 507  30.326   2.213 -11.130
   39    H1*    C 507           H1*        C 507  28.859   0.114 -11.048
   40   1H4     C 507          1H4         C 507  25.547  -3.157  -6.630
   41   2H4     C 507          2H4         C 507  27.012  -4.049  -6.284
   42    H5     C 507           H5         C 507  29.121  -3.522  -7.207
   43    H6     C 507           H6         C 507  30.356  -1.996  -8.705
   44   1H5*    C 508          1H5*        C 508  32.355   5.655  -9.632
   45   2H5*    C 508          2H5*        C 508  33.033   4.205  -8.892
   46    H4*    C 508           H4*        C 508  33.191   6.431  -7.057
   47    H3*    C 508           H3*        C 508  33.963   7.054  -9.853
   48    H2*    C 508           H2*        C 508  36.113   7.834  -9.266
   49   2HO*    C 508          2HO*        C 508  36.439   8.451  -7.128
   50    H1*    C 508           H1*        C 508  36.837   5.709  -7.716
   51   1H4     C 508          1H4         C 508  38.325   3.429 -13.463
   52   2H4     C 508          2H4         C 508  36.637   3.397 -13.922
   53    H5     C 508           H5         C 508  34.883   4.161 -12.538
   54    H6     C 508           H6         C 508  34.310   5.154 -10.350
   55   1H5*    G 509          1H5*        G 509  34.855   9.681 -12.314
   56   2H5*    G 509          2H5*        G 509  34.245  11.085 -11.439
   57    H4*    G 509           H4*        G 509  32.957  11.251 -13.294
   58    H3*    G 509           H3*        G 509  31.423   9.357 -11.513
   59    H2*    G 509           H2*        G 509  29.681   9.343 -13.115
   60   2HO*    G 509          2HO*        G 509  31.275  11.393 -14.363
   61    H1*    G 509           H1*        G 509  31.529   9.126 -15.282
   62    H8     G 509           H8         G 509  31.419   7.054 -12.052
   63    H1     G 509           H1         G 509  29.293   4.051 -17.376
   64   1H2     G 509          1H2         G 509  29.351   5.354 -18.972
   65   2H2     G 509          2H2         G 509  29.894   7.015 -18.881
   66   1H5*    U 510          1H5*        U 510  29.385   9.344  -9.060
   67   2H5*    U 510          2H5*        U 510  28.980   8.085 -10.226
   68    H4*    U 510           H4*        U 510  27.232   9.164  -8.471
   69    H3*    U 510           H3*        U 510  26.731   7.904 -11.170
   70    H2*    U 510           H2*        U 510  24.409   8.179 -10.806
   71   2HO*    U 510          2HO*        U 510  24.150   9.237  -8.438
   72    H1*    U 510           H1*        U 510  24.811  10.817  -9.744
   73    H3     U 510           H3         U 510  22.374  12.088 -13.281
   74    H5     U 510           H5         U 510  25.598  10.094 -15.064
   75    H6     U 510           H6         U 510  26.373   9.537 -12.805
   76   1H    ALA   1           HN       ALA   1  59.240  10.906 -49.649
   77    HA   ALA   1           HA       ALA   1  57.115   9.318 -49.422
   78   1HB   ALA   1          1HB       ALA   1  58.395   7.344 -50.030
   79   2HB   ALA   1          2HB       ALA   1  59.607   7.695 -48.775
   80   3HB   ALA   1          3HB       ALA   1  57.954   7.229 -48.309
   81    H    THR   2           HN       THR   2  56.462  10.922 -47.999
   82    HA   THR   2           HA       THR   2  57.826  10.879 -45.399
   83    HB   THR   2           HB       THR   2  57.056  13.298 -47.107
   84    HG1  THR   2           HG1      THR   2  59.459  12.396 -45.681
   85   1HG2  THR   2          1HG2      THR   2  58.383  13.521 -44.402
   86   2HG2  THR   2          2HG2      THR   2  57.386  14.715 -45.269
   87   3HG2  THR   2          3HG2      THR   2  56.613  13.341 -44.442
   88    H    VAL   3           HN       VAL   3  56.429  10.029 -43.995
   89    HA   VAL   3           HA       VAL   3  53.813  11.226 -43.823
   90    HB   VAL   3           HB       VAL   3  53.586   9.414 -45.514
   91   1HG1  VAL   3          1HG1      VAL   3  55.303   7.896 -44.521
   92   2HG1  VAL   3          2HG1      VAL   3  54.165   7.536 -43.200
   93   3HG1  VAL   3          3HG1      VAL   3  53.755   7.091 -44.874
   94   1HG2  VAL   3          1HG2      VAL   3  52.108   9.232 -42.880
   95   2HG2  VAL   3          2HG2      VAL   3  51.600  10.026 -44.390
   96   3HG2  VAL   3          3HG2      VAL   3  51.657   8.250 -44.294
   97    H    VAL   4           HN       VAL   4  53.603  11.700 -41.703
   98    HA   VAL   4           HA       VAL   4  54.324   9.669 -39.769
   99    HB   VAL   4           HB       VAL   4  56.385  10.997 -40.185
  100   1HG1  VAL   4          1HG1      VAL   4  56.533  13.307 -39.458
  101   2HG1  VAL   4          2HG1      VAL   4  55.257  13.156 -40.688
  102   3HG1  VAL   4          3HG1      VAL   4  54.822  13.300 -38.968
  103   1HG2  VAL   4          1HG2      VAL   4  55.311  11.518 -37.402
  104   2HG2  VAL   4          2HG2      VAL   4  55.758   9.892 -37.973
  105   3HG2  VAL   4          3HG2      VAL   4  56.986  11.179 -37.899
  106    H    SER   5           HN       SER   5  52.687   9.540 -38.323
  107    HA   SER   5           HA       SER   5  51.388  11.977 -37.538
  108   1HB   SER   5          2HB       SER   5  50.223  10.736 -39.622
  109   2HB   SER   5          3HB       SER   5  49.540   9.744 -38.349
  110    HG   SER   5           HG       SER   5  49.016  11.977 -37.325
  111    H    GLY   6           HN       GLY   6  51.401  11.863 -35.325
  112   1HA   GLY   6          1HA       GLY   6  50.633   9.327 -34.062
  113   2HA   GLY   6          2HA       GLY   6  52.183  10.033 -33.649
  114    H    GLN   7           HN       GLN   7  48.646  10.411 -33.476
  115    HA   GLN   7           HA       GLN   7  49.038  12.715 -31.748
  116   1HB   GLN   7          2HB       GLN   7  47.268  12.354 -33.820
  117   2HB   GLN   7          3HB       GLN   7  46.271  11.873 -32.463
  118   1HG   GLN   7          2HG       GLN   7  47.250  14.101 -31.352
  119   2HG   GLN   7          3HG       GLN   7  47.554  14.554 -33.018
  120   1HE2  GLN   7          1HE2      GLN   7  45.575  15.278 -30.762
  121   2HE2  GLN   7          2HE2      GLN   7  44.031  15.346 -31.546
  122    H    LYS   8           HN       LYS   8  48.915  12.450 -29.560
  123    HA   LYS   8           HA       LYS   8  47.022  10.702 -28.389
  124   1HB   LYS   8          2HB       LYS   8  48.512   9.085 -27.382
  125   2HB   LYS   8          3HB       LYS   8  48.639   9.002 -29.127
  126   1HG   LYS   8          2HG       LYS   8  50.578  10.911 -28.439
  127   2HG   LYS   8          3HG       LYS   8  50.686   9.747 -27.134
  128   1HD   LYS   8          2HD       LYS   8  51.789   8.296 -28.479
  129   2HD   LYS   8          3HD       LYS   8  50.435   8.265 -29.593
  130   1HE   LYS   8          2HE       LYS   8  51.419   9.758 -31.050
  131   2HE   LYS   8          3HE       LYS   8  52.107  10.727 -29.762
  132   1HZ   LYS   8          1HZ       LYS   8  53.618   9.281 -31.222
  133   2HZ   LYS   8          2HZ       LYS   8  53.916   9.369 -29.620
  134   3HZ   LYS   8          3HZ       LYS   8  53.165   8.058 -30.240
  135    H    GLN   9           HN       GLN   9  46.377  11.830 -26.641
  136    HA   GLN   9           HA       GLN   9  47.978  13.960 -25.716
  137   1HB   GLN   9          2HB       GLN   9  45.364  13.702 -25.791
  138   2HB   GLN   9          3HB       GLN   9  45.552  12.875 -24.257
  139   1HG   GLN   9          2HG       GLN   9  45.141  15.225 -23.788
  140   2HG   GLN   9          3HG       GLN   9  46.809  14.880 -23.370
  141   1HE2  GLN   9          1HE2      GLN   9  44.748  16.008 -26.032
  142   2HE2  GLN   9          2HE2      GLN   9  45.863  17.145 -26.714
  143    H    ASP  10           HN       ASP  10  48.684  14.261 -23.422
  144    HA   ASP  10           HA       ASP  10  49.440  11.678 -22.303
  145   1HB   ASP  10          2HB       ASP  10  51.321  13.140 -23.134
  146   2HB   ASP  10          3HB       ASP  10  50.822  14.387 -22.009
  147    H    ARG  11           HN       ARG  11  47.646  11.464 -20.836
  148    HA   ARG  11           HA       ARG  11  47.846  13.066 -18.522
  149   1HB   ARG  11          2HB       ARG  11  45.794  13.705 -20.545
  150   2HB   ARG  11          3HB       ARG  11  45.073  13.325 -18.994
  151   1HG   ARG  11          2HG       ARG  11  47.425  15.242 -19.175
  152   2HG   ARG  11          3HG       ARG  11  45.793  15.803 -19.477
  153   1HD   ARG  11          2HD       ARG  11  45.619  16.085 -17.222
  154   2HD   ARG  11          3HD       ARG  11  45.485  14.341 -17.117
  155    HE   ARG  11           HE       ARG  11  48.201  14.667 -17.184
  156   1HH1  ARG  11          2HH2      ARG  11  45.701  16.242 -15.272
  157   2HH1  ARG  11          1HH2      ARG  11  46.742  16.537 -13.920
  158   1HH2  ARG  11          2HH1      ARG  11  49.575  15.055 -15.400
  159   2HH2  ARG  11          1HH1      ARG  11  48.960  15.858 -13.993
  160    H    GLN  12           HN       GLN  12  47.276  11.770 -16.770
  161    HA   GLN  12           HA       GLN  12  45.702   9.406 -17.438
  162   1HB   GLN  12          2HB       GLN  12  48.073   9.773 -15.582
  163   2HB   GLN  12          3HB       GLN  12  46.963   8.436 -15.354
  164   1HG   GLN  12          2HG       GLN  12  47.437   7.528 -17.539
  165   2HG   GLN  12          3HG       GLN  12  48.237   8.998 -18.062
  166   1HE2  GLN  12          1HE2      GLN  12  48.676   5.926 -16.958
  167   2HE2  GLN  12          2HE2      GLN  12  50.302   6.011 -16.365
  168    H    GLY  13           HN       GLY  13  43.738   9.274 -16.440
  169   1HA   GLY  13          1HA       GLY  13  42.935  11.261 -14.560
  170   2HA   GLY  13          2HA       GLY  13  42.010   9.881 -15.119
  171    H    GLY  14           HN       GLY  14  43.186  11.255 -12.375
  172   1HA   GLY  14          1HA       GLY  14  43.570  10.530 -10.284
  173   2HA   GLY  14          2HA       GLY  14  42.725   9.061 -10.728
  174    H    GLU  15           HN       GLU  15  43.878   7.195 -10.535
  175    HA   GLU  15           HA       GLU  15  46.773   7.478 -10.580
  176   1HB   GLU  15          2HB       GLU  15  45.099   6.283  -8.702
  177   2HB   GLU  15          3HB       GLU  15  45.662   4.906  -9.628
  178   1HG   GLU  15          2HG       GLU  15  47.311   5.159  -7.937
  179   2HG   GLU  15          3HG       GLU  15  48.050   5.889  -9.348
  180    H    ARG  16           HN       ARG  16  44.235   5.006 -11.439
  181    HA   ARG  16           HA       ARG  16  44.946   4.862 -14.075
  182   1HB   ARG  16          2HB       ARG  16  47.065   3.838 -12.810
  183   2HB   ARG  16          3HB       ARG  16  46.058   2.410 -12.680
  184   1HG   ARG  16          2HG       ARG  16  46.471   3.817 -15.348
  185   2HG   ARG  16          3HG       ARG  16  47.607   2.617 -14.765
  186   1HD   ARG  16          2HD       ARG  16  45.863   0.899 -14.684
  187   2HD   ARG  16          3HD       ARG  16  44.612   2.079 -15.020
  188    HE   ARG  16           HE       ARG  16  46.729   1.920 -17.065
  189   1HH1  ARG  16          2HH2      ARG  16  43.564   0.783 -16.031
  190   2HH1  ARG  16          1HH2      ARG  16  43.088   0.271 -17.617
  191   1HH2  ARG  16          2HH1      ARG  16  46.102   1.247 -19.157
  192   2HH2  ARG  16          1HH1      ARG  16  44.541   0.538 -19.407
  193    H    ARG  17           HN       ARG  17  42.655   4.672 -14.261
  194    HA   ARG  17           HA       ARG  17  41.654   2.126 -14.321
  195   1HB   ARG  17          2HB       ARG  17  41.515   3.326 -11.670
  196   2HB   ARG  17          3HB       ARG  17  39.888   3.124 -12.289
  197   1HG   ARG  17          2HG       ARG  17  40.468   0.714 -12.859
  198   2HG   ARG  17          3HG       ARG  17  42.020   0.947 -12.078
  199   1HD   ARG  17          2HD       ARG  17  39.301   1.289 -10.720
  200   2HD   ARG  17          3HD       ARG  17  40.349  -0.104 -10.540
  201    HE   ARG  17           HE       ARG  17  41.618   2.477  -9.892
  202   1HH1  ARG  17          2HH2      ARG  17  39.863  -0.314  -8.663
  203   2HH1  ARG  17          1HH2      ARG  17  40.388  -0.085  -7.029
  204   1HH2  ARG  17          2HH1      ARG  17  42.312   2.779  -7.736
  205   2HH2  ARG  17          1HH1      ARG  17  41.791   1.687  -6.498
  206    H    ARG  18           HN       ARG  18  40.482   5.404 -13.226
  207    HA   ARG  18           HA       ARG  18  38.109   5.407 -14.469
  208   1HB   ARG  18          2HB       ARG  18  38.742   7.243 -13.018
  209   2HB   ARG  18          3HB       ARG  18  40.108   7.669 -14.029
  210   1HG   ARG  18          2HG       ARG  18  38.756   8.656 -15.691
  211   2HG   ARG  18          3HG       ARG  18  37.342   7.718 -15.249
  212   1HD   ARG  18          2HD       ARG  18  36.623   9.408 -13.917
  213   2HD   ARG  18          3HD       ARG  18  38.069   9.267 -12.938
  214    HE   ARG  18           HE       ARG  18  39.052  11.066 -14.121
  215   1HH1  ARG  18          2HH2      ARG  18  36.042  10.079 -15.654
  216   2HH1  ARG  18          1HH2      ARG  18  35.959  11.472 -16.680
  217   1HH2  ARG  18          2HH1      ARG  18  38.942  12.905 -15.474
  218   2HH2  ARG  18          1HH1      ARG  18  37.619  13.091 -16.576
  219    H    SER  19           HN       SER  19  41.354   5.889 -15.882
  220    HA   SER  19           HA       SER  19  42.018   6.428 -17.911
  221   1HB   SER  19          2HB       SER  19  41.078   3.921 -17.864
  222   2HB   SER  19          3HB       SER  19  39.940   4.555 -19.036
  223    HG   SER  19           HG       SER  19  41.640   3.871 -20.283
  224    H    GLN  20           HN       GLN  20  40.223   5.985 -20.399
  225    HA   GLN  20           HA       GLN  20  39.195   8.655 -20.384
  226   1HB   GLN  20          2HB       GLN  20  39.954   6.630 -22.397
  227   2HB   GLN  20          3HB       GLN  20  38.507   7.515 -22.837
  228   1HG   GLN  20          2HG       GLN  20  39.938   9.640 -22.085
  229   2HG   GLN  20          3HG       GLN  20  41.300   8.572 -22.355
  230   1HE2  GLN  20          1HE2      GLN  20  39.183  10.732 -23.733
  231   2HE2  GLN  20          2HE2      GLN  20  39.423  10.391 -25.414
  232    H    LEU  21           HN       LEU  21  37.768   7.251 -18.502
  233    HA   LEU  21           HA       LEU  21  35.657   5.732 -19.143
  234   1HB   LEU  21          2HB       LEU  21  36.449   7.376 -16.999
  235   2HB   LEU  21          3HB       LEU  21  34.791   7.820 -17.354
  236    HG   LEU  21           HG       LEU  21  35.658   4.952 -16.936
  237   1HD1  LEU  21          1HD1      LEU  21  34.725   5.196 -14.630
  238   2HD1  LEU  21          2HD1      LEU  21  36.239   6.089 -14.911
  239   3HD1  LEU  21          3HD1      LEU  21  34.686   6.957 -14.887
  240   1HD2  LEU  21          1HD2      LEU  21  33.199   6.213 -17.727
  241   2HD2  LEU  21          2HD2      LEU  21  33.586   4.484 -17.570
  242   3HD2  LEU  21          3HD2      LEU  21  32.981   5.391 -16.163
  243    H    ASP  22           HN       ASP  22  34.242   5.838 -20.798
  244    HA   ASP  22           HA       ASP  22  33.683   8.367 -21.971
  245   1HB   ASP  22          2HB       ASP  22  33.899   6.024 -23.117
  246   2HB   ASP  22          3HB       ASP  22  32.261   5.742 -22.561
  247    H    ARG  23           HN       ARG  23  31.537   9.372 -22.039
  248    HA   ARG  23           HA       ARG  23  30.112   9.104 -19.674
  249   1HB   ARG  23          2HB       ARG  23  30.298  11.062 -21.510
  250   2HB   ARG  23          3HB       ARG  23  28.841  10.318 -22.139
  251   1HG   ARG  23          2HG       ARG  23  28.297  12.127 -20.525
  252   2HG   ARG  23          3HG       ARG  23  27.713  10.575 -19.956
  253   1HD   ARG  23          2HD       ARG  23  29.016  10.678 -18.092
  254   2HD   ARG  23          3HD       ARG  23  30.455  11.003 -19.037
  255    HE   ARG  23           HE       ARG  23  29.214  13.432 -19.128
  256   1HH1  ARG  23          2HH2      ARG  23  29.865  11.256 -16.441
  257   2HH1  ARG  23          1HH2      ARG  23  29.975  12.528 -15.270
  258   1HH2  ARG  23          2HH1      ARG  23  29.359  15.111 -17.584
  259   2HH2  ARG  23          1HH1      ARG  23  29.685  14.735 -15.925
  260    H    ASP  24           HN       ASP  24  30.198   7.093 -22.394
  261    HA   ASP  24           HA       ASP  24  27.521   6.122 -21.771
  262   1HB   ASP  24          2HB       ASP  24  28.871   6.615 -24.419
  263   2HB   ASP  24          3HB       ASP  24  27.834   5.208 -24.302
  264    H    GLN  25           HN       GLN  25  30.204   5.413 -20.654
  265    HA   GLN  25           HA       GLN  25  30.506   2.751 -21.807
  266   1HB   GLN  25          2HB       GLN  25  32.439   4.767 -20.832
  267   2HB   GLN  25          3HB       GLN  25  32.737   3.164 -20.189
  268   1HG   GLN  25          2HG       GLN  25  32.093   3.034 -23.047
  269   2HG   GLN  25          3HG       GLN  25  33.436   4.123 -22.762
  270   1HE2  GLN  25          1HE2      GLN  25  34.338   2.257 -24.102
  271   2HE2  GLN  25          2HE2      GLN  25  35.109   0.970 -23.236
  272    H    CYS  26           HN       CYS  26  31.715   1.321 -19.836
  273    HA   CYS  26           HA       CYS  26  29.832   1.576 -17.604
  274   1HB   CYS  26          2HB       CYS  26  29.328  -0.409 -18.907
  275   2HB   CYS  26          3HB       CYS  26  30.999  -0.932 -18.853
  276    H    ALA  27           HN       ALA  27  30.749   1.704 -15.546
  277    HA   ALA  27           HA       ALA  27  33.670   1.699 -15.476
  278   1HB   ALA  27          1HB       ALA  27  32.276   3.695 -14.724
  279   2HB   ALA  27          2HB       ALA  27  31.713   2.685 -13.371
  280   3HB   ALA  27          3HB       ALA  27  33.441   3.080 -13.529
  281    H    TYR  28           HN       TYR  28  32.196  -0.818 -15.686
  282    HA   TYR  28           HA       TYR  28  32.957  -1.940 -13.079
  283   1HB   TYR  28          2HB       TYR  28  30.392  -1.622 -13.724
  284   2HB   TYR  28          3HB       TYR  28  30.676  -2.885 -14.906
  285    HD1  TYR  28           HD1      TYR  28  30.068  -2.136 -11.414
  286    HD2  TYR  28           HD2      TYR  28  31.359  -5.186 -14.121
  287    HE1  TYR  28           HE1      TYR  28  29.634  -3.904  -9.639
  288    HE2  TYR  28           HE2      TYR  28  30.920  -6.945 -12.338
  289    HH   TYR  28           HH       TYR  28  29.228  -6.977 -10.222
  290    H    CYS  29           HN       CYS  29  31.877  -2.981 -16.398
  291    HA   CYS  29           HA       CYS  29  33.923  -5.038 -16.285
  292   1HB   CYS  29          2HB       CYS  29  32.789  -5.966 -18.277
  293   2HB   CYS  29          3HB       CYS  29  31.713  -5.806 -16.904
  294    H    LYS  30           HN       LYS  30  33.177  -1.884 -17.610
  295    HA   LYS  30           HA       LYS  30  34.621  -0.488 -18.631
  296   1HB   LYS  30          2HB       LYS  30  36.384  -2.471 -18.042
  297   2HB   LYS  30          3HB       LYS  30  36.410  -2.549 -19.792
  298   1HG   LYS  30          2HG       LYS  30  37.596  -0.617 -19.943
  299   2HG   LYS  30          3HG       LYS  30  36.451   0.239 -18.929
  300   1HD   LYS  30          2HD       LYS  30  38.393  -1.692 -17.638
  301   2HD   LYS  30          3HD       LYS  30  38.969  -0.112 -18.130
  302   1HE   LYS  30          2HE       LYS  30  38.074   0.799 -16.259
  303   2HE   LYS  30          3HE       LYS  30  36.474   0.319 -16.787
  304   1HZ   LYS  30          1HZ       LYS  30  38.224  -0.962 -14.904
  305   2HZ   LYS  30          2HZ       LYS  30  36.593  -0.914 -14.946
  306   3HZ   LYS  30          3HZ       LYS  30  37.403  -1.977 -15.885
  307    H    GLU  31           HN       GLU  31  32.260  -2.150 -19.601
  308    HA   GLU  31           HA       GLU  31  32.802  -2.480 -22.379
  309   1HB   GLU  31          2HB       GLU  31  31.223  -3.960 -21.148
  310   2HB   GLU  31          3HB       GLU  31  30.175  -2.591 -20.830
  311   1HG   GLU  31          2HG       GLU  31  29.393  -3.926 -22.789
  312   2HG   GLU  31          3HG       GLU  31  29.763  -2.272 -23.232
  313    H    LYS  32           HN       LYS  32  31.291  -1.396 -24.052
  314    HA   LYS  32           HA       LYS  32  30.882   1.401 -23.249
  315   1HB   LYS  32          2HB       LYS  32  32.822   1.004 -24.789
  316   2HB   LYS  32          3HB       LYS  32  31.701   0.387 -25.986
  317   1HG   LYS  32          2HG       LYS  32  30.768   2.479 -26.413
  318   2HG   LYS  32          3HG       LYS  32  31.034   3.056 -24.779
  319   1HD   LYS  32          2HD       LYS  32  32.968   4.059 -25.403
  320   2HD   LYS  32          3HD       LYS  32  33.616   2.530 -25.963
  321   1HE   LYS  32          2HE       LYS  32  31.598   3.636 -27.817
  322   2HE   LYS  32          3HE       LYS  32  32.948   4.727 -27.576
  323   1HZ   LYS  32          1HZ       LYS  32  34.440   3.061 -28.244
  324   2HZ   LYS  32          2HZ       LYS  32  33.307   1.884 -28.203
  325   3HZ   LYS  32          3HZ       LYS  32  33.237   3.044 -29.349
  326    H    GLY  33           HN       GLY  33  28.748   1.788 -23.016
  327   1HA   GLY  33          1HA       GLY  33  26.849   1.949 -24.814
  328   2HA   GLY  33          2HA       GLY  33  26.852   0.211 -24.595
  329    H    HIS  34           HN       HIS  34  27.094  -0.358 -22.003
  330    HA   HIS  34           HA       HIS  34  24.813   1.030 -20.838
  331   1HB   HIS  34          2HB       HIS  34  24.527  -0.912 -19.452
  332   2HB   HIS  34          3HB       HIS  34  24.679  -1.416 -21.123
  333    HD1  HIS  34           HD1      HIS  34  26.743  -2.842 -21.780
  334    HD2  HIS  34           HD2      HIS  34  26.704  -1.647 -17.759
  335    HE1  HIS  34           HE1      HIS  34  28.553  -4.208 -20.611
  336    H    TRP  35           HN       TRP  35  24.969   1.048 -18.259
  337    HA   TRP  35           HA       TRP  35  27.572   2.271 -17.663
  338   1HB   TRP  35          2HB       TRP  35  24.767   2.920 -16.893
  339   2HB   TRP  35          3HB       TRP  35  26.029   3.220 -15.714
  340    HD1  TRP  35           HD1      TRP  35  25.919   3.950 -19.568
  341    HE1  TRP  35           HE1      TRP  35  26.625   6.447 -20.047
  342    HE3  TRP  35           HE3      TRP  35  26.586   5.248 -14.697
  343    HZ2  TRP  35           HZ2      TRP  35  27.367   8.636 -18.373
  344    HZ3  TRP  35           HZ3      TRP  35  27.302   7.584 -14.206
  345    HH2  TRP  35           HH2      TRP  35  27.691   9.253 -15.949
  346    H    ALA  36           HN       ALA  36  28.207   2.007 -15.265
  347    HA   ALA  36           HA       ALA  36  28.411  -0.699 -14.672
  348   1HB   ALA  36          1HB       ALA  36  29.754   1.453 -13.913
  349   2HB   ALA  36          2HB       ALA  36  28.621   1.418 -12.542
  350   3HB   ALA  36          3HB       ALA  36  29.676   0.021 -12.860
  351    H    LYS  37           HN       LYS  37  26.071   1.821 -13.640
  352    HA   LYS  37           HA       LYS  37  24.868   0.270 -11.627
  353   1HB   LYS  37          2HB       LYS  37  24.035   2.703 -13.206
  354   2HB   LYS  37          3HB       LYS  37  22.946   1.947 -12.060
  355   1HG   LYS  37          2HG       LYS  37  24.465   2.315 -10.215
  356   2HG   LYS  37          3HG       LYS  37  25.790   2.720 -11.289
  357   1HD   LYS  37          2HD       LYS  37  23.305   4.400 -11.507
  358   2HD   LYS  37          3HD       LYS  37  24.274   4.606 -10.062
  359   1HE   LYS  37          2HE       LYS  37  25.773   5.858 -11.213
  360   2HE   LYS  37          3HE       LYS  37  26.085   4.522 -12.302
  361   1HZ   LYS  37          1HZ       LYS  37  24.844   5.465 -13.852
  362   2HZ   LYS  37          2HZ       LYS  37  23.608   5.798 -12.837
  363   3HZ   LYS  37          3HZ       LYS  37  24.867   6.832 -12.957
  364    H    ASP  38           HN       ASP  38  25.003  -0.138 -15.008
  365    HA   ASP  38           HA       ASP  38  22.658  -1.855 -14.825
  366   1HB   ASP  38          2HB       ASP  38  22.735   0.428 -16.359
  367   2HB   ASP  38          3HB       ASP  38  23.371  -0.734 -17.506
  368    H    CYS  39           HN       CYS  39  25.572  -2.371 -14.416
  369    HA   CYS  39           HA       CYS  39  26.635  -3.461 -16.800
  370   1HB   CYS  39          2HB       CYS  39  28.014  -2.620 -14.893
  371   2HB   CYS  39          3HB       CYS  39  27.478  -3.984 -13.931
  372    HA   PRO  40           HA       PRO  40  24.374  -7.207 -16.504
  373   1HB   PRO  40          2HB       PRO  40  25.434  -8.474 -18.680
  374   2HB   PRO  40          3HB       PRO  40  24.114  -7.324 -18.788
  375   1HG   PRO  40          2HG       PRO  40  26.957  -6.955 -19.509
  376   2HG   PRO  40          3HG       PRO  40  25.568  -6.000 -19.992
  377   1HD   PRO  40          2HD       PRO  40  27.524  -5.306 -18.013
  378   2HD   PRO  40          3HD       PRO  40  26.074  -4.409 -18.413
  379    H    LYS  41           HN       LYS  41  27.474  -6.709 -15.689
  380    HA   LYS  41           HA       LYS  41  28.065  -9.534 -15.338
  381   1HB   LYS  41          2HB       LYS  41  29.607  -7.210 -15.849
  382   2HB   LYS  41          3HB       LYS  41  30.052  -7.754 -14.245
  383   1HG   LYS  41          2HG       LYS  41  29.945 -10.160 -15.611
  384   2HG   LYS  41          3HG       LYS  41  30.484  -9.076 -16.878
  385   1HD   LYS  41          2HD       LYS  41  32.574  -9.341 -16.015
  386   2HD   LYS  41          3HD       LYS  41  32.057  -8.267 -14.730
  387   1HE   LYS  41          2HE       LYS  41  32.964 -10.265 -13.689
  388   2HE   LYS  41          3HE       LYS  41  31.230 -10.283 -13.436
  389   1HZ   LYS  41          1HZ       LYS  41  31.234 -11.628 -15.601
  390   2HZ   LYS  41          2HZ       LYS  41  32.809 -11.900 -15.271
  391   3HZ   LYS  41          3HZ       LYS  41  31.659 -12.372 -14.211
  392    H    LYS  42           HN       LYS  42  26.698  -6.809 -13.659
  393    HA   LYS  42           HA       LYS  42  27.448  -7.314 -11.059
  394   1HB   LYS  42          2HB       LYS  42  25.104  -6.022 -12.392
  395   2HB   LYS  42          3HB       LYS  42  24.980  -6.372 -10.680
  396   1HG   LYS  42          2HG       LYS  42  27.496  -5.288 -10.747
  397   2HG   LYS  42          3HG       LYS  42  26.772  -4.439 -12.098
  398   1HD   LYS  42          2HD       LYS  42  25.190  -4.620  -9.535
  399   2HD   LYS  42          3HD       LYS  42  26.556  -3.523  -9.579
  400   1HE   LYS  42          2HE       LYS  42  25.431  -2.793 -11.923
  401   2HE   LYS  42          3HE       LYS  42  23.987  -3.424 -11.156
  402   1HZ   LYS  42          1HZ       LYS  42  25.561  -1.120 -10.447
  403   2HZ   LYS  42          2HZ       LYS  42  23.950  -1.358 -10.330
  404   3HZ   LYS  42          3HZ       LYS  42  24.951  -1.974  -9.195
  405    HA   PRO  43           HA       PRO  43  25.614 -11.290 -10.690
  406   1HB   PRO  43          2HB       PRO  43  26.989 -12.059  -8.456
  407   2HB   PRO  43          3HB       PRO  43  27.594 -12.298 -10.084
  408   1HG   PRO  43          2HG       PRO  43  28.431 -10.303  -8.068
  409   2HG   PRO  43          3HG       PRO  43  29.281 -10.835  -9.504
  410   1HD   PRO  43          2HD       PRO  43  27.849  -8.371  -9.172
  411   2HD   PRO  43          3HD       PRO  43  28.601  -8.956 -10.643
  412    H    ARG  44           HN       ARG  44  24.178 -12.451  -9.245
  413    HA   ARG  44           HA       ARG  44  23.142 -10.561  -7.286
  414   1HB   ARG  44          2HB       ARG  44  20.864 -11.417  -7.773
  415   2HB   ARG  44          3HB       ARG  44  21.600 -10.780  -9.231
  416   1HG   ARG  44          2HG       ARG  44  21.269 -12.778 -10.246
  417   2HG   ARG  44          3HG       ARG  44  22.382 -13.520  -9.113
  418   1HD   ARG  44          2HD       ARG  44  20.420 -13.727  -7.470
  419   2HD   ARG  44          3HD       ARG  44  19.364 -13.203  -8.767
  420    HE   ARG  44           HE       ARG  44  20.921 -15.329  -9.806
  421   1HH1  ARG  44          2HH2      ARG  44  18.511 -14.842  -7.288
  422   2HH1  ARG  44          1HH2      ARG  44  17.910 -16.465  -7.371
  423   1HH2  ARG  44          2HH1      ARG  44  20.128 -17.469  -9.916
  424   2HH2  ARG  44          1HH1      ARG  44  18.836 -17.969  -8.877
  425    H    GLY  45           HN       GLY  45  22.071 -11.597  -5.373
  426   1HA   GLY  45          1HA       GLY  45  22.920 -14.400  -4.967
  427   2HA   GLY  45          2HA       GLY  45  23.237 -13.156  -3.774
  428    HA   PRO  46           HA       PRO  46  23.013 -14.836  -2.564
  429   1HB   PRO  46          2HB       PRO  46  22.175 -17.114  -1.307
  430   2HB   PRO  46          3HB       PRO  46  22.279 -15.560  -0.505
  431   1HG   PRO  46          2HG       PRO  46  19.877 -17.003  -1.446
  432   2HG   PRO  46          3HG       PRO  46  19.987 -15.689  -0.291
  433   1HD   PRO  46          2HD       PRO  46  19.120 -15.508  -3.019
  434   2HD   PRO  46          3HD       PRO  46  19.340 -14.178  -1.898
  435    H    ARG  47           HN       ARG  47  24.586 -16.145  -3.420
  436    HA   ARG  47           HA       ARG  47  23.557 -18.274  -5.069
  437   1HB   ARG  47          2HB       ARG  47  23.761 -16.355  -6.624
  438   2HB   ARG  47          3HB       ARG  47  25.404 -16.059  -6.092
  439   1HG   ARG  47          2HG       ARG  47  25.838 -18.559  -6.834
  440   2HG   ARG  47          3HG       ARG  47  24.346 -18.379  -7.737
  441   1HD   ARG  47          2HD       ARG  47  25.356 -17.106  -9.336
  442   2HD   ARG  47          3HD       ARG  47  26.087 -16.052  -8.142
  443    HE   ARG  47           HE       ARG  47  27.316 -18.428  -9.375
  444   1HH1  ARG  47          2HH2      ARG  47  27.462 -16.093  -6.745
  445   2HH1  ARG  47          1HH2      ARG  47  29.142 -16.369  -6.424
  446   1HH2  ARG  47          2HH1      ARG  47  29.532 -18.792  -8.951
  447   2HH2  ARG  47          1HH1      ARG  47  30.328 -17.914  -7.687
  448    H    GLY  48           HN       GLY  48  24.611 -19.999  -4.107
  449   1HA   GLY  48          1HA       GLY  48  26.287 -21.314  -3.391
  450   2HA   GLY  48          2HA       GLY  48  27.386 -20.331  -4.339
  451    HA   PRO  49           HA       PRO  49  27.820 -19.506   0.240
  452   1HB   PRO  49          2HB       PRO  49  29.673 -21.347   1.041
  453   2HB   PRO  49          3HB       PRO  49  27.951 -21.547   1.297
  454   1HG   PRO  49          2HG       PRO  49  29.698 -22.883  -0.679
  455   2HG   PRO  49          3HG       PRO  49  28.106 -23.358  -0.122
  456   1HD   PRO  49          2HD       PRO  49  28.748 -22.106  -2.622
  457   2HD   PRO  49          3HD       PRO  49  27.145 -22.477  -2.016
  458    H    ARG  50           HN       ARG  50  29.467 -18.287   1.281
  459    HA   ARG  50           HA       ARG  50  31.198 -17.235  -0.687
  460   1HB   ARG  50          2HB       ARG  50  30.806 -16.716   2.291
  461   2HB   ARG  50          3HB       ARG  50  32.066 -15.899   1.388
  462   1HG   ARG  50          2HG       ARG  50  29.772 -15.609  -0.231
  463   2HG   ARG  50          3HG       ARG  50  29.165 -15.406   1.400
  464   1HD   ARG  50          2HD       ARG  50  30.477 -13.499   1.810
  465   2HD   ARG  50          3HD       ARG  50  31.714 -13.968   0.660
  466    HE   ARG  50           HE       ARG  50  29.548 -13.570  -0.979
  467   1HH1  ARG  50          2HH2      ARG  50  30.993 -11.603   1.555
  468   2HH1  ARG  50          1HH2      ARG  50  30.513 -10.100   0.840
  469   1HH2  ARG  50          2HH1      ARG  50  28.915 -11.589  -1.924
  470   2HH2  ARG  50          1HH1      ARG  50  29.323 -10.092  -1.153
  471    HA   PRO  51           HA       PRO  51  34.542 -19.899   0.282
  472   1HB   PRO  51          2HB       PRO  51  36.438 -18.782  -1.338
  473   2HB   PRO  51          3HB       PRO  51  35.248 -19.935  -1.909
  474   1HG   PRO  51          2HG       PRO  51  35.341 -17.010  -2.323
  475   2HG   PRO  51          3HG       PRO  51  34.433 -18.215  -3.212
  476   1HD   PRO  51          2HD       PRO  51  33.407 -16.405  -1.237
  477   2HD   PRO  51          3HD       PRO  51  32.525 -17.687  -2.042
  478    H    GLN  52           HN       GLN  52  36.761 -19.963   1.188
  479    HA   GLN  52           HA       GLN  52  37.053 -17.544   2.793
  480   1HB   GLN  52          2HB       GLN  52  38.029 -18.957   4.551
  481   2HB   GLN  52          3HB       GLN  52  36.437 -19.548   4.118
  482   1HG   GLN  52          2HG       GLN  52  37.443 -21.293   2.671
  483   2HG   GLN  52          3HG       GLN  52  39.048 -20.669   2.994
  484   1HE2  GLN  52          1HE2      GLN  52  37.971 -23.302   3.491
  485   2HE2  GLN  52          2HE2      GLN  52  38.118 -23.629   5.186
  486    H    THR  53           HN       THR  53  39.337 -16.971   3.404
  487    HA   THR  53           HA       THR  53  41.187 -17.798   1.265
  488    HB   THR  53           HB       THR  53  40.363 -15.400   1.214
  489    HG1  THR  53           HG1      THR  53  43.121 -15.976   2.048
  490   1HG2  THR  53          1HG2      THR  53  40.283 -14.228   3.175
  491   2HG2  THR  53          2HG2      THR  53  41.076 -15.562   4.047
  492   3HG2  THR  53          3HG2      THR  53  42.059 -14.321   3.235
  493    H    SER  54           HN       SER  54  41.235 -19.661   3.070
  494    HA   SER  54           HA       SER  54  42.690 -19.055   5.374
  495   1HB   SER  54          2HB       SER  54  41.251 -21.197   4.556
  496   2HB   SER  54          3HB       SER  54  42.849 -21.802   4.167
  497    HG   SER  54           HG       SER  54  43.403 -21.083   6.474
  498    H    LEU  55           HN       LEU  55  44.938 -20.008   5.857
  499    HA   LEU  55           HA       LEU  55  47.106 -20.086   5.456
  500   1HB   LEU  55          2HB       LEU  55  46.021 -21.162   2.882
  501   2HB   LEU  55          3HB       LEU  55  47.740 -20.855   3.033
  502    HG   LEU  55           HG       LEU  55  46.491 -22.435   5.222
  503   1HD1  LEU  55          1HD1      LEU  55  46.309 -23.224   2.391
  504   2HD1  LEU  55          2HD1      LEU  55  47.040 -24.445   3.460
  505   3HD1  LEU  55          3HD1      LEU  55  45.415 -23.811   3.814
  506   1HD2  LEU  55          1HD2      LEU  55  49.119 -22.137   3.894
  507   2HD2  LEU  55          2HD2      LEU  55  48.712 -22.419   5.604
  508   3HD2  LEU  55          3HD2      LEU  55  48.707 -23.776   4.452
  509    H    LEU  56           HN       LEU  56  48.393 -18.327   5.428
  510    HA   LEU  56           HA       LEU  56  49.256 -16.377   4.859
  511   1HB   LEU  56          2HB       LEU  56  48.306 -17.280   2.152
  512   2HB   LEU  56          3HB       LEU  56  49.088 -15.727   2.375
  513    HG   LEU  56           HG       LEU  56  50.362 -18.338   3.224
  514   1HD1  LEU  56          1HD1      LEU  56  49.774 -17.667   0.603
  515   2HD1  LEU  56          2HD1      LEU  56  51.456 -17.121   0.808
  516   3HD1  LEU  56          3HD1      LEU  56  51.022 -18.813   1.150
  517   1HD2  LEU  56          1HD2      LEU  56  52.234 -17.165   3.727
  518   2HD2  LEU  56          2HD2      LEU  56  51.945 -15.937   2.471
  519   3HD2  LEU  56          3HD2      LEU  56  51.046 -15.870   4.007