*HEADER    TRANSCRIPTION/RNA                       27-JUN-06   2HGH              
*TITLE     TRANSCRIPTION FACTOR IIIA ZINC FINGERS 4-6 BOUND TO 5S RRNA           
*TITLE    2 55MER (NMR STRUCTURE)                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRANSCRIPTION FACTOR IIIA;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZINC FINGERS 4-6 (RESIDUES 127-212);                       
*COMPND   5 SYNONYM: FACTOR A, TFIIIA, S-TFIIIA/O-TFIIIA;                        
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: 55-MER;                                                    
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS;                                 
*SOURCE   3 ORGANISM_COMMON: AFRICAN CLAWED FROG;                                
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET22B(+);                                
*SOURCE   9 MOL_ID: 2;                                                           
*SOURCE  10 SYNTHETIC: YES;                                                      
*SOURCE  11 OTHER_DETAILS: RNA WAS SYNTHESIZED BY IN VITRO                       
*SOURCE  12 TRANSCRIPTION FROM LINEARIZED PUC18 PLASMID CONTAINING THE           
*SOURCE  13 55MER SEQUENCE AND THE PRIMER BINDING SITE FOR T7 RNA                
*SOURCE  14 POLYMERASE                                                           
*KEYWDS    ZINC FINGER                                                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    B.M.LEE                                                               
*REVDAT   4   12-DEC-06 2HGH    1   REVISED CONSTRAINTS                          
*REVDAT   3   31-OCT-06 2HGH    1   REVISED CONSTRAINTS                          
*REVDAT   2   17-OCT-06 2HGH    1   REVISED CONSTRAINTS                          
*REVDAT   1   01-AUG-06 2HGH    0                                                
# 5S rRNA 55mer
# NOEs:         2.7     3.3     5.0
# H-BONDS HN->O: 2.0 N->O: 3.0
#
#
#****************************************
#--HBONDS--Base-Pairs
#****************************************
  1 RGUA O6     55 RCYT H41     2.00
  1 RGUA O6     55 RCYT N4      3.00
  1 RGUA H1     55 RCYT N3      2.00
  1 RGUA N1     55 RCYT N3      3.00
  1 RGUA H21    55 RCYT O2      2.00
  1 RGUA N2     55 RCYT O2      3.00
  2 RGUA O6     54 RCYT H41     2.00
  2 RGUA O6     54 RCYT N4      3.00
  2 RGUA H1     54 RCYT N3      2.00
  2 RGUA N1     54 RCYT N3      3.00
  2 RGUA H21    54 RCYT O2      2.00
  2 RGUA N2     54 RCYT O2      3.00
  3 RGUA O6     53 RCYT H41     2.00
  3 RGUA O6     53 RCYT N4      3.00
  3 RGUA H1     53 RCYT N3      2.00
  3 RGUA N1     53 RCYT N3      3.00
  3 RGUA H21    53 RCYT O2      2.00
  3 RGUA N2     53 RCYT O2      3.00
  4 RCYT H41    52 RGUA O6      2.00
  4 RCYT N4     52 RGUA O6      3.00
  4 RCYT N3     52 RGUA H1      2.00
  4 RCYT N3     52 RGUA N1      3.00
  4 RCYT O2     52 RGUA H21     2.00
  4 RCYT O2     52 RGUA N2      3.00
# 6 RADE N3     17 RGUA H22     2.00
# 6 RADE N3     17 RGUA N2      3.00
# 8 RADE OP2    17 RGUA H21     2.00
# 8 RADE OP2    17 RGUA N2      3.00
  9 RCYT H41    16 RGUA O6      2.00
  9 RCYT N4     16 RGUA O6      3.00
  9 RCYT N3     16 RGUA H1      2.00
  9 RCYT N3     16 RGUA N1      3.00
  9 RCYT O2     16 RGUA H21     2.00
  9 RCYT O2     16 RGUA N2      3.00
 10 RCYT H41    15 RGUA O6      2.00
 10 RCYT N4     15 RGUA O6      3.00
 10 RCYT N3     15 RGUA H1      2.00
 10 RCYT N3     15 RGUA N1      3.00
 10 RCYT O2     15 RGUA H21     2.00
 10 RCYT O2     15 RGUA N2      3.00
#14 URA H3      16 RGUA O6      2.00
#14 URA N3      16 RGUA O6      3.00
 17 RGUA O6     51 URA H3       2.00
 17 RGUA O6     51 URA N3       3.00
 17 RGUA H1     51 URA O2       2.00
 17 RGUA N1     51 URA O2       3.00
 18 RCYT H41    50 RGUA O6      2.00
 18 RCYT N4     50 RGUA O6      3.00
 18 RCYT N3     50 RGUA H1      2.00
 18 RCYT N3     50 RGUA N1      3.00
 18 RCYT O2     50 RGUA H21     2.00
 18 RCYT O2     50 RGUA N2      3.00
 19 RCYT H41    49 RGUA O6      2.00
 19 RCYT N4     49 RGUA O6      3.00
 19 RCYT N3     49 RGUA H1      2.00
 19 RCYT N3     49 RGUA N1      3.00
 19 RCYT O2     49 RGUA H21     2.00
 19 RCYT O2     49 RGUA N2      3.00
 20 URA H3      48 RADE N1      2.00
 20 URA N3      48 RADE N1      3.00
 20 URA O4      48 RADE H61     2.00
 20 URA O4      48 RADE N6      3.00
 21 RGUA O6     47 RCYT H41     2.00
 21 RGUA O6     47 RCYT N4      3.00
 21 RGUA H1     47 RCYT N3      2.00
 21 RGUA N1     47 RCYT N3      3.00
 21 RGUA H21    47 RCYT O2      2.00
 21 RGUA N2     47 RCYT O2      3.00
 22 RGUA O6     46 RCYT H41     2.00
 22 RGUA O6     46 RCYT N4      3.00
 22 RGUA H1     46 RCYT N3      2.00
 22 RGUA N1     46 RCYT N3      3.00
 22 RGUA H21    46 RCYT O2      2.00
 22 RGUA N2     46 RCYT O2      3.00
 23 URA H3      45 RADE N1      2.00
 23 URA N3      45 RADE N1      3.00
 23 URA O4      45 RADE H61     2.00
 23 URA O4      45 RADE N6      3.00
 24 URA H3      44 URA O4       2.00
 24 URA N3      44 URA O4       3.00
 24 URA O2      44 URA H3       2.00
 24 URA O2      44 URA N3       3.00
 25 RADE H62    43 RADE N7      2.00
 25 RADE N6     43 RADE N7      3.00
 25 RADE N7     43 RADE H62     2.00
 25 RADE N7     43 RADE N6      3.00
#26 RGUA H1     42 RADE OP2     2.00
#26 RGUA N1     42 RADE OP2     3.00
#26 RGUA H21    42 RADE OP2     2.00
#26 RGUA N2     42 RADE OP2     3.00
#26 RGUA H22    27 URA O4       2.00
#26 RGUA N2     27 URA O4       3.00
 27 URA H3      42 RADE N7      2.00
 27 URA N3      42 RADE N7      3.00
 27 URA O2      42 RADE H62     2.00
 27 URA O2      42 RADE N6      3.00
 28 RADE H62    41 RGUA N3      2.00
 28 RADE N6     41 RGUA N3      3.00
 28 RADE N7     41 RGUA H22     2.00
 28 RADE N7     41 RGUA N2      3.00
#28 RADE OP2    41 RGUA H1      2.00
#28 RADE OP2    41 RGUA N1      3.00
#28 RADE OP2    41 RGUA H21     2.00
#28 RADE OP2    41 RGUA N2      3.00
 29 RCYT H41    40 RGUA O6      2.00
 29 RCYT N4     40 RGUA O6      3.00
 29 RCYT N3     40 RGUA H1      2.00
 29 RCYT N3     40 RGUA N1      3.00
 29 RCYT O2     40 RGUA H21     2.00
 29 RCYT O2     40 RGUA N2      3.00
 30 RCYT H41    39 RGUA O6      2.00
 30 RCYT N4     39 RGUA O6      3.00
 30 RCYT N3     39 RGUA H1      2.00
 30 RCYT N3     39 RGUA N1      3.00
 30 RCYT O2     39 RGUA H21     2.00
 30 RCYT O2     39 RGUA N2      3.00
 31 URA H3      38 URA O2       2.00
 31 URA N3      38 URA O2       3.00
 31 URA O4      38 URA H3       2.00
 31 URA O4      38 URA N3       3.00
 32 RCYT H41    37 RGUA O6      2.00
 32 RCYT N4     37 RGUA O6      3.00
 32 RCYT N3     37 RGUA H1      2.00
 32 RCYT N3     37 RGUA N1      3.00
 32 RCYT O2     37 RGUA H21     2.00
 32 RCYT O2     37 RGUA N2      3.00
 33 URA O2      36 RGUA H1      2.00
 33 URA O2      36 RGUA N1      3.00
 33 URA O2      36 RGUA H21     2.00
 33 URA O2      36 RGUA N2      3.00
 33 URA HO2'    36 RGUA O6      2.00
 33 URA O2'     36 RGUA O6      3.00
#****************************************
#--Planarity--Base-Pairs
#****************************************
  1 RGUA C1'    55 RCYT C1'    10.80
  2 RGUA C1'    54 RCYT C1'    10.80
  3 RGUA C1'    53 RCYT C1'    10.80
  4 RCYT C1'    52 RGUA C1'    10.80
  9 RCYT C1'    16 RGUA C1'    10.80
 10 RCYT C1'    15 RGUA C1'    10.80
 17 RGUA C1'    51 URA C1'     12.00
 18 RCYT C1'    50 RGUA C1'    10.80
 19 RCYT C1'    49 RGUA C1'    10.80
 20 URA C1'     48 RADE C1'    10.50
 21 RGUA C1'    47 RCYT C1'    10.80
 22 RGUA C1'    46 RCYT C1'    10.80
 23 URA C1'     45 RADE C1'    10.50
 24 URA C1'     44 URA C1'      9.20 #removed 23jul02
 24 URA N3      44 URA N3       3.70
 25 RADE C1'    43 RADE C1'    11.20 #430D 11.0
#26 RGUA C1'    27 URA C1'      7.10 #430D 6.88
#26 RGUA C1'    42 RADE C1'    10.60 #430D 10.4
 27 URA C1'     42 RADE C1'     9.90 #430D 9.7
 28 RADE C1'    41 RGUA C1'     9.70 #430D 9.5
 29 RCYT C1'    40 RGUA C1'    10.80
 30 RCYT C1'    39 RGUA C1'    10.80
 31 URA C1'     38 URA C1'      9.20 #removed 23jul02
 31 URA N3      38 URA N3       3.70
 32 RCYT C1'    37 RGUA C1'    10.40
 33 URA C1'     36 RGUA C1'    10.10
#****************************************
#--NOE--Base-Pairs
#****************************************
  1 RGUA H8      1 RGUA H3'     3.30 #intra b-s
  1 RGUA H1'     2 RGUA H8      5.00 #seq b-s
  1 RGUA H2'     2 RGUA H8      2.70 #seq b-s
  1 RGUA H2'     2 RGUA H5'     3.30 #seq s-s
  1 RGUA H3'     2 RGUA H8      3.30 #seq b-s
  1 RGUA H8      2 RGUA H8      5.00 #seq b-b
# 1 RGUA H1      2 RGUA H1'     5.00 #seq i-s
  1 RGUA H1      2 RGUA H1      5.00 #seq i-i
# 1 RGUA H1     55 RCYT H5      5.00 #x-s i-b
# 1 RGUA H1     55 RCYT H1'     5.00 #x-s i-s
# 1 RGUA H1     55 RCYT H2'     5.00 #x-s i-s
  2 RGUA H8      2 RGUA H3'     3.30 #intra b-s
  2 RGUA H1'     3 RGUA H8      5.00 #seq b-s
  2 RGUA H2'     3 RGUA H8      2.70 #seq b-s
  2 RGUA H2'     3 RGUA H5'     3.30 #seq s-s
  2 RGUA H3'     3 RGUA H8      3.30 #seq b-s
  2 RGUA H8      3 RGUA H8      5.00 #seq b-b
# 2 RGUA H1      3 RGUA H1'     5.00 #seq i-s
  2 RGUA H1      3 RGUA H1      5.00 #seq i-i
# 2 RGUA H1     54 RCYT H5      5.00 #x-s i-b
# 2 RGUA H1     54 RCYT H1'     5.00 #x-s i-s
# 2 RGUA H1     54 RCYT H2'     5.00 #x-s i-s
  2 RGUA H1     55 RCYT H5      4.50 #x-s i-b
# 2 RGUA H1     55 RCYT H1'     5.00 #x-s i-s
  3 RGUA H8      3 RGUA H3'     3.30 #intra b-s
  3 RGUA H1'     4 RCYT H6      5.00 #seq b-s
  3 RGUA H2'     4 RCYT H5      5.00 #seq b-s
  3 RGUA H2'     4 RCYT H6      2.70 #seq b-s
  3 RGUA H2'     4 RCYT H5'     3.30 #seq s-s
  3 RGUA H3'     4 RCYT H5      5.00 #seq b-s
  3 RGUA H3'     4 RCYT H6      3.30 #seq b-s
  3 RGUA H8      4 RCYT H5      5.00 #seq b-b
  3 RGUA H8      4 RCYT H6      5.00 #seq b-b
# 3 RGUA H1      4 RCYT H5      5.00 #seq i-b
# 3 RGUA H1      4 RCYT H1'     5.00 #seq i-s
  3 RGUA H1     52 RGUA H1      5.00 #x-s i-i
# 3 RGUA H1     53 RCYT H5      5.00 #x-s i-b
# 3 RGUA H1     53 RCYT H1'     5.00 #x-s i-s
# 3 RGUA H1     53 RCYT H2'     5.00 #x-s i-s
  3 RGUA H1     54 RCYT H5      4.50 #x-s i-b
# 3 RGUA H1     54 RCYT H1'     5.00 #x-s i-s
  4 RCYT H6      4 RCYT H3'     3.30 #intra b-s
  4 RCYT H2'     5 RCYT H1'     6.00 #seq s-s 19jul4 
  4 RCYT H2'     5 RCYT H5      5.00 #seq b-s 19jul4 
  4 RCYT H2'     5 RCYT H6      5.00 #seq b-s 19jul4
  4 RCYT H3'     5 RCYT H1'     6.00 #seq s-s 19jul4 rlx 9aug4
  4 RCYT H3'     5 RCYT H5      3.30 #seq b-s 21jun4 switch h3' to h2' 16jul4 to h3' 19jul4
  4 RCYT H3'     5 RCYT H6      3.30 #seq b-s 21jun4 switch h3' to h2' 16jul4 to h3' 19jul4
  4 RCYT H5      8 RADE H2      6.00 #16jul4 switch h2' to h5 19jul4
  4 RCYT H5      5 RCYT H5      3.30 #seq b-b 21jun4
  4 RCYT H5      5 RCYT H6      6.00 #seq b-b 21jun4
  4 RCYT H6      5 RCYT H5      3.30 #seq b-b 21jun4
  4 RCYT H6      5 RCYT H6      6.00 #seq b-b 21jun4
# 4 RCYT H5     52 RGUA H1      5.00 #x-s i-b
# 4 RCYT H1'    52 RGUA H1      5.00 #x-s i-s
# 4 RCYT H2'    52 RGUA H1      5.00 #x-s i-s
# 5 RCYT H1'     5 RCYT H6      5.00 #intra b-s???asn?
  5 RCYT H1'     6 RADE H4'     5.00 #seq s-s 2jun4
  5 RCYT H1'     6 RADE H5'     5.00 #seq s-s 2jun4
  5 RCYT H1'     6 RADE H8      5.00 #seq b-s 2jun4 rlx 25jun4
  5 RCYT H1'     8 RADE H2      5.00 #MEDIUM-STRONG d5sa46hnoe900.nv rlx 7jun4 adj 16jun4 rlx 25jun4 rlx 9jul4 rlx 21jul4
  6 RADE H4'     6 RADE H8      5.00 #intra b-s 2jun4 STRONG? rlx 25jun4
  6 RADE H5'     6 RADE H8      5.00 #intra b-s 2jun4 rlx 19jul4 3.70 1un6
  6 RADE H1'     8 RADE HO2'    2.70 #MED 19jul4 adj 5aug4
  6 RADE H1'     8 RADE H2      6.00 #MED 2D d5sa46hnoe900.nv 13may4 rlx 3jun4 rlx 20jul4
  6 RADE H1'     8 RADE H8      6.00 #overlap 20jul4
  6 RADE H1'     9 RCYT H5      5.00 #MED 2D d5sa46hnoe900.nv 1jun4 rlx 7jul4
  6 RADE H1'     9 RCYT H6      6.00 #WEAK 2D d5sa46hnoe900.nv 1jun4 rlx 20jul4
  6 RADE H4'     8 RADE H2      6.00 #WEAK d5sa46hdhfnoe.nv 2jun4 rlx 20jul4
  6 RADE H4'     8 RADE H8      3.30 #MEDIUM d5sa46hdhfnoe.nv 2jun4 rlx 25jun4 adj 16jul4
  6 RADE H8      8 RADE H2      6.00 #WEAK-MED 2D d5sa46hdhfnoe.nv 14may4 rlx 16jul4
# 6 RADE H8     17 RGUA H2'     6.00 #VERY WEAK d5sa46hdhfnoe.nv 4jun4 guess 18 chg 8jul4 SD
  6 RADE H2      9 RCYT H1'     5.00 #MEDIUM 2D d5sa46hdhfnoe.nv 1jun4 rlx 7jul4 adj 16jul4 rlx 19jul4
  6 RADE H2     10 RCYT H1'     6.00 #WEAK 2D d5sa46hdhfnoe.nv 1jun4 rlx 16jun4
  6 RADE H2     16 RGUA H1      5.00 #MED 2D 5sa46gnoesy80288.nv 13may4 rlx 7jul4
  6 RADE H2     17 RGUA H1'     3.30 #STRONG 2D d5sa46hdhfnoe.nv 1jun4 rlx 3jun4 adj 16jun4 rlx 15jul4 adj 16jul4 rlx 19jul4
  6 RADE H2     17 RGUA H1      5.00 #MED 2D 5sa46gnoesy80288.nv 13may4 rlx 1jul4 adj 16jul4 rlx 19jul4
  6 RADE H2     18 RCYT H1'     5.00 #WEAK-MED d5sa46hdhfnoe.nv 4jun4 guess 18
  6 RADE H2     17 RGUA H2'     6.00 #MEDIUM d5sa46hdhfnoe.nv 4jun4 guess 18 rlx 7jun7 chg 8jul4 rlx 16jul4
  6 RADE H2     18 RCYT H6      5.00 #MEDIUM 5sa46gnoesy80288.nv 24jun4 rlx 25jun4 adj 16jul4 rlx 19jul4
# 6 RADE H2     51 URA H3       6.00 #WEAK 2D 5sa46gnoesy80288.nv 13may4 SD 7jul4
  7 URA H1'     19 RCYT H1'     5.00 #GUESS 30jun4
  7 URA H5      19 RCYT H1'     3.30 #GUESS 30jun4
# 7 URA H5      19 RCYT H6      5.00 #GUESS 30jun4 rm 1oct4
  7 URA H6      19 RCYT H1'     3.30 #GUESS 30jun4 rlx 1jul4
# 7 URA H6      19 RCYT H6      5.00 #GUESS 30jun4 rm 1oct4
# 8 RADE H1'     9 RCYT H5      6.00 #seq b-s 2jun4 rlx 3jun4 rlx 21jul4 rm 5aug4
  8 RADE H1'     9 RCYT H6      6.00 #seq b-s 2jun4 rlx 3jun4 rlx 20jul4
  8 RADE H8      9 RCYT H5      6.00 #seq b-b 2jun4 rlx 16jul4
# 8 RADE H8      9 RCYT H6      5.00 #seq b-b 2jun4 SD 7jul4
  8 RADE H2     52 RGUA H1      6.00 #MED guessing 52 asn rlx 7jun4 rlx 21jul4
  9 RCYT H6      9 RCYT H3'     3.30 #intra b-s
  9 RCYT H1'    10 RCYT H6      5.00 #seq b-s
  9 RCYT H2'    10 RCYT H5      5.00 #seq b-s
  9 RCYT H2'    10 RCYT H6      2.70 #seq b-s
  9 RCYT H2'    10 RCYT H5'     3.30 #seq s-s
  9 RCYT H3'    10 RCYT H5      5.00 #seq b-s
  9 RCYT H3'    10 RCYT H6      3.30 #seq b-s
  9 RCYT H5     10 RCYT H5      5.00 #seq b-b
  9 RCYT H6     10 RCYT H5      5.00 #seq b-b
  9 RCYT H6     10 RCYT H6      5.00 #seq b-b
  9 RCYT H5     16 RGUA H1      5.00 #x-s i-b CONFIRMED 4jun4
  9 RCYT H5     17 RGUA H1      5.00 #x-s i-b CONFIRMED 4jun4
# 9 RCYT H1'    16 RGUA H1      5.00 #x-s i-s
# 9 RCYT H2'    16 RGUA H1      5.00 #x-s i-s
 10 RCYT H6     10 RCYT H3'     3.30 #intra b-s
 10 RCYT H1'    16 RGUA H1      5.00 #x-s i-s 5sa46gnoesy80288.nv 1jun4
 10 RCYT H1'    16 RGUA H21     5.00 #x-s a-s 5sa46gnoesy80288.nv 1jun4
 10 RCYT H1'    16 RGUA H22     3.30 #x-s a-s 5sa46gnoesy80288.nv 1jun4
 10 RCYT H2'    11 URA H6       5.00 #seq b-s 1jwc
 10 RCYT H2'    11 URA H5'      3.30 #seq s-s 1jwc
 10 RCYT H3'    11 URA H6       5.00 #seq b-s 1jwc
#10 RCYT H5     15 RGUA H1      5.00 #x-s i-b
#10 RCYT H1'    15 RGUA H1      5.00 #x-s i-s
#10 RCYT H2'    15 RGUA H1      5.00 #x-s i-s
 10 RCYT H5     16 RGUA H1      5.00 #x-s i-b
#10 RCYT H1'    16 RGUA H1      5.00 #x-s i-s
 11 URA H6      11 URA H3'      3.30 #intra b-s 1jwc
 11 URA H2'     12 RCYT H6      5.00 #seq b-s 1jwc
 11 URA H2'     12 RCYT H5'     5.00 #seq s-s 1jwc
 11 URA H3'     12 RCYT H6      5.00 #seq b-s 1jwc
 12 RCYT H6     12 RCYT H3'     5.00 #intra b-s 1jwc
 12 RCYT H1'    13 URA H5       3.30 #seq b-s 1jwc
 12 RCYT H1'    13 URA H6       5.00 #seq b-s 1jwc
 13 URA H6      13 URA H3'      5.00 #intra b-s 1jwc
 13 URA H1'     14 URA H1'      5.00 #seq s-s 1jwc
 13 URA H1'     15 RGUA H8      5.00 #seq b-s 1jwc
 13 URA H1'     15 RGUA H1'     5.00 #seq s-s 1jwc
 14 URA H6      14 URA H3'      5.00 #intra b-s 1jwc
 14 URA H1'     15 RGUA H8      5.00 #seq b-s 1jwc
 15 RGUA H8     15 RGUA H3'     3.30 #intra b-s
 15 RGUA H1'    16 RGUA H8      5.00 #seq b-s
 15 RGUA H2'    16 RGUA H8      2.70 #seq b-s
 15 RGUA H2'    16 RGUA H5'     3.30 #seq s-s
 15 RGUA H3'    16 RGUA H8      3.30 #seq b-s
 15 RGUA H8     16 RGUA H8      5.00 #seq b-b
#15 RGUA H1     16 RGUA H1'     5.00 #seq i-s
 15 RGUA H1     16 RGUA H1      5.00 #seq i-i CONFIRMED WEAK 5s46
 16 RGUA H8     16 RGUA H3'     3.30 #intra b-s
 16 RGUA H1'    17 RGUA H8      5.00 #seq b-s
 16 RGUA H2'    17 RGUA H8      2.70 #seq b-s
 16 RGUA H2'    17 RGUA H5'     3.30 #seq s-s
 16 RGUA H3'    17 RGUA H8      3.30 #seq b-s
 16 RGUA H8     17 RGUA H8      5.00 #seq b-b
 16 RGUA H1     17 RGUA H1'     3.30 #seq i-s CONFIRMED MED-WEAK 1jun4
 16 RGUA H22    17 RGUA H1'     3.30 #seq i-s CONFIRMED MED-WEAK 1jun4
 16 RGUA H1     17 RGUA H1      5.00 #seq i-i CONFIRMED MED-WEAK 5s46
 16 RGUA H1     51 URA H3       5.00 #x-s i-i CONFIRMED WEAK
#17 RGUA H8     17 RGUA H3'     3.30 #intra b-s 3.7 1un6
 17 RGUA H1'    18 RCYT H5      5.00 #seq b-s 4jun4 guess 18
 17 RGUA H1'    18 RCYT H6      5.00 #seq b-s 1un6
#17 RGUA H1'    18 RCYT H4'     5.00 #seq s-s 4jun4 guess 18 rm 8jul4
 17 RGUA H2'    18 RCYT H1'     5.00 #seq s-s add 8jul4
 17 RGUA H2'    18 RCYT H5      5.00 #seq b-s 1un6
 17 RGUA H2'    18 RCYT H6      2.70 #seq b-s 1un6
 17 RGUA H2'    18 RCYT H5'     2.70 #seq s-s 1un6
 17 RGUA H3'    18 RCYT H5      3.30 #seq b-s 1un6
 17 RGUA H3'    18 RCYT H6      2.70 #seq b-s 1un6
 17 RGUA H8     18 RCYT H5      5.00 #seq b-b 1un6
 17 RGUA H8     18 RCYT H6      5.00 #seq b-b 1un6
#17 RGUA H1     18 RCYT H5      5.00 #seq i-b 1un6
#17 RGUA H1     18 RCYT H1'     5.00 #seq i-s 1un6
 17 RGUA H1     50 RGUA H1      5.00 #x-s i-i CONFIRMED MED-WEAK 5s46
 17 RGUA H1     51 URA H3       2.70 #x-s i-i CONFIRMED STRONG 5s46
#17 RGUA H1     51 URA H1'      5.00 #x-s i-s
 18 RCYT H6     18 RCYT H3'     3.30 #intra b-s
 18 RCYT H1'    19 RCYT H6      5.00 #seq b-s
 18 RCYT H2'    19 RCYT H5      5.00 #seq b-s
 18 RCYT H2'    19 RCYT H6      2.70 #seq b-s
 18 RCYT H2'    19 RCYT H5'     3.30 #seq s-s
 18 RCYT H3'    19 RCYT H5      5.00 #seq b-s
 18 RCYT H3'    19 RCYT H6      3.30 #seq b-s
 18 RCYT H5     19 RCYT H5      5.00 #seq b-b
 18 RCYT H6     19 RCYT H5      5.00 #seq b-b
 18 RCYT H6     19 RCYT H6      5.00 #seq b-b
#18 RCYT H5     50 RGUA H1      5.00 #x-s i-b
#18 RCYT H1'    50 RGUA H1      5.00 #x-s i-s
#18 RCYT H2'    50 RGUA H1      5.00 #x-s i-s
 19 RCYT H6     19 RCYT H3'     3.30 #intra b-s
 19 RCYT H1'    20 URA H6       5.00 #seq b-s
 19 RCYT H2'    20 URA H5       5.00 #seq b-s
 19 RCYT H2'    20 URA H6       2.70 #seq b-s
 19 RCYT H2'    20 URA H5'      3.30 #seq s-s
 19 RCYT H3'    20 URA H5       5.00 #seq b-s
 19 RCYT H3'    20 URA H6       3.30 #seq b-s
 19 RCYT H5     20 URA H5       5.00 #seq b-b
 19 RCYT H6     20 URA H5       5.00 #seq b-b
 19 RCYT H6     20 URA H6       5.00 #seq b-b
#19 RCYT H5     49 RGUA H1      5.00 #x-s i-b
#19 RCYT H1'    49 RGUA H1      5.00 #x-s i-s
#19 RCYT H2'    49 RGUA H1      5.00 #x-s i-s
 19 RCYT H5     50 RGUA H1      5.00 #x-s i-b
 19 RCYT H1'    50 RGUA H1      5.00 #x-s i-s 30jun4
 20 URA H6      20 URA H3'      3.30 #intra b-s
 20 URA H1'     21 RGUA H8      5.00 #seq b-s
 20 URA H2'     21 RGUA H8      2.70 #seq b-s
 20 URA H2'     21 RGUA H5'     3.30 #seq s-s
 20 URA H3'     21 RGUA H8      3.30 #seq b-s
 20 URA H6      21 RGUA H8      5.00 #seq b-b
 20 URA H3      21 RGUA H8      5.00 #seq i-b
#20 URA H3      21 RGUA H1'     5.00 #seq i-s
 20 URA H3      21 RGUA H1      5.00 #seq i-i CONFIRMED
 20 URA H1'     48 RADE H2      5.00 #x-s b-s
#20 URA H2'     48 RADE H2      5.00 #x-s b-s
 20 URA H3      48 RADE H2      3.30 #x-s i-b CONFIRMED
#20 URA H3      49 RGUA H1'     5.00 #x-s i-s
 20 URA H5      49 RGUA H1      5.00 #x-s i-b
#20 URA H1'     49 RGUA H1      5.00 #x-s i-s
 20 URA H3      49 RGUA H1      5.00 #x-s i-i CONFIRMED
 21 RGUA H8     21 RGUA H3'     3.30 #intra b-s
 21 RGUA H1'    22 RGUA H8      5.00 #seq b-s
 21 RGUA H2'    22 RGUA H8      2.70 #seq b-s
 21 RGUA H2'    22 RGUA H5'     3.30 #seq s-s
 21 RGUA H3'    22 RGUA H8      3.30 #seq b-s
 21 RGUA H8     22 RGUA H8      5.00 #seq b-b
#21 RGUA H1     22 RGUA H1'     5.00 #seq i-s
 21 RGUA H1     22 RGUA H1      5.00 #seq i-i CONFIRMED
 21 RGUA H1'    48 RADE H2      5.00 #x-s b-s
#21 RGUA H8     48 RADE H2      5.00 #x-s b-b
#21 RGUA H1     47 RCYT H5      5.00 #x-s i-b
#21 RGUA H1     47 RCYT H1'     5.00 #x-s i-s
#21 RGUA H1     47 RCYT H2'     5.00 #x-s i-s
 21 RGUA H1     48 RADE H8      5.00 #x-s i-b
 21 RGUA H1     48 RADE H2      5.00 #x-s i-b CONFIRMED
#21 RGUA H8     48 RADE H2      5.00 #x-s i-b
#21 RGUA H1     48 RADE H1'     5.00 #x-s i-s
 22 RGUA H8     22 RGUA H3'     3.30 #intra b-s
 22 RGUA H1'    23 URA H6       5.00 #seq b-s
 22 RGUA H2'    23 URA H6       2.70 #seq b-s
 22 RGUA H2'    23 URA H5       5.00 #seq b-s
 22 RGUA H2'    23 URA H5'      5.00 #seq s-s rlx 6jul4
 22 RGUA H3'    23 URA H6       3.30 #seq b-s
 22 RGUA H3'    23 URA H5       5.00 #seq b-s
 22 RGUA H8     23 URA H5       5.00 #seq b-b
 22 RGUA H8     23 URA H6       5.00 #seq b-b
 22 RGUA H1     23 URA H3       5.00 #seq i-i CONFIRMED
 22 RGUA H1     45 RADE H2      5.00 #x-s i-b 5.16 CONFIRMED
 22 RGUA H1     47 RCYT H5      5.00 #x-s i-b
#22 RGUA H1     47 RCYT H1'     5.00 #x-s i-s
 23 URA H6      23 URA H3'      3.30 #intra b-s
 23 URA H1'     24 URA H6       5.00 #seq b-s rm 22jul02
 23 URA H2'     24 URA H6       2.70 #seq b-s rm 22jul02
 23 URA H2'     24 URA H5       5.00 #seq b-s rm 22jul02
 23 URA H2'     24 URA H5'      3.30 #seq s-s rm 22jul02
 23 URA H3'     24 URA H6       3.30 #seq b-s rm 22jul02
 23 URA H3'     24 URA H5       5.00 #seq b-s rm 22jul02
#23 URA H5      24 URA H5       5.00 #seq b-b rm 22jul02
#23 URA H6      24 URA H5       5.00 #seq b-b rm 22jul02
#23 URA H6      24 URA H6       5.00 #seq b-b rm 22jul02
 23 URA H3      24 URA H5       5.00 #seq i-b rm 22jul02
 23 URA H3      24 URA H6       5.00 #seq i-b rm 22jul02
 23 URA H3      24 URA H3       5.00 #seq i-i CONFIRMED
 23 URA H3      45 RADE H2      3.30 #x-s i-b CONFIRMED
 24 URA H6      24 URA H1'      5.00 #intra b-s weak 22jul02
 24 URA H6      24 URA H2'      5.00 #intra b-s weak 22jul02 MEDIUM-WEAK
 24 URA H1'     25 RADE H8      5.50 #seq b-s 430D 5.33 CONFIRMED WEAK-MEDIUM rlx 18sep3
 24 URA H2'     25 RADE H8      2.70 #seq b-s 430D 2.70 CONFIRMED
#24 URA H2'     25 RADE H5'     5.00 #seq s-s 430D 5.38 rm 22jul02
 24 URA H3'     25 RADE H8      3.30 #seq b-s 430D 2.80 CONFIRMED
 24 URA H3'     25 RADE H3'     5.00 #seq s-s 430D 2.28 rm 22jul02 loosen 483D 3.91
 24 URA H6      25 RADE H2'     3.30 #seq b-s 430D 2.86 CONFIRMED
 24 URA H6      25 RADE H3'     5.00 #seq b-s 430D 4.94 rm 22jul02 rm 3dec3
#24 URA H5      25 RADE H2      5.00 #seq b-b 430D 4.61 rm 22jul02
 24 URA H5      25 RADE H8      5.00 #seq b-b 430D 4.70 CONFIRMED
 24 URA H6      25 RADE H8      5.00 #seq b-b 430D 3.97 CONFIRMED
#24 URA H3      25 RADE H2      5.00 #seq i-b SPIN-DIFFUSION?
 24 URA H3      25 RADE H8      5.00 #seq i-b WEAK-MEDIUM CONFIRMED may overlap 45.h8
 24 URA H1'     45 RADE H2      3.30 #x-s b-s MEDIUM-STRONG
#24 URA H5      45 RADE H2      5.00 #x-s b-b rm 22jul02
 24 URA H6      45 RADE H2      5.00 #x-s VERY WEAK
 24 URA H3      45 RADE H2      5.00 #x-s i-b WEAK-MEDIUM CONFIRMED 
#24 URA H3      45 RADE H8      5.00 #x-s i-b rm 22jul02
 24 URA H3      44 URA H3       2.70 #x-s i-i CONFIRMED
#24 URA H3      43 RADE H2      5.00 #x-s i-b rm 22jul02
 24 URA H3      43 RADE H8      5.50 #x-s i-b WEAK-MEDIUM CONFIRMED rlx 18sep3
 25 RADE H8     25 RADE H1'     5.00 #intra b-s 430D 3.84 CONFIRMED
 25 RADE H8     25 RADE H2'     3.30 #intra b-s 430D 2.86 CONFIRMED
 25 RADE H8     25 RADE H3'     5.00 #intra b-s 430D 4.85
#25 RADE H2     26 RGUA H1'     6.00 #seq b-s 430D 5.84
 25 RADE H1'    26 RGUA H8      7.00 #seq b-s 430D 6.70 VERY WEAK
 25 RADE H1'    26 RGUA H4'     3.30 #seq s-s 430D 3.24
#25 RADE H2'    26 RGUA H5'     5.00 #seq s-s 430D 4.83
 25 RADE H4'    26 RGUA H4'     2.70 #seq s-s 430D 2.60
 25 RADE H2     26 RGUA H1      5.00 #seq i-b 430D 4.33 CONFIRMED STRONG? med 12dec3 rlx 30jan4
 25 RADE H8     27 URA H1'      5.00 #seq b-s 430D 3.50 CONFIRMED
 25 RADE H1'    27 URA H5       3.30 #seq b-s 430D 3.31 CONFIRMED
 25 RADE H1'    27 URA H6       5.00 #seq b-s 430D 3.67 CONFIRMED
 25 RADE H1'    27 URA H3       5.00 #seq i-s 430D 5.01
 25 RADE H4'    27 URA H5       5.00 #seq b-s 430D 4.61
 25 RADE H4'    27 URA H6       3.30 #seq b-s 430D 2.93
 25 RADE H4'    27 URA H5'      3.30 #seq s-s 430D 3.09
 25 RADE H5'    27 URA H6       5.00 #seq b-s 430D 3.89
 25 RADE H5'    27 URA H1'      2.70 #seq s-s 430D 1.90
 25 RADE H5"    27 URA H6       5.00 #seq b-s 430D 4.72
 25 RADE H2     27 URA H3       6.00 #seq i-b 430D 5.62 WEAK
 25 RADE H8     27 URA H3       5.00 #seq i-b 430D 4.24 CONFIRMED 
 25 RADE H2     27 URA H5       5.00 #seq b-b 430D 5.30 WEAK-MED
#25 RADE H8     27 URA H5       5.00 #seq b-b 430D 5.72
 25 RADE H8     27 URA H6       6.00 #seq b-b 430D 5.16 WEAK
 25 RADE H2     41 RGUA H2'     6.00 #x-s b-s 430D 5.07 relaxed 7nov3
#25 RADE H2     42 RADE H3'     5.00 #x-s b-s 430D 5.46
 25 RADE H2     42 RADE H5'     5.00 #x-s b-s 430D 4.21
 25 RADE H2     42 RADE H5"     5.00 #x-s b-s 430D 3.39
 25 RADE H2     42 RADE H8      5.00 #x-s b-b 430D 4.59 CONFIRMED
#25 RADE H2     44 URA H3       5.00 #x-s i-b
 25 RADE H8     44 URA H3       7.00 #x-s i-b VERY WEAK may overlap 45.h8
 26 RGUA H8     26 RGUA H1'     5.00 #intra b-s 430D 3.80 CONFIRMED
 26 RGUA H8     26 RGUA H2'     2.70 #intra b-s 430D 2.26 CONFIRMED remove 2dec3
 26 RGUA H8     26 RGUA H3'     5.00 #intra b-s 430D 4.64 CONFIRMED tighten 24nov3 rlx 9dec3
 26 RGUA H1'    27 URA H5       2.70 #seq b-s 430D 2.00 OVERLAP
 26 RGUA H1'    27 URA H6       5.00 #seq b-s 430D 3.56 CONFIRMED
 26 RGUA H2'    27 URA H5       5.00 #seq b-s 430D 4.94 CONFIRMED
#26 RGUA H2'    27 URA H5'      5.00 #seq s-s 430D 5.46
 26 RGUA H3'    27 URA H5       5.00 #seq b-s 430D 4.79 CONFIRMED
#26 RGUA H3'    27 URA H5'      3.30 #seq s-s 430D 3.27 rm 3dec3
 26 RGUA H4'    27 URA H5       5.00 #seq b-s 430D 3.60
 26 RGUA H4'    27 URA H6       3.30 #seq b-s 430D 3.02
 26 RGUA H4'    27 URA H5'      3.30 #seq s-s 430D 3.26
#26 RGUA H1     27 URA H5       7.00 #seq i-b 430D 6.24
 26 RGUA H1     41 RGUA H8      5.00 #x-s i-b 430D 3.73 CONFIRMED rlx 12dec3
 26 RGUA H8     41 RGUA H1      5.00 #x-s i-b 430D 5.08
 26 RGUA H1     41 RGUA H2'     5.00 #x-s i-s 430D 3.46
 26 RGUA H1     41 RGUA H3'     2.70 #x-s i-s 430D 2.70
 26 RGUA H1'    41 RGUA H1      3.30 #x-s i-s 430D 2.79 CONFIRMED
 26 RGUA H2'    41 RGUA H1      5.00 #x-s i-s 430D 4.22
 26 RGUA H3'    41 RGUA H1      5.00 #x-s i-s 430D 4.64
#26 RGUA H1     41 RGUA H1      5.00 #x-s i-i 430D 6.60
 26 RGUA H1     42 RADE H8      5.00 #x-s i-b new 26nov3
 27 URA H6      27 URA H1'      5.00 #intra b-s 430D 3.45 CONFIRMED
 27 URA H6      27 URA H3'      3.30 #intra b-s 430D 3.15
 27 URA H1'     28 RADE H8      5.00 #seq b-s 430D 4.11
 27 URA H2'     28 RADE H8      2.70 #seq b-s 430D 1.63
 27 URA H2'     28 RADE H5'     2.70 #seq s-s 430D 2.68
 27 URA H3'     28 RADE H8      2.70 #seq b-s 430D 2.67
 27 URA H3'     29 RCYT H5      5.00 #seq b-s 430D 4.58
#27 URA H4'     28 RADE H8      5.00 #seq b-s 430D 5.06 bad orientation
 27 URA H6      28 RADE H8      5.00 #seq b-b 430D 4.57
#27 URA H3      28 RADE H2      5.00 #seq i-b 430D 6.28 VERY WEAK
 27 URA H3      28 RADE H8      5.00 #seq i-b 430D 4.01 CONFIRMED
 27 URA H3      28 RADE H1'     5.00 #seq i-s 430D 4.98
#27 URA H3      43 RADE H2      5.00 #x-s i-b 430D 7.46
#27 URA H3      43 RADE H8      6.00 #x-s i-b 430D 5.43 
 27 URA H3      42 RADE H8      3.30 #x-s i-b 430D 2.91 Reverse Hoogsteen CONFIRMED
 27 URA H3      42 RADE H1'     6.00 #x-s i-s 430D 5.90 WEAK-MEDIUM S.D.?
 27 URA H5      41 RGUA H1      5.00 #x-s i-b 430D 3.45 CONFIRMED
 27 URA H6      41 RGUA H1      5.00 #x-s i-b 430D 4.64 CONFIRMED
#27 URA H3      41 RGUA H1      5.00 #x-s i-i 430D 6.80 ???
 28 RADE H8     28 RADE H3'     3.30 #intra b-s 430D 3.37
 28 RADE H2     29 RCYT H1'     2.70 #seq b-s 430D 2.23 CONFIRMED
 28 RADE H2     29 RCYT H2'     5.00 #seq b-s 430D 4.97
 28 RADE H2     29 RCYT H4'     5.00 #seq b-s 430D 4.71
 28 RADE H1'    29 RCYT H6      5.00 #seq b-s 430D 4.89
 28 RADE H2'    29 RCYT H5      5.00 #seq b-s 430D 4.50
 28 RADE H2'    29 RCYT H6      2.70 #seq b-s 430D 2.43
 28 RADE H2'    29 RCYT H5'     2.70 #seq s-s 430D 2.06
 28 RADE H3'    29 RCYT H5      3.30 #seq b-s 430D 3.23
 28 RADE H3'    29 RCYT H6      2.70 #seq b-s 430D 2.33
 28 RADE H3'    29 RCYT H5'     5.00 #seq s-s 430D 3.29 loosen 483D 3.78
#28 RADE H2     29 RCYT H6      5.00 #seq b-b 430D 5.17
 28 RADE H8     29 RCYT H5      5.00 #seq b-b 430D 4.26
 28 RADE H8     29 RCYT H6      5.00 #seq b-b 430D 4.59
#28 RADE H2     40 RGUA H1      5.00 #x-s i-b 430D 6.07
#28 RADE H8     40 RGUA H1      5.00 #x-s i-b 430D 7.03
#28 RADE H2     41 RGUA H1      5.00 #x-s i-b 430D 9.54
 28 RADE H8     41 RGUA H1      7.00 #x-s i-b 430D 6.65 VERY WEAK
 28 RADE H2     42 RADE H1'     5.00 #x-s b-s 430D 4.16 CONFIRMED
 28 RADE H1'    42 RADE H2      5.00 #x-s b-s 430D 4.59
#28 RADE H1'    43 RADE H2      5.00 #x-s b-s 430D 5.40
 28 RADE H2     42 RADE H2      5.00 #x-s b-b 430D 4.06 CONFIRMED
#28 RADE H2     43 RADE H2      5.00 #x-s b-b 430D 8.16
 29 RCYT H6     29 RCYT H3'     3.30 #intra b-s
 29 RCYT H1'    30 RCYT H6      5.00 #seq b-s
 29 RCYT H2'    30 RCYT H5      5.00 #seq b-s
 29 RCYT H2'    30 RCYT H6      2.70 #seq b-s
 29 RCYT H2'    30 RCYT H5'     3.30 #seq s-s
 29 RCYT H3'    30 RCYT H5      5.00 #seq b-s
 29 RCYT H3'    30 RCYT H6      3.30 #seq b-s
 29 RCYT H5     30 RCYT H5      5.00 #seq b-b
 29 RCYT H6     30 RCYT H5      5.00 #seq b-b
 29 RCYT H6     30 RCYT H6      5.00 #seq b-b
#29 RCYT H5     40 RGUA H1      5.00 #x-s i-b 430D 5.08
#29 RCYT H6     40 RGUA H1      5.00 #x-s i-b 430D 5.78
#29 RCYT H1'    40 RGUA H1      5.00 #x-s i-s
#29 RCYT H2'    40 RGUA H1      5.00 #x-s i-s
#29 RCYT H5     41 RGUA H1      5.00 #x-s i-b 430D 6.6
 30 RCYT H6     30 RCYT H3'     3.30 #intra b-s
#30 RCYT H1'    31 URA H6       5.00 #seq b-s rm 22jul02
#30 RCYT H2'    31 URA H5       5.00 #seq b-s rm 22jul02
#30 RCYT H2'    31 URA H6       2.70 #seq b-s rm 22jul02
#30 RCYT H2'    31 URA H5'      3.30 #seq s-s rm 22jul02
#30 RCYT H3'    31 URA H5       5.00 #seq b-s rm 22jul02
#30 RCYT H3'    31 URA H6       3.30 #seq b-s rm 22jul02
#30 RCYT H5     31 URA H5       5.00 #seq b-b rm 22jul02
#30 RCYT H6     31 URA H5       5.00 #seq b-b rm 22jul02
#30 RCYT H6     31 URA H6       5.00 #seq b-b rm 22jul02
#30 RCYT H5     39 RGUA H1      5.00 #x-s i-b rm 22jul02
#30 RCYT H1'    39 RGUA H1      5.00 #x-s i-s rm 22jul02
#30 RCYT H2'    39 RGUA H1      5.00 #x-s i-s rm 22jul02
 30 RCYT H5     40 RGUA H1      5.00 #x-s i-b
#30 RCYT H1'    40 RGUA H1      5.00 #x-s i-s
 31 URA H6      31 URA H3'      5.00 #intra b-s weak 22jul02
#31 URA H1'     32 RCYT H6      5.00 #seq b-s rm 22jul02
#31 URA H2'     32 RCYT H6      2.70 #seq b-s rm 22jul02
#31 URA H2'     32 RCYT H5'     3.30 #seq s-s rm 22jul02
#31 URA H3'     32 RCYT H6      3.30 #seq b-s rm 22jul02
#31 URA H6      32 RCYT H6      5.00 #seq b-b rm 22jul02
#31 URA H3      32 RCYT H6      5.00 #seq i-b rm 22jul02
 31 URA H3      38 URA H3       2.70 #x-s i-i
#31 URA H3      39 RGUA H1      5.00 #x-s i-i rm 22jul02
#31 URA H5      39 RGUA H1      5.00 #x-s i-b rm 22jul02
 32 RCYT H6     32 RCYT H3'     3.30 #intra b-s
 37 RGUA H8     37 RGUA H3'     3.30 #intra b-s
#37 RGUA H1'    38 URA H6       5.00 #seq b-s
#37 RGUA H2'    38 URA H5       5.00 #seq b-s
#37 RGUA H2'    38 URA H6       2.70 #seq b-s
#37 RGUA H2'    38 URA H5'      3.30 #seq s-s
#37 RGUA H3'    38 URA H5       5.00 #seq b-s
#37 RGUA H3'    38 URA H6       3.30 #seq b-s
#37 RGUA H8     38 URA H5       5.00 #seq b-b
#37 RGUA H8     38 URA H6       5.00 #seq b-b
 38 URA H6      38 URA H3'      5.00 #intra b-s weak 22jul02
#38 URA H1'     39 RGUA H8      5.00 #seq b-s
#38 URA H2'     39 RGUA H8      2.70 #seq b-s
#38 URA H2'     39 RGUA H5'     3.30 #seq s-s
#38 URA H3'     39 RGUA H8      3.30 #seq b-s
#38 URA H6      39 RGUA H8      5.00 #seq b-b
#38 URA H3      39 RGUA H8      5.00 #seq i-b
#38 URA H3      39 RGUA H1      5.00 #seq i-i
 39 RGUA H8     39 RGUA H3'     3.30 #intra b-s
 39 RGUA H1'    40 RGUA H8      5.00 #seq b-s
 39 RGUA H2'    40 RGUA H8      2.70 #seq b-s
 39 RGUA H2'    40 RGUA H5'     3.30 #seq s-s
 39 RGUA H3'    40 RGUA H8      3.30 #seq b-s
 39 RGUA H8     40 RGUA H8      5.00 #seq b-b
#39 RGUA H1     40 RGUA H1'     5.00 #seq i-s
 39 RGUA H1     40 RGUA H1      5.00 #seq i-i
 40 RGUA H8     40 RGUA H3'     3.30 #intra b-s
 40 RGUA H1'    41 RGUA H8      5.00 #seq b-s 430D 5.05 ovlp rm 9dec3 add 7jul4
 40 RGUA H2'    41 RGUA H8      3.30 #seq b-s 430D 2.75 rlx 27aug4
 40 RGUA H2'    41 RGUA H5'     3.30 #seq s-s 430D 2.16
 40 RGUA H3'    41 RGUA H8      2.70 #seq b-s 430D 2.26
#40 RGUA H4'    41 RGUA H8      5.00 #seq b-s 430D 5.18
 40 RGUA H5'    41 RGUA H8      6.00 #seq b-s 430D 4.90 483D 5.03 loosen 3nov3
 40 RGUA H5"    41 RGUA H8      5.00 #seq b-s 430D 4.44 483D 4.42
#40 RGUA H8     41 RGUA H1'     5.00 #seq b-s new 9dec3 rlx 30jan4 rm 7jul4
 40 RGUA H8     41 RGUA H8      5.00 #seq b-b 430D 4.47 rm 12dec3 add 7jul4 rlx 27aug4
 40 RGUA H1     41 RGUA H1'     3.30 #seq i-s 430D 3.15
#40 RGUA H1     41 RGUA H1      5.00 #seq i-i 430D 5.35
#40 RGUA H1     41 RGUA H8      5.00 #seq i-b 430D 5.81
#40 RGUA H8     41 RGUA H1      5.00 #seq i-b 430D 7.13
 41 RGUA H8     41 RGUA H3'     3.30 #intra b-s 430D 2.46
 41 RGUA H1'    42 RADE H8      5.50 #seq b-s 430D 5.10
 41 RGUA H2'    42 RADE H8      5.00 #seq b-s 430D 3.42
 41 RGUA H2'    42 RADE H5"     5.00 #seq s-s 430D 4.42
#41 RGUA H3'    42 RADE H8      5.00 #seq b-s 430D 5.55
#41 RGUA H1     42 RADE H2      5.00 #seq i-b 430D 12.2
#41 RGUA H1     42 RADE H8      5.00 #seq i-b 430D 7.2
 42 RADE H8     42 RADE H3'     5.00 #intra b-s 430D 3.57
 42 RADE H2     42 RADE H1'     5.00 #intra b-s 430D 4.95
 42 RADE H2     43 RADE H1'     3.30 #seq b-s 430D 2.96 CONFIRMED
 42 RADE H1'    43 RADE H8      5.00 #seq b-s 430D 4.00 CONFIRMED
 42 RADE H2'    43 RADE H8      2.70 #seq b-s 430D 1.56
 42 RADE H2'    43 RADE H1'     3.30 #seq s-s 430D 3.13
 42 RADE H2'    43 RADE H5'     3.30 #seq s-s 430D 3.09
 42 RADE H3'    43 RADE H8      2.70 #seq b-s 430D 1.73
 42 RADE H4'    43 RADE H8      5.00 #seq b-s 430D 4.33
 42 RADE H5'    43 RADE H8      5.00 #seq b-s 430D 4.80
 42 RADE H5"    43 RADE H8      5.00 #seq b-s 430D 3.86
 42 RADE H2     43 RADE H2      5.00 #seq b-b 430D 4.64 CONFIRMED
 42 RADE H2     43 RADE H8      5.00 #seq b-b 430D 5.03 CONFIRMED
 42 RADE H8     43 RADE H8      5.00 #seq b-b 430D 4.13 CONFIRMED
 43 RADE H8     43 RADE H3'     5.00 #intra b-s 430D 3.56
 43 RADE H2     44 URA H1'      5.00 #seq b-s 430D 4.16 overlap
#43 RADE H1'    44 URA H5       5.00 #seq b-s 430D 4.27 removed 22jul02
#43 RADE H1'    44 URA H6       5.00 #seq b-s 430D 4.13 removed 22jul02
 43 RADE H2'    44 URA H5       5.00 #seq b-s 430D 2.42 removed 22jul02
 43 RADE H2'    44 URA H6       2.70 #seq b-s 430D 1.33 removed 22jul02
 43 RADE H2'    44 URA H5'      5.00 #seq s-s 430D 3.43 removed 22jul02
 43 RADE H3'    44 URA H5       3.30 #seq b-s 430D 2.67 removed 22jul02
 43 RADE H3'    44 URA H6       2.70 #seq b-s 430D 2.80 removed 22jul02
#43 RADE H4'    44 URA H6       5.00 #seq b-s 430D 4.72 removed 22jul02
#43 RADE H2     44 URA H5       5.00 #seq b-b 430D 4.75 removed 22jul02
#43 RADE H2     44 URA H6       5.00 #seq b-b 430D 4.64 removed 22jul02
 43 RADE H2     44 URA H3       6.00 #seq i-b VERY WEAK
 43 RADE H8     44 URA H5       5.00 #seq b-b 430D 3.48 removed 22jul02
#43 RADE H8     44 URA H6       5.00 #seq b-b 430D 5.17
 44 URA H6      44 URA H3'      5.00 #intra b-s weak 22jul02
#44 URA H1'     45 RADE H8      5.00 #seq b-s removed 22jul02
 44 URA H2'     45 RADE H8      2.70 #seq b-s removed 22jul02
 44 URA H2'     45 RADE H5'     3.30 #seq s-s removed 22jul02
 44 URA H3'     45 RADE H8      3.30 #seq b-s removed 22jul02
#44 URA H6      45 RADE H8      5.00 #seq b-b removed 22jul02
 44 URA H3      45 RADE H1'     5.00 #seq i-b maybe
#44 URA H3      45 RADE H8      5.00 #seq i-b removed 22jul02 may overlap 25.h8
 44 URA H3      45 RADE H2      5.00 #seq i-b WEAK
 45 RADE H8     45 RADE H3'     3.30 #intra b-s
 45 RADE H2     46 RCYT H1'     5.00 #seq b-s CONFIRMED
 45 RADE H1'    46 RCYT H6      5.00 #seq b-s
 45 RADE H2'    46 RCYT H5      5.00 #seq b-s
 45 RADE H2'    46 RCYT H6      2.70 #seq b-s
 45 RADE H2'    46 RCYT H5'     3.30 #seq s-s
 45 RADE H3'    46 RCYT H5      5.00 #seq b-s
 45 RADE H3'    46 RCYT H6      3.30 #seq b-s
 45 RADE H8     46 RCYT H5      5.00 #seq b-b
 45 RADE H8     46 RCYT H6      5.00 #seq b-b
#45 RADE H1     46 RCYT H5      5.00 #seq i-b
#45 RADE H1     46 RCYT H1'     5.00 #seq i-s
 46 RCYT H6     46 RCYT H3'     5.00 #intra b-s
 46 RCYT H1'    47 RCYT H6      5.00 #seq b-s
 46 RCYT H2'    47 RCYT H5      5.00 #seq b-s
 46 RCYT H2'    47 RCYT H6      2.70 #seq b-s
 46 RCYT H2'    47 RCYT H5'     3.30 #seq s-s
 46 RCYT H3'    47 RCYT H5      5.00 #seq b-s
 46 RCYT H3'    47 RCYT H6      3.30 #seq b-s
 46 RCYT H5     47 RCYT H5      5.00 #seq b-b
 46 RCYT H6     47 RCYT H5      5.00 #seq b-b
 46 RCYT H6     47 RCYT H6      5.00 #seq b-b
 47 RCYT H6     47 RCYT H3'     3.30 #intra b-s
 47 RCYT H1'    48 RADE H8      5.00 #seq b-s
 47 RCYT H2'    48 RADE H8      2.70 #seq b-s
 47 RCYT H2'    48 RADE H5'     3.30 #seq s-s
 47 RCYT H3'    48 RADE H8      3.30 #seq b-s
 47 RCYT H6     48 RADE H8      5.00 #seq b-b
 48 RADE H8     48 RADE H3'     3.30 #intra b-s
 48 RADE H2     49 RGUA H1'     5.00 #seq b-s
 48 RADE H1'    49 RGUA H8      5.00 #seq b-s
 48 RADE H2'    49 RGUA H8      2.70 #seq b-s
 48 RADE H2'    49 RGUA H5'     3.30 #seq s-s
 48 RADE H3'    49 RGUA H8      3.30 #seq b-s
 48 RADE H2     49 RGUA H8      5.00 #seq b-b
 48 RADE H8     49 RGUA H8      5.00 #seq b-b
 48 RADE H2     49 RGUA H1      6.00 #seq i-b WEAK 5.63
 49 RGUA H8     49 RGUA H3'     3.30 #intra b-s
 49 RGUA H1'    50 RGUA H8      5.00 #seq b-s
 49 RGUA H2'    50 RGUA H8      2.70 #seq b-s
 49 RGUA H2'    50 RGUA H5'     3.30 #seq s-s
 49 RGUA H3'    50 RGUA H8      3.30 #seq b-s
 49 RGUA H8     50 RGUA H8      5.00 #seq b-b
#49 RGUA H1     50 RGUA H1'     5.00 #seq i-s
 49 RGUA H1     50 RGUA H1      5.00 #seq i-i
 50 RGUA H8     50 RGUA H3'     3.30 #intra b-s 1un6
 50 RGUA H1'    51 URA H6       5.00 #seq b-s 1un6
 50 RGUA H2'    51 URA H5       5.00 #seq b-s 1un6
 50 RGUA H2'    51 URA H6       2.70 #seq b-s 1un6
 50 RGUA H2'    51 URA H5'      3.30 #seq s-s 1un6
 50 RGUA H3'    51 URA H5       5.00 #seq b-s 1un6
 50 RGUA H3'    51 URA H6       3.30 #seq b-s 1un6
 50 RGUA H8     51 URA H5       5.00 #seq b-b 1un6
 50 RGUA H1     51 URA H3       3.30 #seq i-i CONFIRMED MED-STRONG 19sep3
 51 URA H6      51 URA H2'      3.30 #intra b-s 1un6
 52 RGUA H8     52 RGUA H3'     3.30 #intra b-s
 52 RGUA H1'    53 RCYT H6      5.00 #seq b-s
 52 RGUA H2'    53 RCYT H5      5.00 #seq b-s
 52 RGUA H2'    53 RCYT H6      2.70 #seq b-s
 52 RGUA H2'    53 RCYT H5'     3.30 #seq s-s
 52 RGUA H3'    53 RCYT H5      5.00 #seq b-s
 52 RGUA H3'    53 RCYT H6      3.30 #seq b-s
 52 RGUA H8     53 RCYT H5      5.00 #seq b-b
#52 RGUA H1     53 RCYT H5      5.00 #seq i-b
#52 RGUA H1     53 RCYT H1'     5.00 #seq i-s
 53 RCYT H6     53 RCYT H3'     3.30 #intra b-s
 53 RCYT H1'    54 RCYT H6      5.00 #seq b-s
 53 RCYT H2'    54 RCYT H5      5.00 #seq b-s
 53 RCYT H2'    54 RCYT H6      2.70 #seq b-s
 53 RCYT H2'    54 RCYT H5'     3.30 #seq s-s
 53 RCYT H3'    54 RCYT H5      5.00 #seq b-s
 53 RCYT H3'    54 RCYT H6      3.30 #seq b-s
 53 RCYT H5     54 RCYT H5      5.00 #seq b-b
 53 RCYT H6     54 RCYT H5      5.00 #seq b-b
 53 RCYT H6     54 RCYT H6      5.00 #seq b-b
 54 RCYT H6     54 RCYT H3'     3.30 #intra b-s
 54 RCYT H1'    55 RCYT H6      5.00 #seq b-s
 54 RCYT H2'    55 RCYT H5      5.00 #seq b-s
 54 RCYT H2'    55 RCYT H6      2.70 #seq b-s
 54 RCYT H2'    55 RCYT H5'     3.30 #seq s-s
 54 RCYT H3'    55 RCYT H5      5.00 #seq b-s
 54 RCYT H3'    55 RCYT H6      3.30 #seq b-s
 54 RCYT H5     55 RCYT H5      5.00 #seq b-b
 54 RCYT H6     55 RCYT H5      5.00 #seq b-b
 54 RCYT H6     55 RCYT H6      5.00 #seq b-b

 






# TFIIIA zf46 17 Jul 01 BL
# NOEs:		2.7	3.3	5.0
# CROSS-SHEET HN(i)->HN(j): 3.5
# ALPHA HELIX HN(i)->HN(i+1): 3.0
# ALPHA HELIX Ha(i)->HN(i+3): 5.0 ?->4.0
# H-BONDS HN->O: 2.0 N->O: 3.0
#========================================
# Stereospecific Assignments
#========================================
#105 TYR HB2 <-> HB3  flipped in upl file CONFIRMED
#106 VAL QG1 <-> QG2  flipped in upl file CONFIRMED
#107 CYSZ HB2 <-> HB3 flipped in upl file CONFIRMED
#112 CYS- HB2 <-> HB3 flipped in upl file HB2=HB3->QB
#113 GLY HA2 == HA2                       CONFIRMED partially due to overlap
#116 PHE HB2 <-> HB3  flipped in upl file ASSUMED but unconfirmed
#122 LEU QD1 <-> QD2  flipped in upl file CONFIRMED
#122 LEU HB2 <-> HB3  flipped in upl file ASSUMED not confirmed
#124 VAL QG1 <-> QG2  flipped in upl file CONFIRMED
#125 HIS HB2 == HB2                       CONFIRMED this is flipped from free
#126 GLN HE21 == HE21                     CONFIRMED
#129 HIS HB2 == HB2                       CONFIRMED
#135 TYR HB2 <-> HB3  flipped in upl file
#137 CYSZ HB2 <-> HB3 flipped in upl file
#142 CYS- HB2 <-> HB3 flipped in upl file
#146 PHE HB2 <-> HB3  flipped in upl file
#149 PRO HG3 == HG3
#149 PRO HD3 == HD3
#152 LEU HB2 <-> HB3  flipped in upl file 
#152 LEU QD1 <-> QD2  flipped in upl file ASSUMED but unconfirmed
#158 VAL QG1 <-> QG2 PROBABLY flipped according to structures
#161 GLY HA2 <-> HA3 PROBABLY flipped according to structures
#162 TYR HB2 <-> HB3  flipped in upl file
#172 PHE HB2 == HB2
#173 VAL QG1 == QG1
#177 TRP HB2 <-> HB3  flipped in upl file ASSUMED but unconfirmed
#181 LEU HB2 == HB2
#181 LEU QD1 == QD1
#183 HIS HB2 <-> HB3  flipped in upl file
#========================================
# ZINC FINGER 4
#----------------------------------------
# Beta Sheet 
#  >-Y105-V106-C107->
#  <-F116-A115-K114-<
#------------------------------anti--para
#--Ha(i)->HN(i+1)--------------2.20--2.20
 104 MET HA     105 TYR HN     2.70  #STRONG mobilty?
 105 TYR HA     106 VAL HN     2.70  #CONFIRMED
 106 VAL HA     107 CYSZ HN    2.70  #CONFIRMED
 107 CYSZ HA    108 HIS HN     2.70  #CONFIRMED
#113 GLY QA     114 LYS+ HN    2.70  #WEAK
 114 LYS+ HA    115 ALA HN     2.70  #CONFIRMED
 115 ALA HA     116 PHE HN     2.70  #CONFIRMED
 116 PHE HA     117 LYS+ HN    2.70  #CONFIRMED
#--Ha(i)->Ha(j)--cross-sheet---2.30--4.80
 104 MET HA     117 LYS+ HA    3.30  #MEDIUM
 106 VAL HA     115 ALA HA     2.70  #CONFIRMED
#108 HIS HA     113 GLY QA     2.70  #N.O.
#--Ha(i)->HN(j+1)--cross-sheet-3.20--3.00
 106 VAL HA     116 PHE HN     3.30  #CONFIRMED
#108 HIS HA     114 LYS+ HN    3.30  #N.O.
 115 ALA HA     107 CYSZ HN    3.30  #CONFIRMED
 117 LYS+ HA    105 TYR HN     5.00  #CONFIRMED relax 8nov3
#--Ha(i)->HN(j-1)--cross-sheet-
#106 VAL HA     114 LYS+ HN    5.00  #OVERLAP 112.ha
#113 GLY QA     107 CYSZ HN    5.00  #N.O.
 115 ALA HA     105 TYR HN     5.00  #CONFIRMED
#--HN(i)->HN(j)--cross-sheet---3.30--4.00
 105 TYR HN     116 PHE HN     3.50  #CONFIRMED
 107 CYSZ HN    114 LYS+ HN    5.00  #MEDIUM-WEAK LOOSEN for 114.hn-112.sg bond
#****************************************
#--HBONDS--cross-sheet
#****************************************
 105 TYR HN     116 PHE O      2.00  #NEW IN 5S46
 105 TYR N      116 PHE O      3.00
 107 CYSZ HN    114 LYS+ O     2.00  
 107 CYSZ N     114 LYS+ O     3.00  
#114 LYS+ HN    107 CYSZ O     2.00  
#114 LYS+ N     107 CYSZ O     3.00
 116 PHE HN     105 TYR O      2.00  
 116 PHE N      105 TYR O      3.00
#----------------------------------------
# Alpha Helix
#  >-K118--L122--Q126--T130->
#      H119--K123--F127   
#        N120--V124--S128
#          Q121--H125--H129
#                    Zn
#------------------------------alph--3-10
#--HN(i)->HN(i+1)--------------2.80--2.60
 119 HIS HN     120 ASN HN     3.00  #MEDIUM-STRONG
 120 ASN HN     121 GLN HN     3.00  #MEDIUM
 121 GLN HN     122 LEU HN     3.00  #MEDIUM MNS
 122 LEU HN     123 LYS+ HN    3.00  #CONFIRMED
#123 LYS+ HN    124 VAL HN     3.00  #124.hn too weak MNS
 124 VAL HN     125 HIS HN     3.00  #CONFIRMED
 125 HIS HN     126 GLN HN     3.00  #CONFIRMED
 126 GLN HN     127 PHE HN     3.00  #CONFIRMED
 127 PHE HN     128 SER HN     3.00  #CONFIRMED
 128 SER HN     129 HIS HN     3.00  #CONFIRMED
 129 HIS HN     130 THR HN     3.00  #CONFIRMED
 130 THR HN     131 GLN HN     3.00  #CONFIRMED
#--HN(i)->HN(i+2)--------------4.20--4.10
 119 HIS HN     121 GLN HN     5.00  #CONFIRMED WEAK
 120 ASN HN     122 LEU HN     5.00  #CONFIRMED
 121 GLN HN     123 LYS+ HN    5.00  #CONFIRMED
 122 LEU HN     124 VAL HN     5.00  #CONFIRMED
 123 LYS+ HN    125 HIS HN     5.00  #WEAK MNS
 124 VAL HN     126 GLN HN     5.00  #CONFIRMED
 125 HIS HN     127 PHE HN     5.00  #CONFIRMED
 126 GLN HN     128 SER HN     5.00  #CONFIRMED
 127 PHE HN     129 HIS HN     5.00  #WEAK MNS
 128 SER HN     130 THR HN     5.00  #WEAK MNS 
 129 HIS HN     131 GLN HN     5.00  #WEAK MNS 
#--Ha(i)->HN(i+2)--------------4.40--3.80
 119 HIS HA     121 GLN HN     5.00  #CONFIRMED
 120 ASN HA     122 LEU HN     5.00  #OVERLAP 121.ha
#121 GLN HA     123 LYS+ HN    5.00  #OVERLAP 123.ha
 122 LEU HA     124 VAL HN     5.00  #CONFIRMED
#123 LYS+ HA    125 HIS HN     5.00  #OVERLAP 124.ha
#124 VAL HA     126 GLN HN     5.00  #OVERLAP 123.ha
#125 HIS HA     127 PHE HN     5.00  #OVERLAP 127.ha
#126 GLN HA     128 SER HN     5.00  #OVERLAP 128.hb3
#127 PHE HA     129 HIS HN     5.00  #OVERLAP 129.ha
 128 SER HA     130 THR HN     5.00  #CONFIRMED
#129 HIS HA     131 GLN HN     5.00  #OVERLAP 127.ha
#--Ha(i)->HN(i+3)--------------3.40--3.30
 119 HIS HA     122 LEU HN     3.50  #CONFIRMED
 120 ASN HA     123 LYS+ HN    3.50  #CONFIRMED
#121 GLN HA     124 VAL HN     3.50  #OVERLAP 124.ha
 122 LEU HA     125 HIS HN     3.50  #OVERLAP 125.hb2; CONFIRMED non800
 123 LYS+ HA    126 GLN HN     3.50  #CONFIRMED
#124 VAL HA     127 PHE HN     3.50  #OVERLAP 128.hb2
#125 HIS HA     128 SER HN     3.50  #OVERLAP 127.ha
 126 GLN HA     129 HIS HN     3.50  #OVERLAP 128.hb3, but assigned shoulder
#127 PHE HA     130 THR HN     3.50  #OVERLAP 129.ha
 128 SER HA     131 GLN HN     3.50  #CONFIRMED 3-10
#--Ha(i)->HN(i+4)--------------4.20
 119 HIS HA     123 LYS+ HN    5.00  #CONFIRMED
 120 ASN HA     124 VAL HN     5.00  #OVERLAP 124.ha
#121 GLN HA     125 HIS HN     5.00  #OVERLAP 124.ha
 122 LEU HA     126 GLN HN     5.00  #OVERLAP 125.hb2; CONFIRMED non800
 123 LYS+ HA    127 PHE HN     5.00  #OVERLAP 124.ha; CONFIRMED non800
#124 VAL HA     128 SER HN     5.00  #OVERLAP 128.hb2
#125 HIS HA     129 HIS HN     5.00  #OVERLAP 129.ha
#126 GLN HA     130 THR HN     5.00  #OVERLAP 128.hb3
 127 PHE HA     131 GLN HN     5.00  #OVERLAP 129.ha, but a-L C-cap
#--Ha(i)->Hb(i+3)--------------2.5-4.4--3.1-5.1
#119 HIS HA     122 LEU HB2    3.30  #OVERLAP WEAK
#119 HIS HA     122 LEU HB3    3.30  #OVERLAP WEAK
#120 ASN HA     123 LYS+ QB    3.30  #N.O.
 121 GLN HA     124 VAL HB     3.30  #CONFIRMED
 122 LEU HA     125 HIS HB3    3.30  #CONFIRMED
 122 LEU HA     125 HIS HB2    5.00  #WEAK
 123 LYS+ HA    126 GLN HB2    5.00  #CONFIRMED
 123 LYS+ HA    126 GLN HB3    3.30  #CONFIRMED
#124 VAL HA     127 PHE HB2    5.00  #VERY WEAK
#124 VAL HA     127 PHE HB3    5.00  #VERY WEAK
#125 HIS HA     128 SER HB2    5.00  #VERY WEAK
#126 GLN HA     129 HIS HB2    5.00  #VERY WEAK
#126 GLN HA     129 HIS HB3    5.00  #OVERLAP
#127 PHE HA     130 THR HB     5.00  #OVERLAP see 130.qg2
#128 SER HA     131 GLN HB2    5.00  #N.O.
#128 SER HA     131 GLN HB3    5.00  #N.O.
#129 HIS HA     132 GLN HB2    5.00  #N.O.
#129 HIS HA     132 GLN HB3    5.00  #N.O.
#****************************************
#--HBONDS--alpha-helix
#****************************************
#122 LEU HN     118 LYS+ O     2.00  #119.ha to 123.hn rm 24nov3
#122 LEU N      118 LYS+ O     3.00  #119.ha to 123.hn rm 24nov3
 123 LYS+ HN    119 HIS O      2.00
 123 LYS+ N     119 HIS O      3.00
 124 VAL HN     120 ASN O      2.00
 124 VAL N      120 ASN O      3.00
 125 HIS HN     121 GLN O      2.00
 125 HIS N      121 GLN O      3.00
 126 GLN HN     122 LEU O      2.00
 126 GLN N      122 LEU O      3.00
#127 PHE HN     123 LYS+ O     2.00  #3-10
#127 PHE N      123 LYS+ O     3.00  #3-10
#128 SER HN     124 VAL O      2.00  #3-10
#128 SER N      124 VAL O      3.00  #3-10
#129 HIS HN     125 HIS O      2.00  #3-10
#129 HIS N      125 HIS O      3.00  #3-10
#130 THR HN     126 GLN O      2.00  #NO
#130 THR N      126 GLN O      3.00  #NO
#131 GLN HN     127 PHE O      2.00  #NO
#131 GLN N      127 PHE O      3.00  #NO
#----------------------------------------
# Zinc Ligands
#    C107    H125
#         Zn
#    C112    H129
#----------------------------------------
 107 CYSZ ZN    107 CYSZ SG    2.35
 107 CYSZ ZN    107 CYSZ CB    3.41
 107 CYSZ ZN    112 CYS- SG    2.35
 107 CYSZ ZN    112 CYS- CB    3.41
 107 CYSZ ZN    125 HIS NE2    2.05
 107 CYSZ ZN    129 HIS NE2    2.05
#========================================
# Long Range NOEs Zinc Finger 4
#========================================
 104 MET HA     105 TYR QD     5.00  #WEAK
 104 MET HA     105 TYR QE     5.00  #WEAK
 104 MET HA     106 VAL QG2    5.00  #ORIENTATION of VAL
 104 MET HA     115 ALA QB     5.00  #WEAK S.D?
#104 MET QB     105 TYR QD     5.00  #OVERLAP 117.qb
 104 MET QB     106 VAL QG2    5.00  #ORIENTATION of VAL
 104 MET QB     115 ALA QB     5.00  #might LOOSEN due to mobility
 104 MET QB     117 LYS+ HA    5.00  #might LOOSEN due to mobility
 104 MET QG     105 TYR QD     5.00  #might LOOSEN due to mobility
 104 MET QG     106 VAL QG2    3.30  #ORIENTATION of VAL
 104 MET QG     115 ALA QB     5.00  #might LOOSEN due to mobility
 104 MET QG     117 LYS+ HA    5.00  #might LOOSEN due to mobility
 104 MET QE     105 TYR QD     5.00  #might LOOSEN due to mobility
 104 MET QE     106 VAL QG2    5.00  #ORIENTATION of VAL
 104 MET QE     115 ALA HA     5.00  #might LOOSEN due to mobility
 104 MET QE     115 ALA QB     5.00  #might LOOSEN due to mobility
 104 MET QE     116 PHE HA     3.30  #might LOOSEN due to mobility
 104 MET QE     117 LYS+ HA    5.00  #might LOOSEN due to mobility
 104 MET QE     117 LYS+ QE    5.00  #might LOOSEN due to mobility
#105 TYR HN     105 TYR HB2    2.70  #phi and Chi-1 UNDETERMINED
 105 TYR HN     115 ALA QB     5.00  #WEAK cross-sheet HN(i)-QB(j-1)
#105 TYR HN     116 PHE HB2    5.00  #OVERLAP
 105 TYR HN     116 PHE HB3    5.00  #WEAK
 105 TYR HA     106 VAL QG2    3.30  #MEDIUM
 105 TYR HA     122 LEU QD2    3.30  #MEDIUM
 105 TYR HA     122 LEU QD1    5.00  #WEAK-MEDIUM
#105 TYR HB3    116 PHE HB2    5.00  #BROAD
#105 TYR HB3    116 PHE HB3    5.00  #BROAD
#105 TYR HB3    118 LYS+ HN    5.00  #OVERLAP
 105 TYR HB3    122 LEU QD2    5.00  #STRONG relax 10nov3
#105 TYR HB2    116 PHE HB2    3.30  #BROAD
#105 TYR HB2    116 PHE HB3    5.00  #BROAD
#105 TYR HB2    116 PHE QD     5.00  #OVERLAP
#105 TYR HB2    118 LYS+ HN    5.00  #OVERLAP
 105 TYR HB2    122 LEU QD2    5.00  #MEDIUM relax 10nov3
#105 TYR QD     106 VAL QG1    5.00  #S.D. 6A
#105 TYR QD     117 LYS+ HA    5.00  #MEDIUM relax 8nov3 remove 10nov3
#105 TYR QD     118 LYS+ HN    5.00  #MEDIUM relax 10nov3 rm 9dec3
#105 TYR QD     118 LYS+ HA    5.00  #WEAK-MEDIUM remove 10nov3
#105 TYR QD     119 HIS HN     3.30  #MEDIUM overlap 105.qe rm 9dec3
#105 TYR QD     119 HIS HA     3.30  #MEDIUM remove 8nov3
#105 TYR QD     119 HIS HD2    5.00  #VERY WEAK remove 8nov3
#105 TYR QD     122 LEU QD2    3.30  #MEDIUM-STRONG remove 8nov3 for flex
#105 TYR QE     118 LYS+ HA    3.30  #STRONG relax 8nov3 rm 9dec3
#105 TYR QE     118 LYS+ QB    5.00  #VERY WEAK remove 8nov3
#105 TYR QE     118 LYS+ HG2   5.00  #WEAK-MEDIUM remove 8nov3
#105 TYR QE     118 LYS+ HG3   3.30  #MEDIUM remove 8nov3
#105 TYR QE     118 LYS+ HD2   3.30  #MEDIUM remove 8nov3
#105 TYR QE     118 LYS+ HD3   3.30  #MEDIUM remove 8nov3
#105 TYR QE     118 LYS+ HE2   5.00  #WEAK remove 8nov3
#105 TYR QE     118 LYS+ HE3   5.00  #WEAK remove 8nov3
#105 TYR QE     119 HIS HN     3.30  #MEDIUM overlap 105.qd rm 9dec3
#105 TYR QE     119 HIS HA     5.00  #MEDIUM relax 7nov3 remove 8nov3
 105 TYR QE     119 HIS HD2    3.30  #MEDIUM keep 8nov3 KEEP
#105 TYR QE     122 LEU QD2    5.00  #WEAK-MEDIUM remove 8nov3 for flex
#105 TYR QR     118 LYS+ HN    3.30  #OVERLAP 105.qr 116.qd NEED 4D CN remove 8nov3
#105 TYR QR     119 HIS HN     3.30  #OVERLAP 105.qr 116.qd NEED 4D CN remove 8nov3
 106 VAL HN     106 VAL HB     2.70  #ORIENTATION of VAL 106.hb->107.hn is weak too
 106 VAL HN     106 VAL QG2    2.70  #ORIENTATION of VAL
 106 VAL HN     122 LEU QD2    3.30  #MEDIUM OVERLAP 115.qb
 106 VAL HA     115 ALA QB     3.30  #MEDIUM cross sheet HA(i)-QB(j)
#106 VAL HA     116 PHE QD     5.00  #OVERLAP
 106 VAL QG1    107 CYSZ HN    3.30  #ORIENTATION of VAL
 106 VAL QG1    107 CYSZ HA    5.00  #WEAK CAREFUL!!
 106 VAL QG1    108 HIS HA     5.00  #WEAK
 106 VAL QG1    108 HIS HE1    2.70  #might LOOSEN due to mobility
 106 VAL QG1    113 GLY HN     5.00  #WEAK-MEDIUM
 106 VAL QG1    113 GLY HA2    3.30  #STRONG relax 11nov3
 106 VAL QG1    113 GLY HA3    5.00  #MEDIUM relax 11nov3
 106 VAL QG1    114 LYS+ HN    5.00  #ORIENTATION of VAL
 106 VAL QG1    115 ALA HA     3.30  #MEDIUM
 106 VAL QG1    115 ALA QB     3.30  #MEDIUM
 106 VAL QG2    108 HIS HE1    3.30  #might LOOSEN due to mobility
 106 VAL QG2    113 GLY HA2    5.00  #WEAK
#106 VAL QG2    113 GLY HA3    5.00  #S.D.
 106 VAL QG2    115 ALA HA     2.70  #STRONG
 106 VAL QG2    115 ALA QB     2.70  #STRONG
 106 VAL QG2    116 PHE HN     5.00  #ORIENTATION of VAL
#107 CYSZ HN    113 GLY HN     5.00  #VERY WEAK S.D. rm 24nov3
#107 CYSZ HN    114 LYS+ HN    5.00  #see cross-sheet HN-HN above 
#107 CYSZ HN    114 LYS+ HA    5.00  #WRONG ORIENTATION 5A
#107 CYSZ HN    115 ALA QB     3.30  #DISTANCE FILTERED OVERLAP 122.qd2
#107 CYSZ HN    116 PHE QD     5.00  #OVERLAP
 107 CYSZ HN    116 PHE QE     3.30  #MEDIUM
 107 CYSZ HN    116 PHE HZ     5.00  #WEAK
#107 CYSZ HN    122 LEU QD1    3.30  #OVERLAP 115.qb remove 8nov3
 107 CYSZ HN    125 HIS HD2    5.00  #MEDIUM S.D. loosen 4Jun2
 107 CYSZ HA    109 PHE HN     5.00  #WEAK
#107 CYSZ HA    114 LYS+ HN    5.00  #S.D. 6A
 107 CYSZ HA    116 PHE QE     5.00  #WEAK
 107 CYSZ HA    122 LEU QD1    2.70  #STRONG
 107 CYSZ HA    122 LEU QD2    3.30  #MEDIUM spin diffusion?
 107 CYSZ HA    125 HIS HD2    5.00  #spin diffusion?
 107 CYSZ HA    126 GLN HE21   2.70  #STRONG
 107 CYSZ HA    126 GLN HE22   3.30  #MEDIUM
#107 CYSZ HB2   114 LYS+ HN    5.00  #OVERLAP 114.qe
 107 CYSZ HB2   116 PHE QD     5.00  #WEAK
 107 CYSZ HB2   116 PHE QE     5.00  #WEAK
 107 CYSZ HB2   122 LEU QD1    3.30  #MEDIUM
 107 CYSZ HB2   125 HIS HD2    3.30  #MEDIUM
#107 CYSZ HB3   113 GLY HN     5.00  #WEAK remove 8nov3
 107 CYSZ HB3   114 LYS+ HN    3.30  #MEDIUM
 107 CYSZ HB3   114 LYS+ HB2   5.00  #med in xray
 107 CYSZ HB3   122 LEU QD1    5.00  #WEAK
#107 CYSZ HB3   125 HIS HD2    5.00  #N.O.
#107 CYSZ HB3   126 GLN HG2    5.00  #??? OVERLAP
 108 HIS HN     109 PHE HN     2.70  #STRONG-MEDIUM
 108 HIS HN     122 LEU QD2    5.00  #WEAK
 108 HIS HN     126 GLN HE21   5.00  #WEAK
 108 HIS HN     126 GLN HE22   5.00  #WEAK
#108 HIS HA     109 PHE HN     3.30  #MEDIUM remove 12nov3
 108 HIS HA     113 GLY HN     5.00  #MEDIUM-WEAK
 109 PHE HN     112 CYS- HN    5.00  #WEAK overlap 129.he1
 109 PHE HN     112 CYS- QB    5.00  #WEAK HN-S?
 109 PHE HN     113 GLY HN     5.00  #WEAK
 109 PHE HN     126 GLN HE21   5.00  #WEAK
 109 PHE HN     129 HIS HD2    5.00  #WEAK
 109 PHE HA     110 GLU- HN    2.70  #VERY STRONG
#109 PHE HA     112 CYS- QB    5.00  #WEAK wrong orientation remove 12nov3
 109 PHE HB2    112 CYS- HN    5.00  #WEAK
 109 PHE HB2    112 CYS- QB    3.30  #MEDIUM-WEAK
#109 PHE HB2    113 GLY HN     6.00  #VERY WEAK remove 12nov3
 109 PHE HB2    129 HIS HD2    3.30  #MEDIUM-WEAK
 109 PHE HB2    129 HIS HE1    3.30  #MEDIUM-WEAK
 109 PHE HB3    112 CYS- HN    5.00  #WEAK
 109 PHE HB3    112 CYS- QB    3.30  #MEDIUM-WEAK
#109 PHE HB3    113 GLY HN     6.00  #VERY WEAK remove 12nov3
 109 PHE HB3    129 HIS HD2    5.00  #WEAK-MEDIUM
 109 PHE HB3    129 HIS HE1    3.30  #MEDIUM-WEAK
 109 PHE QD     110 GLU- HN    5.00  #WEAK removed 4jun2 try again 8jun2
 109 PHE QD     112 CYS- HN    5.00  #WEAK added 4jun2
 109 PHE QD     112 CYS- HA    5.00  #WEAK remove 12nov3 try again 20nov3
 109 PHE QD     112 CYS- QB    5.00  #WEAK-MEDIUM
 109 PHE QD     129 HIS HD2    3.30  #MEDIUM-WEAK
 109 PHE QD     129 HIS HE1    3.30  #MEDIUM-WEAK
 109 PHE QD     130 THR QG2    5.00  #WEAK added 4jun2
#109 PHE QE     110 GLU- HN    5.00  #VERY WEAK removed 4jun2
 109 PHE QE     129 HIS HD2    5.00  #WEAK added 4jun2
 109 PHE QE     130 THR HA     5.00  #WEAK added 4jun2
#109 PHE QE     130 THR HB     5.00  #WEAK bad orientation
 109 PHE QE     130 THR QG2    3.30  #MEDIUM
 109 PHE HZ     130 THR HA     5.00  #WEAK added 4jun2
 109 PHE HZ     130 THR QG2    5.00  #WEAK added 4jun2
 110 GLU- HA    111 ASN HN     2.70  #STRONG Type I turn 2.2 switch 13nov3
 110 GLU- HA    112 CYS- HN    4.00  #MEDIUM Type I turn 3.6 switch 13nov3
 111 ASN HN     112 CYS- HN    2.70  #STRONG Type I turn 2.4
 111 ASN HN     113 GLY HN     5.00  #VERY WEAK S.D.? remove 12nov3 add 10feb4
 112 CYS- HN    112 CYS- QB    2.70  #ORIENTATION
 112 CYS- HN    113 GLY HN     3.30  #MEDIUM overlap remove 13nov3 add 24nov3
 112 CYS- HN    113 GLY HA2    5.00  #WEAK
 112 CYS- HA    114 LYS+ HN    5.00  #WEAK 114.hn -> 112.sg H-bond
 112 CYS- HA    129 HIS HE1    5.00  #MEDIUM-WEAK relax 20nov3
 112 CYS- QB    113 GLY HN     2.70  #STRONG relax 18nov3 tighten 24nov3 stereo from structure 5feb4
 112 CYS- QB    114 LYS+ HN    3.30  #MEDIUM OVERLAP 114.qe stereo from structure 5feb4
 112 CYS- QB    129 HIS HE1    3.30  #MEDIUM-WEAK stereo from structure 5feb4
#113 GLY HN     114 LYS+ HB2   5.00  #WEAK-MEDIUM rm 24nov3
#113 GLY HN     114 LYS+ HB3   5.00  #WEAK-MEDIUM weaker SD remove 12nov
 114 LYS+ HN    116 PHE QE     5.00  #WEAK-MEDIUM  S.D.?
 114 LYS+ HN    116 PHE HZ     5.00  #WEAK-MEDIUM  S.D.?
 114 LYS+ HA    116 PHE QE     5.00  #WEAK
 114 LYS+ HA    116 PHE HZ     5.00  #WEAK
 114 LYS+ HB2   116 PHE QD     5.00  #WEAK
 114 LYS+ HB2   116 PHE QE     5.00  #WEAK
 114 LYS+ HB2   116 PHE HZ     5.00  #WEAK
 114 LYS+ HB2   122 LEU QD1    5.00  #WEAK S.D.?
 114 LYS+ HB2   125 HIS HE1    5.00  #WEAK
 114 LYS+ HB3   116 PHE QD     5.00  #WEAK
 114 LYS+ HB3   116 PHE QE     5.00  #WEAK
 114 LYS+ HB3   116 PHE HZ     5.00  #WEAK
 114 LYS+ HB3   122 LEU QD1    5.00  #WEAK
 114 LYS+ HB3   125 HIS HE1    5.00  #WEAK
 114 LYS+ HG2   116 PHE QD     5.00  #WEAK
 114 LYS+ HG2   116 PHE QE     5.00  #WEAK
 114 LYS+ HG2   116 PHE HZ     5.00  #WEAK
 114 LYS+ HG2   125 HIS HE1    5.00  #WEAK-MEDIUM
 114 LYS+ HG3   116 PHE QD     5.00  #WEAK
 114 LYS+ HG3   116 PHE QE     5.00  #WEAK
 114 LYS+ HG3   116 PHE HZ     5.00  #WEAK
 114 LYS+ HG3   125 HIS HE1    5.00  #WEAK
 114 LYS+ QD    116 PHE QD     5.00  #WEAK
 114 LYS+ QD    116 PHE QE     5.00  #WEAK-MEDIUM
 114 LYS+ QD    116 PHE HZ     5.00  #WEAK-MEDIUM
 114 LYS+ QD    125 HIS HE1    3.30  #MEDIUM
 114 LYS+ QE    116 PHE QD     5.00  #WEAK
 114 LYS+ QE    116 PHE QE     3.30  #MEDIUM
 114 LYS+ QE    116 PHE HZ     3.30  #MEDIUM
 114 LYS+ QE    125 HIS HE1    3.30  #MEDIUM
 115 ALA HN     116 PHE QD     5.00  #WEAK
 115 ALA HN     116 PHE QE     5.00  #MEDIUM relax 8nov3
 115 ALA HN     116 PHE HZ     5.00  #WEAK
 115 ALA HA     116 PHE QD     5.00  #WEAK orientation of PHE
 116 PHE HN     116 PHE QD     2.70  #STRONG orientation of PHE
 116 PHE HA     118 LYS+ HN    5.00  #WEAK
 116 PHE HB2    117 LYS+ HN    5.00  #MEDIUM relax 11nov3
 116 PHE HB2    118 LYS+ HN    3.30  #MEDIUM
#116 PHE HB2    121 GLN HB2    5.00  #TOO BROAD
#116 PHE HB2    121 GLN HB3    5.00  #TOO BROAD
#116 PHE HB2    122 LEU HB3    5.00  #TOO BROAD
 116 PHE HB3    117 LYS+ HN    5.00  #MEDIUM relax 10nov3
 116 PHE HB3    118 LYS+ HN    3.30  #MEDIUM
#116 PHE HB3    121 GLN HB2    3.30  #TOO BROAD
#116 PHE HB3    121 GLN HB3    5.00  #loosened 7aug00
#116 PHE HB3    121 GLN HG2    5.00  #TOO BROAD
#116 PHE HB3    121 GLN HG3    5.00  #weak
#116 PHE HB3    121 GLN HN     5.00  #overlap 119.ha
 116 PHE HB3    122 LEU HN     5.00  #MEDIUM-WEAK
 116 PHE QD     117 LYS+ HN    5.00  #WEAK
 116 PHE QD     121 GLN HA     5.00  #WEAK-MEDIUM
 116 PHE QD     121 GLN QB     5.00  #WEAK
 116 PHE QD     121 GLN HG2    5.00  #WEAK
 116 PHE QD     122 LEU HA     3.30  #MEDIUM
 116 PHE QD     122 LEU HB2    5.00  #WEAK
 116 PHE QD     122 LEU HB3    5.00  #WEAK
 116 PHE QD     122 LEU QD1    3.30  #MEDIUM
 116 PHE QE     122 LEU HA     5.00  #WEAK
 116 PHE QE     122 LEU QD1    3.30  #MEDIUM
 116 PHE QE     125 HIS HA     5.00  #WEAK
 116 PHE QE     125 HIS HB3    5.00  #WEAK
 116 PHE QE     125 HIS HB2    5.00  #WEAK
 116 PHE QE     125 HIS HD2    5.00  #WEAK
 116 PHE QE     125 HIS HE1    5.00  #WEAK
 116 PHE HZ     122 LEU HA     5.00  #WEAK
 116 PHE HZ     125 HIS HN     5.00  #WEAK overlap 129.hd2
 116 PHE HZ     125 HIS HA     5.00  #WEAK
 116 PHE HZ     125 HIS HB3    5.00  #WEAK
 116 PHE HZ     125 HIS HB2    5.00  #WEAK
 116 PHE HZ     125 HIS HD2    5.00  #WEAK overlap 129.hd2
 116 PHE HZ     125 HIS HE1    5.00  #WEAK overlap 129.hd2
 117 LYS+ HN    117 LYS+ QG    5.00  #MEDIUM rlx 30jan4
 117 LYS+ HN    118 LYS+ HN    3.30  #MEDIUM
 117 LYS+ HN    118 LYS+ HG3   5.00  #WEAK new 1dec3
 117 LYS+ QB    118 LYS+ HN    3.30  #MEDIUM new 1dec3
#118 LYS+ HN    121 GLN HN     5.00  #OVERLAP 123.hn
 118 LYS+ HN    121 GLN QB     3.30  #OVERLAP 117.qb new 1dec3
 118 LYS+ HN    121 GLN HG3    3.30  #new 1dec3
 118 LYS+ HN    121 GLN HE21   5.00  #new 1dec3
 118 LYS+ HN    121 GLN HE22   5.00  #new 1dec3
#118 LYS+ HN    122 LEU HN     5.00  #OVERLAP 123.hn
 118 LYS+ HA    119 HIS HN     2.70  #MEDIUM-STRONG tighten 24nov3
 118 LYS+ HA    119 HIS HB3    5.00  #WEAK 24nov3
 118 LYS+ HA    120 ASN HN     5.00  #WEAK 17nov3
#118 LYS+ QB    121 GLN HN     5.00  #WEAK remove 8nov3
#118 LYS+ QB    121 GLN QB     5.00  #VERY WEAK remove 8nov3
#118 LYS+ QB    121 GLN QG     5.00  #VERY WEAK remove 8nov3
#118 LYS+ HG2   121 GLN HN     5.00  #WEAK remove 8nov3
 119 HIS HN     119 HIS HD2    5.00  #orientation of HIS add 11nov3 rlx 27aug4
#119 HIS HA     119 HIS HD2    2.70  #orientation of HIS remove 7nov3
 119 HIS HA     122 LEU QD2    3.30
 119 HIS HD2    120 ASN HN     5.00  #orientation of HIS? add 30aug4
#119 HIS HD2    122 LEU HB3    5.00  #spin diffusion? remove 7nov3
#119 HIS HD2    122 LEU QD2    3.30  #orientation of HIS remove 7nov3
 119 HIS HE1    120 ASN HN     5.00  #orientation of HIS weak? add 30aug4
 119 HIS HE1    120 ASN HD21   3.30  #orientation of HIS med add 11nov3 tighte
 119 HIS HE1    120 ASN HD22   3.30  #orientation of HIS med add 11nov3 tighte
#120 ASN HN     120 ASN HD21   3.30  #10feb4 rm 2aug4
#120 ASN HN     120 ASN HD22   3.30  #10feb4 rm 2aug4
#120 ASN HD21   121 GLN HN     5.00  #10feb4
#120 ASN HD22   121 GLN HN     5.00  #10feb4
#121 GLN HN     121 GLN HG3    2.70  #fix chi angles rm 2aug4
 122 LEU HA     122 LEU QD1    2.70  #orientation of LEU
 122 LEU HA     125 HIS HD2    5.00
 122 LEU HB3    123 LYS+ HN    2.70  #orientation of LEU
 122 LEU HG     126 GLN HG2    5.00
 122 LEU HG     126 GLN HN     5.00
 122 LEU HG     126 GLN HE21   5.00
 122 LEU HG     126 GLN HE22   5.00
 122 LEU QD1    125 HIS HD2    3.30  #MEDIUM
 122 LEU QD1    126 GLN HN     5.00
 122 LEU QD1    126 GLN HG2    3.30
 122 LEU QD1    126 GLN HG3    5.00
 122 LEU QD1    126 GLN HE21   3.30
 122 LEU QD1    126 GLN HE22   3.30
 124 VAL HN     124 VAL QG2    2.70  #ORIENTATION of sidechain
 124 VAL HA     127 PHE QD     3.30  #FLEXIBILITY????? tighten 18nov3
 124 VAL HB     125 HIS HN     2.70  #ORIENTATION of sidechain
 124 VAL QG1    125 HIS HN     3.30  #ORIENTATION of sidechain
 124 VAL QG1    127 PHE HN     5.00  #ORIENTATION of sidechain
#124 VAL QG1    127 PHE QD     5.00  #FLEXIBILITY????? rm 3dec3
 124 VAL QG2    125 HIS HN     5.00  #ORIENTATION of sidechain
 124 VAL QG2    127 PHE QE     3.30  #FLEXIBILITY????? tighten 18nov3 QE 3dec3
 125 HIS HA     125 HIS HB2    2.70  #CONFIRMED chi-1
 125 HIS HB3    125 HIS HD2    2.70  #CONFIRMED chi-2
 125 HIS HD2    126 GLN HN     5.00  #med?
 125 HIS HD2    126 GLN HA     5.00
 125 HIS HD2    126 GLN HG2    3.30
 125 HIS HD2    126 GLN HG3    3.30
 125 HIS HD2    129 HIS HD2    5.00  #WEAK SD
 126 GLN HN     129 HIS HD2    5.00  #WEAK
 126 GLN HA     129 HIS HD2    2.70
 126 GLN HA     130 THR QG2    5.00  #WEAK-MEDIUM linker C-cap
 126 GLN HB2    129 HIS HD2    5.00
 126 GLN HB2    130 THR QG2    5.00  #WEAK linker C-cap
 126 GLN HB3    129 HIS HD2    5.00
 126 GLN HB3    130 THR QG2    3.30  #WEAK-MEDIUM linker C-cap
 126 GLN HG3    129 HIS HD2    3.30
 126 GLN HE21   129 HIS HD2    5.00  #WEAK
 127 PHE HN     130 THR HG1    5.00  #WEAK linker C-cap
 127 PHE HA     130 THR HG1    2.70  #linker C-cap
 127 PHE HA     130 THR QG2    3.30  #MED-WEAK linker C-cap
 127 PHE HB2    132 GLN HE21   3.30  #MED 21jul4
 127 PHE HB2    132 GLN HE22   5.00  #WEAK 21jul4
 127 PHE HB3    132 GLN HE21   3.30  #MED 21jul4
 127 PHE HB3    132 GLN HE22   5.00  #WEAK 21jul4
 127 PHE QD     128 SER HA     5.00  #WEAK
 127 PHE QD     128 SER HB2    5.00  #WEAK SD?
 127 PHE QD     128 SER HB3    5.00  #WEAK SD?
 127 PHE QD     131 GLN HN     5.00  #MEDIUM-WEAK
 127 PHE QD     131 GLN HA     5.00  #WEAK 21jul4
 127 PHE QD     132 GLN HN     3.30  #MEDIUM-STRONG
 127 PHE QD     132 GLN QB     5.00  #WEAK flexible
 127 PHE QD     132 GLN QG     5.00  #WEAK flexible
 127 PHE QE     131 GLN HA     5.00  #WEAK 21jul4
 127 PHE QE     131 GLN QG     5.00  #MEDIUM but FLEXIBLE!!! QE 3dec3
 128 SER HN     129 HIS HD2    5.00  #WEAK
 128 SER HA     131 GLN HE21   3.30  #MED 7jul4
 128 SER HA     131 GLN HE22   5.00  #MED 21jul4
 129 HIS HN     129 HIS HD2    3.30  #MEDIUM-STRONG 3.0A
 129 HIS HN     130 THR HG1    5.00  #WEAK linker C-cap
 129 HIS HN     130 THR QG2    5.00  #MEDIUM but SD
 129 HIS HA     131 GLN HE21   5.00  #WEAK 7jul4
 129 HIS HA     131 GLN HE22   5.00  #WEAK 7jul4
 129 HIS HB2    129 HIS HD2    2.70  #MEDIUM-STRONG
 129 HIS HD2    130 THR HN     5.00  #WEAK
 129 HIS HD2    130 THR QG2    5.00  #WEAK linker C-cap
 130 THR HN     130 THR HG1    2.70  #STRONG chi-1
 130 THR HN     131 GLN HA     5.00  #S.D. ???
 130 THR HN     132 GLN HN     5.00  #WEAK-MEDIUM
 130 THR HA     132 GLN HG2    5.00  #WEAK
 130 THR HA     132 GLN HG3    5.00  #WEAK
 130 THR HB     132 GLN HN     3.30  #MEDIUM overlap 130.ha
 130 THR HB     132 GLN HB2    5.00  #WEAK
 130 THR HB     132 GLN HB3    5.00  #WEAK
 130 THR HB     132 GLN HG2    3.30  #MEDIUM-WEAK loosen 4jun2 adj 21jul4
 130 THR HB     132 GLN HG3    3.30  #MEDIUM-WEAK loosen 4jun2 adj 21jul4
 130 THR HB     132 GLN HE21   3.30  #WEAK 8jul4 adj 21jul4
 130 THR HB     132 GLN HE22   5.00  #WEAK 8jul4
 130 THR HG1    131 GLN HN     3.30  #MEDIUM C-cap
 130 THR HG1    132 GLN HN     2.70  #STRONG C-cap H-BOND VERY IMPORTANT!!
 130 THR HG1    132 GLN HE21   5.00  #WEAK
 130 THR HG1    132 GLN HE22   5.00  #WEAK
 130 THR QG2    132 GLN HN     5.00  #WEAK 21jul4
#130 THR QG2    132 GLN HB2    5.00  #WEAK SD removed 4jun2
#130 THR QG2    132 GLN HB3    5.00  #WEAK SD removed 4jun2
 130 THR QG2    132 GLN HG2    5.00  #WEAK-MEDIUM removed 4jun2 add 7jul4
 130 THR QG2    132 GLN HG3    5.00  #WEAK-MEDIUM removed 4jun2 add 7jul4
 130 THR QG2    132 GLN HE21   3.30  #MED 7jul4
 130 THR QG2    132 GLN HE22   5.00  #MED 7jul4 rlx  21jul4
 131 GLN HN     132 GLN HN     3.30  #MEDIUM-STRONG

#========================================
# InterFinger NOEs Zinc Fingers 4 to 5
#========================================
 121 GLN HA     148 LEU QD2    5.00  #MEDIUM 3DC return 1dec3
 121 GLN HA     135 TYR QE     6.00  #VERY WEAK new 2dec3 rlx 20jul4
 121 GLN QB     148 LEU QD2    5.00  #MEDIUM-WEAK new 2dec3
 124 VAL HA     135 TYR QD     5.00  #MEDIUM remove 8nov3 weak relax 9nov3  
 124 VAL HA     135 TYR QE     3.30  #WEAK keep 8nov3 MEDIUM? 18nov3
 124 VAL HA     148 LEU QD2    5.00  #WEAK 4DCC MED 3DC
 124 VAL HB     148 LEU QD2    5.00  #MED-WEAK 3DC
 124 VAL QG2    135 TYR QD     5.00  #WEAK 3DC
 124 VAL QG2    135 TYR QE     3.30  #MEDIUM 4DCC
 124 VAL QG2    148 LEU HA     5.00  #WEAK 3DC
 124 VAL QG2    148 LEU HG     5.00  #WEAK 3DC
 124 VAL QG2    148 LEU QD1    3.30  #MEDIUM 4DCC
 124 VAL QG2    148 LEU QD2    2.70  #STRONG 4DCC
 124 VAL QG2    149 PRO HD2    3.30  #MEDIUM 3DC
 124 VAL QG2    149 PRO HD3    5.00  #WEAK 3DC
 124 VAL QG1    135 TYR QE     5.00  #WEAK 3DC
 124 VAL QG1    148 LEU HA     5.00  #WEAK 3DC
 124 VAL QG1    148 LEU HG     5.00  #WEAK 3DC
 124 VAL QG1    148 LEU QD1    3.30  #MEDIUM
 124 VAL QG1    148 LEU QD2    2.70  #STRONG
#127 PHE HN     133 LEU HG     5.00  #MAYBE?
 127 PHE HA     133 LEU QD2    6.00  #WEAK loosen 3nov3 tighten 18nov3
 127 PHE QD     133 LEU HA     5.00  #WEAK
 127 PHE QE     133 LEU HG     3.30  #MEDIUM
 127 PHE QE     133 LEU QD1    3.30  #MEDIUM
 127 PHE QE     133 LEU QD2    2.70  #STRONG
 127 PHE QD     134 PRO HA     6.00  #WEAK
 127 PHE QD     134 PRO HB3    5.00  #WEAK
 127 PHE QD     134 PRO QD     5.00  #WEAK
 127 PHE QD     147 SER HA     5.00  #WEAK
 127 PHE QD     147 SER HB2    5.00  #WEAK
 127 PHE QD     147 SER HB3    5.00  #WEAK
 132 GLN HN     133 LEU HN     5.00  #WEAK-MED 7jul4
 132 GLN HA     133 LEU HN     2.70  #STRONG define psi
 132 GLN HE21   133 LEU HN     5.00  #WEAK 7jul4
 132 GLN HE22   133 LEU HN     5.00  #WEAK 7jul4
 132 GLN HE22   134 PRO HB3    5.00  #WEAK 21jul4
 132 GLN HE21   134 PRO HD3    5.00  #WEAK 8jul4
 132 GLN HE22   134 PRO HD3    5.00  #WEAK 8jul4
#========================================
# ZINC FINGER 5
#----------------------------------------
# Beta Sheet 
#  >-Y135-E136-C137->
#  <-F146-R145-K144-<
#------------------------------anti--para
#--Ha(i)->HN(i+1)--------------2.20--2.20
 135 TYR HA     136 GLU- HN    2.70  #CONFIRMED
 136 GLU- HA    137 CYSZ HN    2.70  #CONFIRMED
#137 CYSZ HA    138 PRO HD2    2.70  #TOO WEAK
#137 CYSZ HA    138 PRO HD3    2.70  #TOO WEAK
 144 LYS+ HA    145 ARG+ HN    2.70  #CONFIRMED
 145 ARG+ HA    146 PHE HN     2.70  #CONFIRMED
 146 PHE HA     147 SER HN     2.70  #CONFIRMED
#--Ha(i)->Ha(j)--cross-sheet---2.30--4.80
 136 GLU- HA    145 ARG+ HA    2.70  #CONFIRMED
#138 PRO HA     143 ASP- HA    2.70  #N.O.
#--Ha(i)->HN(j+1)--cross-sheet-3.20--3.00
 136 GLU- HA    146 PHE HN     3.30  #CONFIRMED
#138 PRO HA     144 LYS+ HN    3.30  #???
 145 ARG+ HA    137 CYSZ HN    3.30  #CONFIRMED
 147 SER HA     135 TYR HN     5.00  #CONFIRMED loosen 3nov3
#--Ha(i)->HN(j-1)--cross-sheet-
#136 GLU- HA    144 LYS+ HN    5.00  #OVERLAP 142.ha
#143 ASP- HA    137 CYSZ HN    5.00  #N.O.
 145 ARG+ HA    135 TYR HN     5.00  #CONFIRMED
#--HN(i)->HN(j)--cross-sheet---3.30--4.00
 135 TYR HN     146 PHE HN     5.00  #CONFIRMED
 137 CYSZ HN    144 LYS+ HN    5.00  #WEAK
#****************************************
#--HBONDS--cross-sheet
#****************************************
#135 TYR HN     146 PHE O      2.00  #NEW in 5S46
#135 TYR N      146 PHE O      3.00  
 137 CYSZ HN    144 LYS+ O     2.00  
 137 CYSZ N     144 LYS+ O     3.00  
#144 LYS+ HN    137 CYSZ O     2.00  #missing 137.hn->144.hn
#144 LYS+ N     137 CYSZ O     3.00  #  and 138.ha->144.hn
 146 PHE HN     135 TYR O      2.00  
 146 PHE N      135 TYR O      3.00
#----------------------------------------
# Alpha Helix
#  >-L148--L152--E156--A150->
#      P149--K153--K157   
#        S150--R154--V158
#          R151--H155--H159
#                    Zn
#------------------------------alph--3-10
#--HN(i)->HN(i+1)--------------2.80--2.60
#149 PRO QD     150 SER HN     3.00  #OVERLAP 149.ha & 150.hb3
 150 SER HN     151 ARG+ HN    3.00  #CONFIRMED
 151 ARG+ HN    152 LEU HN     3.00  #CONFIRMED
 152 LEU HN     153 LYS+ HN    3.00  #CONFIRMED
 153 LYS+ HN    154 ARG+ HN    3.00  #OVERLAP 155.hn & 155.n
#154 ARG+ HN    155 HIS HN     3.00  #OVERLAP 155.hn & 155.n
 155 HIS HN     156 GLU- HN    3.00  #OVERLAP 154.hn & 154.n
 156 GLU- HN    157 LYS+ HN    3.00  #CONFIRMED
 157 LYS+ HN    158 VAL HN     3.00  #CONFIRMED
 158 VAL HN     159 HIS HN     3.00  #CONFIRMED
 159 HIS HN     160 ALA HN     3.00  #CONFIRMED
 160 ALA HN     161 GLY HN     3.00  #CONFIRMED
#--HN(i)->HN(i+2)--------------4.20--4.10
#149 PRO QD     151 ARG+ HN    5.00  #OVERLAP 151.qd 150.hb3
 150 SER HN     152 LEU HN     5.00  #CONFIRMED
 151 ARG+ HN    153 LYS+ HN    5.00  #CONFIRMED
 152 LEU HN     154 ARG+ HN    5.00  #OVERLAP 155.hn & 155.n
#153 LYS+ HN    155 HIS HN     5.00  #OVERLAP 155.hn & 155.n
#154 ARG+ HN    156 GLU- HN    5.00  #OVERLAP 155.hn & 155.n
 155 HIS HN     157 LYS+ HN    5.00  #CONFIRMED
 156 GLU- HN    158 VAL HN     5.00  #CONFIRMED
 157 LYS+ HN    159 HIS HN     5.00  #CONFIRMED
 158 VAL HN     160 ALA HN     5.00  #CONFIRMED
 159 HIS HN     161 GLY HN     5.00  #CONFIRMED
#--Ha(i)->HN(i+2)--------------4.40--3.80
#149 PRO HA     151 ARG+ HN    5.00  #OVERLAP 151.qd
#150 SER HA     152 LEU HN     5.00  #OVERLAP 151.ha
#151 ARG+ HA    153 LYS+ HN    5.00  #OVERLAP 153.ha
#152 LEU HA     154 ARG+ HN    5.00  #OVERLAP 154.qd
#153 LYS+ HA    155 HIS HN     5.00  #OVERLAP 154.ha
 154 ARG+ HA    156 GLU- HN    5.00  #SHOULDER
 155 HIS HA     157 LYS+ HN    5.00  #CONFIRMED
 156 GLU- HA    158 VAL HN     5.00  #CONFIRMED
#157 LYS+ HA    159 HIS HN     5.00  #OVERLAP 158.ha
#158 VAL HA     160 ALA HN     5.00  #OVERLAP 161.ha1 157.ha
#159 HIS HA     161 GLY HN     5.00  #OVERLAP 160.ha
#160 ALA HA     162 TYR HN     5.00  #OVERALP ?
#--Ha(i)->HN(i+3)--------------3.40--3.30
#149 PRO HA     152 LEU HN     3.50  #OVERLAP 152.ha
#150 SER HA     153 LYS+ HN    3.50  #OVERLAP 153.ha
#151 ARG+ HA    154 ARG+ HN    3.50  #OVERALP 154.ha
#152 LEU HA     155 HIS HN     3.50  #OVERALP 152.hb2
 153 LYS+ HA    156 GLU- HN    3.50  #CONFIRMED
 154 ARG+ HA    157 LYS+ HN    3.50  #SHOULDER
 155 HIS HA     158 VAL HN     3.50  #SHOULDER
 156 GLU- HA    159 HIS HN     3.50  #CONFIRMED
 157 LYS+ HA    160 ALA HN     3.50  #OVERLAP 161.ha1
#158 VAL HA     161 GLY HN     5.00  #OVERLAP 161.ha1
#--Ha(i)->HN(i+4)--------------4.20
#149 PRO HA     153 LYS+ HN    5.00  #OVERLAP 152.ha
#150 SER HA     154 ARG+ HN    5.00  #OVERLAP 154.ha
#151 ARG+ HA    155 HIS HN     5.00  #OVERLAP 154.ha
 152 LEU HA     156 GLU- HN    5.00  #CONFIRMED
#153 LYS+ HA    157 LYS+ HN    5.00  #OVERLAP 157.ha
#154 ARG+ HA    158 VAL HN     5.00  #OVERLAP 158.ha
#155 HIS HA     159 HIS HN     5.00  #OVERLAP 159.ha
 156 GLU- HA    160 ALA HN     5.00  #OVERLAP 161.ha2
#157 LYS+ HA    161 GLY HN     5.00  #OVERLAP 161.ha1
#--Ha(i)->Hb(i+3)--------------2.5-4.4--3.1-5.1
 149 PRO HA     152 LEU HB2    3.30  #CONFIRMED WEAK but comparable to 152.ha
 149 PRO HA     152 LEU HB3    3.30  #CONFIRMED WEAK but comparable to 152.ha
 150 SER HA     153 LYS+ QB    3.30  #CONFIRMED OVERLAP 153.ha
 151 ARG+ HA    154 ARG+ HB2   3.30  #CONFIRMED OVERLAP 154.ha
 151 ARG+ HA    154 ARG+ HB3   3.30  #CONFIRMED OVERLAP 154.ha
 152 LEU HA     155 HIS HB2    3.30  #CONFIRMED OVERLAP 125.hb2
 152 LEU HA     155 HIS HB3    3.30  #CONFIRMED OVERLAP 125.hb3
 153 LYS+ HA    156 GLU- QB    3.30  #CONFIRMED
#154 ARG+ HA    157 LYS+ QB    3.30  #157.qb IS UNASSIGNED
 155 HIS HA     158 VAL HB     5.00  #CONFIRMED MED-WEAK rlx 9jul4
 156 GLU- HA    159 HIS QB     3.30  #CONFIRMED MED-WEAK
 157 LYS+ HA    160 ALA QB     3.30  #CONFIRMED
#****************************************
#--HBONDS--alpha-helix
#****************************************
#152 LEU HN     148 LEU O      2.00  #NO
#152 LEU N      148 LEU O      3.00  #NO
 153 LYS+ HN    149 PRO O      2.00
 153 LYS+ N     149 PRO O      3.00
 154 ARG+ HN    150 SER O      2.00
 154 ARG+ N     150 SER O      3.00
 155 HIS HN     151 ARG+ O     2.00
 155 HIS N      151 ARG+ O     3.00
 156 GLU- HN    152 LEU O      2.00
 156 GLU- N     152 LEU O      3.00
#157 LYS+ HN    153 LYS+ O     2.00  #MISSING 153.ha>157.hn
#157 LYS+ N     153 LYS+ O     3.00  #MISSING 153.ha>157.hn
#158 VAL HN     154 ARG+ O     2.00  #MISSING 154.ha>158.hn
#158 VAL N      154 ARG+ O     3.00  #MISSING 154.ha>158.hn
#159 HIS HN     155 HIS O      2.00  #MISSING 155.ha>159.hn
#159 HIS N      155 HIS O      3.00  #MISSING 155.ha>159.hn
#160 ALA HN     156 GLU- O     2.00  #156.ha>160.hn
#160 ALA N      156 GLU- O     3.00  #156.ha>160.hn
#161 GLY HN     157 LYS+ O     2.00  #MISSING 157.ha>161.hn
#161 GLY N      157 LYS+ O     3.00  #MISSING 157.ha>161.hn
#----------------------------------------
# Zinc Ligands
#    C137    H155
#         Zn
#    C142    H159
#----------------------------------------
 137 CYSZ ZN    137 CYSZ SG    2.35
 137 CYSZ ZN    137 CYSZ CB    3.41
 137 CYSZ ZN    142 CYS- SG    2.35
 137 CYSZ ZN    142 CYS- CB    3.41
 137 CYSZ ZN    155 HIS NE2    2.05
 137 CYSZ ZN    159 HIS NE2    2.05
#========================================
# Long Range NOEs Zinc Finger 5
#========================================
 133 LEU HA     134 PRO HD2    2.70  #VERY WEAK trans Pro
 133 LEU HA     134 PRO HD3    2.70  #VERY WEAK trans Pro
 133 LEU HA     135 TYR HN     5.00
 133 LEU HA     147 SER HA     5.00  #SD?
 133 LEU HB2    135 TYR HN     5.00
 133 LEU HB2    145 ARG+ HB2   5.00
 133 LEU HB2    145 ARG+ HB3   5.00
 133 LEU HB2    146 PHE HN     3.30
 133 LEU HB3    145 ARG+ HB2   3.30
 133 LEU HB3    145 ARG+ HB3   5.00
 133 LEU QQD    145 ARG+ HN    5.00
 133 LEU QQD    145 ARG+ HB2   3.30
 133 LEU QQD    145 ARG+ HB3   3.30
 133 LEU QQD    146 PHE HN     5.00
 133 LEU QQD    146 PHE HA     3.30
 133 LEU QQD    147 SER HN     3.30
 133 LEU QD1    134 PRO HD2    3.30  #WEAK 8jul4
 133 LEU QD1    134 PRO HD3    3.30  #WEAK 8jul4
 133 LEU QD2    134 PRO HD2    5.00  #WEAK 8jul4 
 133 LEU QD2    134 PRO HD3    5.00  #WEAK 8jul4
 133 LEU QD1    147 SER HA     3.30  #MEDIUM
 133 LEU QD2    147 SER HA     2.70  #STRONG
#134 PRO HA     135 TYR HN     3.30
 134 PRO HB3    135 TYR HN     3.30
 134 PRO HG2    135 TYR QD     5.00
 134 PRO HG2    135 TYR QE     5.00
 134 PRO HG3    135 TYR HN     3.30
 134 PRO HG3    135 TYR QD     2.70
 134 PRO HG3    135 TYR QE     2.70
 134 PRO HG3    147 SER HA     5.00  #SD?
 134 PRO QD     135 TYR HN     3.30
 134 PRO QD     135 TYR QD     3.30
 134 PRO QD     135 TYR QE     5.00
 134 PRO HD2    147 SER HA     2.70
 134 PRO HD3    147 SER HA     2.70
 135 TYR HN     135 TYR QD     2.70  #side chain orientation
 135 TYR HB3    146 PHE HB2    5.00
#135 TYR HB3    146 PHE HB3    5.00  #SD 6A
 135 TYR HB3    152 LEU HB2    5.00
 135 TYR HB3    152 LEU QD2    3.30  #rlx 15jul4
#135 TYR HB3    152 LEU QD1    5.00  #SD
#135 TYR HB2    136 GLU- HN    3.30  #removed 10nov3
 135 TYR HB2    146 PHE HB2    3.30  #W-M
 135 TYR HB2    146 PHE HB3    5.00
 135 TYR HB2    148 LEU HN     5.00  #weak and partially overlapped
#135 TYR HB2    152 LEU HB2    5.00  #SD weak
 135 TYR HB2    152 LEU QD2    3.30  #rlx 7jul4
#135 TYR HB2    152 LEU QD1    5.00  #SD
 135 TYR QD     147 SER HA     3.30
 135 TYR QD     148 LEU HA     5.00
#135 TYR QD     148 LEU QD2    5.00  #WRONG due to overlap 152.qdWEAK 3DC
 135 TYR QD     149 PRO HA     5.00
 135 TYR QD     152 LEU QD2    2.70  #STRONG
#135 TYR QD     152 LEU QD1    5.00  #SD
 135 TYR QE     147 SER HA     5.00    
 135 TYR QE     148 LEU HA     2.70
 135 TYR QE     148 LEU QD1    5.00  #WEAK
 135 TYR QE     148 LEU QD2    3.30  #CONFIRMED 3DC
 135 TYR QE     149 PRO HA     5.00
 135 TYR QE     149 PRO HB2    5.00
 135 TYR QE     149 PRO HB3    5.00
 135 TYR QE     149 PRO HG2    5.00
 135 TYR QE     149 PRO HG3    3.30
 135 TYR QE     149 PRO HD2    5.00 #rlx 30aug4
 135 TYR QE     149 PRO HD3    2.70
 135 TYR QE     152 LEU QD2    5.00
 136 GLU- HN    152 LEU QD2    3.30
 136 GLU- HN    152 LEU QD1    5.00
 136 GLU- HA    145 ARG+ HB2   3.30
 136 GLU- HA    145 ARG+ HB3   5.00
 136 GLU- HA    145 ARG+ HG2   5.00
 136 GLU- HA    145 ARG+ HG3   3.30  #loosened
 136 GLU- HB2   145 ARG+ HA    5.00
 136 GLU- HB3   145 ARG+ HA    5.00
 137 CYSZ HN    137 CYSZ HB2   2.70
 137 CYSZ HN    137 CYSZ HB3   2.70
 137 CYSZ HN    145 ARG+ HG3   5.00
 137 CYSZ HN    146 PHE QD     5.00  #relax 11nov3
 137 CYSZ HN    146 PHE QE     3.30
 137 CYSZ HN    152 LEU QD1    3.30
 137 CYSZ HA    138 PRO HD2    2.70
 137 CYSZ HA    138 PRO HD3    2.70
 137 CYSZ HA    152 LEU QD1    2.70
 137 CYSZ HA    152 LEU QD2    5.00
 137 CYSZ HB3   144 LYS+ HN    3.30
 137 CYSZ HB3   144 LYS+ HB2   5.00
#137 CYSZ HB3   144 LYS+ HB3   5.00  #weak
 137 CYSZ HB3   146 PHE QD     5.00
 137 CYSZ HB3   152 LEU QD1    5.00
 137 CYSZ HB3   155 HIS HD2    5.00  #weak
 137 CYSZ HB2   144 LYS+ HN    5.00
 137 CYSZ HB2   144 LYS+ HB2   5.00
#137 CYSZ HB2   144 LYS+ HB3   5.00  #weak
 137 CYSZ HB2   146 PHE QD     5.00
 137 CYSZ HB2   152 LEU QD1    3.30
 137 CYSZ HB2   155 HIS HD2    3.30
 138 PRO HA     139 HIS HN     3.30
 138 PRO HD2    139 HIS HN     3.30
 138 PRO HD2    152 LEU QD1    3.30
 138 PRO HD2    152 LEU QD2    5.00
#138 PRO HD3    139 HIS HN     5.00  #overlap 139.ha
 138 PRO HD3    152 LEU QD1    3.30
 138 PRO HD3    152 LEU QD2    5.00
 139 HIS HN     142 CYS- HB3   3.30
 139 HIS HN     142 CYS- HB2   5.00
 139 HIS HN     159 HIS HD2    5.00
 139 HIS HA     140 GLU- HN    2.70  #STRONG
 139 HIS QB     142 CYS- HB3   2.70
 139 HIS QB     142 CYS- HB2   3.30
 139 HIS QB     159 HIS HD2    5.00
 139 HIS QB     159 HIS HE1    5.00
 140 GLU- HA    141 GLY HN     2.70  #Type I turn 2.2
 140 GLU- HA    142 CYS- HN    4.00  #Type I turn 3.6
 141 GLY HN     142 CYS- HN    2.70  #Type I turn 2.4
 142 CYS- HN    142 CYS- HB2   2.70
 142 CYS- HN    142 CYS- HB3   2.70
#142 CYS- HN    143 ASP- HN    5.00  #loosened
 142 CYS- HA    143 ASP- HN    2.70  #tightened
 142 CYS- HA    144 LYS+ HN    4.00  #relax 10nov3 tighten 24nov3
#142 CYS- HB3   143 ASP- HN    3.30  #defer to HA
 142 CYS- HB3   144 LYS+ HN    5.00  #overlap
 142 CYS- HB3   159 HIS HE1    5.00
#142 CYS- HB2   143 ASP- HN    3.30  #defer to HA
 142 CYS- HB2   144 LYS+ HN    5.00
 142 CYS- HB2   159 HIS HE1    3.30  #M-W
 143 ASP- HN    144 LYS+ HN    2.70  #relax to fix 143phi tighten 24nov3
#144 LYS+ HN    146 PHE QE     5.00  #SD
 144 LYS+ HB2   146 PHE QE     5.00  #W-M
 144 LYS+ HB2   146 PHE HZ     5.00
 144 LYS+ HB3   146 PHE QE     5.00
 144 LYS+ HB3   146 PHE HZ     3.30
 144 LYS+ QG    155 HIS HD1    5.00  #WEAK
 144 LYS+ QG    155 HIS HE1    3.30
 144 LYS+ HD3   155 HIS HE1    5.00  #W-S
 145 ARG+ HN    146 PHE QE     5.00
 145 ARG+ HA    146 PHE QD     5.00
 145 ARG+ HG3   146 PHE HN     5.00  
 146 PHE HN     146 PHE QD     2.70
 146 PHE HB2    148 LEU HN     3.30
#146 PHE HB2    151 ARG+ HB3   5.00  #SD
 146 PHE HB2    152 LEU HN     3.30  #tighten 10dec3
 146 PHE HB3    148 LEU HN     3.30
 146 PHE HB3    151 ARG+ HB2   5.00
 146 PHE HB3    151 ARG+ HB3   3.30
 146 PHE HB3    152 LEU HB2    5.00
 146 PHE HB3    152 LEU QD1    5.00
 146 PHE QD     152 LEU HA     5.00  #W
 146 PHE QD     151 ARG+ QB    3.30  #151.hb3 overlaps 121.hb3
 146 PHE QD     152 LEU QD1    3.30
 146 PHE QE     137 CYSZ HB2   5.00
 146 PHE QE     152 LEU QD1    5.00
 146 PHE QE     155 HIS HB2    5.00
 146 PHE HZ     155 HIS HB3    3.30  #M-W
 146 PHE QE     155 HIS HD2    3.30
 146 PHE QE     152 LEU HA     3.30  #M-W
 147 SER HN     148 LEU HN     2.70
#147 SER HA     148 LEU HN     3.30  #H2O overlap remove 13nov3
 148 LEU HN     152 LEU HN     5.00  #add 10dec3
 148 LEU HA     148 LEU QD2    2.70  #SIDECHAIN 3DC
 148 LEU HA     149 PRO HD2    2.70  #trans Pro CONFIRMED 3DC
 148 LEU HA     149 PRO HD3    2.70  #trans Pro CONFIRMED 3DC
#148 LEU HG     149 PRO HD2    3.30  #N.O. 3DC
 148 LEU QD2    149 PRO HD2    2.70  #CONFIRMED 3DC
 148 LEU QD2    149 PRO HD3    3.30  #CONFIRMED 3DC
 148 LEU QD1    149 PRO HD2    3.30  #MEDIUM
 148 LEU QD1    149 PRO HD3    5.00  #WEAK
 148 LEU HN     151 ARG+ QB    3.30
 149 PRO HA     152 LEU QD2    3.30
#149 PRO HA     152 LEU QD1    5.00  #SD
 152 LEU HA     155 HIS HD2    5.00  #weak
 152 LEU HB3    153 LYS+ HN    2.70
 152 LEU QD1    155 HIS HD2    2.70
 152 LEU QD1    153 LYS+ HN    5.00
 152 LEU QD1    156 GLU- HN    5.00
 152 LEU QD2    153 LYS+ HN    5.00  #relax 10nov3
 155 HIS HA     158 VAL QG1    5.00  #8jul4
 155 HIS HA     158 VAL QG2    3.30  #8jul4
 155 HIS HD1    158 VAL QG1    5.00  #WEAK-MEDIUM
 155 HIS HD1    158 VAL QG2    5.00  #WEAK-MEDIUM
 155 HIS HD2    156 GLU- HA    3.30
 155 HIS HD2    156 GLU- HG2   5.00
 155 HIS HD2    156 GLU- HG3   5.00
 155 HIS HD2    159 HIS HD2    5.00
 155 HIS HE1    158 VAL QG1    3.30  #7jul4
 155 HIS HE1    158 VAL QG2    3.30  #7jul4
 156 GLU- HA    159 HIS HD2    2.70
 156 GLU- QB    159 HIS HD2    5.00
 156 GLU- HG3   159 HIS HD2    5.00
 158 VAL HA     159 HIS HA     5.00
 158 VAL HB     159 HIS HN     3.30  #7jul4
 158 VAL HB     160 ALA HN     5.00  #7jul4
 158 VAL QG1    159 HIS HD2    5.00  #7jul4
 158 VAL QG2    159 HIS HD2    6.00  #7jul4
 158 VAL QG1    159 HIS HE1    5.00  #7jul4
 158 VAL QG2    159 HIS HE1    6.00  #7jul4

#========================================
# InterFinger NOEs Zinc Fingers 5 to 6
#========================================
 158 VAL HN     162 TYR HH     5.00  #VERY WEAK
 158 VAL HA     162 TYR QE     5.00  #WEAK-MEDIUM
 158 VAL HA     162 TYR HH     3.30  #MEDIUM OVERLAP 161.ha2
 158 VAL QG1    162 TYR QE     5.00  #WEAK
 158 VAL QG1    162 TYR HH     5.00  #MEDIUM
 158 VAL QG2    176 THR HB     5.00  #WEAK
 158 VAL QG2    176 THR QG2    2.70  #MEDIUM-WEAK adj 30aug4
 158 VAL QG2    162 TYR QE     3.30  #MEDIUM
 158 VAL QG2    162 TYR HH     3.30  #MEDIUM
#158 VAL QG2    178 THR HA     5.00  #WEAK OVERLAP 179.qd2
#158 VAL QG2    178 THR HB     5.00  #WEAK OVERLAP 179.qd2
#158 VAL QG2    178 THR QG2    3.30  #MEDIUM OVERLAP 179.qd2
#160 ALA QB     173 VAL QG2    5.00  #WEAK SD?
#161 GLY HN     173 VAL QG1    5.00  #MEDIUM rlx 3jun4 rm 16jun4
 161 GLY HA2    162 TYR HN     2.70  #USELESS
 161 GLY HA2    162 TYR QE     5.00  #WEAK
 161 GLY HA2    173 VAL QG1    3.30  #MEDIUM
 161 GLY HA2    175 LYS+ HA    5.00
 161 GLY HA3    162 TYR HN     2.70  #USELESS
 161 GLY HA3    162 TYR QE     5.00  #WEAK
 161 GLY HA3    173 VAL QG1    3.30  #MEDIUM adj 16jun4
 161 GLY HA3    173 VAL QG2    5.00  #WEAK adj 16jun4
#161 GLY HA3    175 LYS+ HA    5.00  #VERY WEAK

#========================================
# ZINC FINGER 6
#----------------------------------------
# Beta Sheet 
#  >-Y162-P163-C164->
#  <-G174-V173-F172-<
#------------------------------anti--para
#--Ha(i)->HN(i+1)--------------2.20--2.20
 162 TYR HA     163 PRO QD     2.70  #CONFIRMED trans Pro
 163 PRO HA     164 CYSZ HN    2.70  #CONFIRMED
 172 PHE HA     173 VAL HN     2.70  #CONFIRMED
 173 VAL HA     174 GLY HN     2.70  #CONFIRMED
#--Ha(i)->Ha(j)--cross-sheet---2.30--4.80
 163 PRO HA     173 VAL HA     2.70  #CONFIRMED
#165 LYS+ HA    171 SER HA     2.70  #OVERLAP
#--Ha(i)->HN(j+1)--cross-sheet-3.20--3.00
 163 PRO HA     174 GLY HN     3.30  #CONFIRMED
#165 LYS+ HA    172 PHE HN     3.30  #OVERLAP 171.ha
 173 VAL HA     164 CYSZ HN    3.30  #CONFIRMED
#--Ha(i)->HN(j-1)--cross-sheet-
#--HN(i)->HN(j)--cross-sheet---3.30--4.00
 162 TYR HN     174 GLY HN     3.50  #CONFIRMED
#164 CYSZ HN    172 PHE HN     3.50  #WEAK
#****************************************
#--HBONDS--cross-sheet
#****************************************
#162 TYR HN     174 GLY O      2.00  #
#162 TYR N      174 GLY O      3.00  #
 164 CYSZ HN    172 PHE O      2.00  #
 164 CYSZ N     172 PHE O      3.00  #
#172 PHE HN     164 CYSZ O     2.00  #missing 164.hn->172.hn
#172 PHE N      164 CYSZ O     3.00  #  and 165.ha->172.hn
 174 GLY HN     162 TYR O      2.00  #missing 164.hn->172.hn
 174 GLY N      162 TYR O      3.00  #but have 164.hn->173.ha
#----------------------------------------
# Alpha Helix
#    >-W177--L181--A185--Q189-D190.
#        T178--K182--E186
#          L179--H183--C187
#                     Zn
#            Y180--V184--H188
#------------------------------alph--3-10
#--HN(i)->HN(i+1)--------------2.80--2.60
 177 TRP HN     178 THR HN     3.00
 178 THR HN     179 LEU HN     3.00
 179 LEU HN     180 TYR HN     3.00
 180 TYR HN     181 LEU HN     3.00
 181 LEU HN     182 LYS+ HN    3.00
 182 LYS+ HN    183 HIS HN     3.00
 183 HIS HN     184 VAL HN     3.00
 184 VAL HN     185 ALA HN     3.00
 185 ALA HN     186 GLU- HN    3.00
 186 GLU- HN    187 CYS HN     3.00
 187 CYS HN     188 HIS HN     3.00
 188 HIS HN     189 GLN HN     3.00
#189 GLN HN     190 ASP- HN    3.00  #???
#--HN(i)->HN(i+2)--------------4.20--4.10
 177 TRP HN     179 LEU HN     5.00
#178 THR HN     180 TYR HN     5.00  #???
#179 LEU HN     181 LEU HN     5.00  #???
#180 TYR HN     182 LYS+ HN    5.00  #???
 181 LEU HN     183 HIS HN     5.00
#182 LYS+ HN    184 VAL HN     5.00  #???
#183 HIS HN     185 ALA HN     5.00  #???
#184 VAL HN     186 GLU- HN    5.00  #???
 185 ALA HN     187 CYS HN     5.00
#186 GLU- HN    188 HIS HN     5.00  #???
 187 CYS HN     189 GLN HN     5.00
#188 HIS HN     190 ASP- HN    5.00  #???
#--Ha(i)->HN(i+2)--------------4.40--3.80
#177 TRP HA     179 LEU HN     5.00  #???
#178 THR HA     180 TYR HN     5.00
 179 LEU HA     181 LEU HN     5.00
 180 TYR HA     182 LYS+ HN    5.00
 181 LEU HA     183 HIS HN     5.00  #overlap 183.hb2
#182 LYS+ HA    184 VAL HN     5.00  #???
#183 HIS HA     185 ALA HN     5.00  #???
 184 VAL HA     186 GLU- HN    5.00
#185 ALA HA     187 CYS HN     5.00  #???
 186 GLU- HA    188 HIS HN     5.00  #???
#187 CYS HA     189 GLN HN     5.00  #NO
#188 HIS HA     190 ASP- HN    5.00
#--Ha(i)->HN(i+3)--------------3.40--3.30
 177 TRP HA     180 TYR HN     3.50
 178 THR HA     181 LEU HN     3.50
 179 LEU HA     182 LYS+ HN    3.50
 180 TYR HA     183 HIS HN     3.50
 181 LEU HA     184 VAL HN     3.50
#182 LYS+ HA    185 ALA HN     3.50  #???
#183 HIS HA     186 GLU- HN    3.50
#184 VAL HA     187 CYS HN     3.50  #NO
#185 ALA HA     188 HIS HN     3.50  #???
#186 GLU- HA    189 GLN HN     3.50  #NO
#187 CYS HA     190 ASP- HN    3.50  #???
#--Ha(i)->HN(i+4)--------------4.20
#177 TRP HA     181 LEU HN     5.00
 178 THR HA     182 LYS+ HN    5.00
 179 LEU HA     183 HIS HN     5.00
 180 TYR HA     184 VAL HN     5.00
 181 LEU HA     185 ALA HN     5.00
#182 LYS+ HA    186 GLU- HN    5.00  #???
#183 HIS HA     187 CYS HN     5.00  #???
 184 VAL HA     188 HIS HN     5.00  #MEDIUM
 185 ALA HA     189 GLN HN     5.00  #???
#186 GLU- HA    190 ASP- HN    5.00  #NO
#--Ha(i)->Hb(i+3)--------------2.5-4.4--3.1-5.1
 177 TRP HA     180 TYR QB     3.30
 178 THR HA     181 LEU HB2    2.70
 178 THR HA     181 LEU HB3    5.00  #med-weak rlx 9jul4
 179 LEU HA     182 LYS+ QB    3.30
 180 TYR HA     183 HIS HB3    3.30
 181 LEU HA     184 VAL HB     3.30
 182 LYS+ HA    185 ALA QB     3.30
#183 HIS HA     186 GLU- QB    3.30  #NO
#184 VAL HA     187 CYS QB     3.30  #NO
#185 ALA HA     188 HIS QB     3.30  #NO
#186 GLU- HA    189 GLN QB     3.30  #???
#187 CYS HA     190 ASP- QB    3.30  #NO
#****************************************
#--HBONDS--alpha-helix
#****************************************
#180 TYR HN     176 THR O      2.00  #???
#180 TYR N      176 THR O      3.00  #???
 181 LEU HN     177 TRP O      2.00
 181 LEU N      177 TRP O      3.00
 182 LYS+ HN    178 THR O      2.00
 182 LYS+ N     178 THR O      3.00
 183 HIS HN     179 LEU O      2.00
 183 HIS N      179 LEU O      3.00
#184 VAL HN     180 TYR O      2.00
#184 VAL N      180 TYR O      3.00
#185 ALA HN     181 LEU O      2.00
#185 ALA N      181 LEU O      3.00
#186 GLU- HN    182 LYS+ O     2.00  #???
#186 GLU- N     182 LYS+ O     3.00  #???
#187 CYS HN     183 HIS O      2.00  #NO
#187 CYS N      183 HIS O      3.00  #NO
#188 HIS HN     184 VAL O      2.00  #NO
#188 HIS N      184 VAL O      3.00  #NO
#189 GLN HN     185 ALA O      2.00  #NO
#189 GLN N      185 ALA O      3.00  #NO
#190 ASP- HN    186 GLU- O     2.00  #???
#190 ASP- N     186 GLU- O     3.00  #???
#----------------------------------------
# Zinc Ligands
#    C164    H183
#         Zn
#    C170    H188
#----------------------------------------
 164 CYSZ ZN    164 CYSZ SG    2.35
 164 CYSZ ZN    164 CYSZ CB    3.41
 164 CYSZ ZN    170 CYS- SG    2.35
 164 CYSZ ZN    170 CYS- CB    3.41
 164 CYSZ ZN    183 HIS NE2    2.05
 164 CYSZ ZN    188 HIS NE2    2.05
#========================================
# Long Range NOEs Zinc Finger 6
#========================================
 162 TYR HN     162 TYR QD     2.70
 162 TYR HN     162 TYR QE     5.00
 162 TYR HN     172 PHE QE     5.00  #WEAK
 162 TYR HN     173 VAL QG1    3.30
 162 TYR HN     175 LYS+ HA    5.00  #weak
 162 TYR HB3    180 TYR QB     5.00
 162 TYR HB3    180 TYR QD     5.00
 162 TYR HB2    174 GLY HN     5.00  #?SD
 162 TYR HB2    180 TYR QB     5.00
#162 TYR QD     163 PRO QD     5.00  #VERY WEAK
#162 TYR QD     175 LYS+ HN    5.00  #BAD ORIENTATION
 162 TYR QD     175 LYS+ HA    5.00
 162 TYR QD     176 THR HN     3.30  #MEDIUM 
 162 TYR QD     177 TRP HA     5.00  #WEAK-MEDIUM
 162 TYR QE     176 THR HA     2.70
 162 TYR QE     177 TRP HN     3.30  #MEDIUM
 162 TYR QE     177 TRP HA     5.00
 162 TYR QE     177 TRP HB2    5.00
 162 TYR HH     176 THR HA     5.00  #WEAK-MEDIUM 5sa46gnoesy80288
 162 TYR HH     177 TRP HN     5.00  #WEAK
 162 TYR HH     177 TRP HD1    6.00  #VERY-WEAK
 163 PRO HA     173 VAL QG1    3.30
 163 PRO HA     173 VAL QG2    2.70
 163 PRO HB2    173 VAL HA     5.00
 163 PRO HB2    173 VAL QG1    5.00  #weak
 163 PRO HB2    173 VAL QG2    3.30
 163 PRO HB3    173 VAL HA     5.00
 163 PRO HB3    173 VAL QG1    5.00  #weak
 163 PRO HB3    173 VAL QG2    5.00
 163 PRO HG3    173 VAL QG1    5.00
 163 PRO HG3    173 VAL QG2    5.00
 163 PRO QD     173 VAL QG1    5.00  #HD3?
 164 CYSZ HN    164 CYSZ HB2   2.70  #chi-1
 164 CYSZ HN    164 CYSZ HB3   2.70  #chi-1
 164 CYSZ HN    172 PHE HB3    5.00
 164 CYSZ HN    172 PHE QD     3.30  #CNFD 5sa46gnon3d80.nv 17jun4
 164 CYSZ HN    172 PHE QE     6.00  #5sa46gnon3d80.nv 17jun4
 164 CYSZ HN    173 VAL QG2    3.30
 164 CYSZ HA    165 LYS+ HN    2.70
 164 CYSZ HA    166 LYS+ HN    3.30
 164 CYSZ HA    180 TYR QE     2.70
 164 CYSZ HA    184 VAL QG1    5.00  #overlap?
 164 CYSZ HA    184 VAL QG2    5.00  #overlap?
 164 CYSZ HB2   172 PHE HN     5.00  
 164 CYSZ HB2   172 PHE HB3    5.00
 164 CYSZ HB3   167 ASP- HN    5.00  #8jul4
 164 CYSZ HB3   172 PHE HN     5.00
 164 CYSZ HB3   172 PHE HB3    3.30
 164 CYSZ HB3   172 PHE HD1    3.30
 164 CYSZ HB3   183 HIS HD2    5.00
 165 LYS+ HN    166 LYS+ HN    3.30
 165 LYS+ HN    167 ASP- HN    5.00  #8jul4
 165 LYS+ HN    180 TYR QD     6.00  #5sa46gnon3d80.nv 17jun4
 165 LYS+ HN    180 TYR QE     3.30  #CNFD 5sa46gnon3d80.nv 17jun4
 165 LYS+ HA    167 ASP- HN    3.30  #overlap 8jul4
 166 LYS+ HN    167 ASP- HN    2.70  #CNFD 5sa46gnon3d80.nv 17jun4 adj 8jul4
 166 LYS+ HN    180 TYR QE     5.00  #CNFD 5sa46gnon3d80.nv 17jun4
 166 LYS+ HN    188 HIS HD2    5.00  #5sa46gnon3d80.nv 17jun4
 166 LYS+ HN    188 HIS HE1    5.00  #5sa46gnon3d80.nv 17jun4
 166 LYS+ HB3   188 HIS HD2    5.00
 166 LYS+ HG2   184 VAL QG1    3.30
 166 LYS+ HG2   184 VAL QG2    3.30
 166 LYS+ HG2   188 HIS HD2    5.00
 166 LYS+ HG3   184 VAL HA     5.00
 166 LYS+ HG3   184 VAL QG1    3.30
 166 LYS+ HG3   184 VAL QG2    3.30
 166 LYS+ HG3   188 HIS HD2    3.30
 166 LYS+ QD    184 VAL HA     5.00
 166 LYS+ QD    184 VAL QG1    3.30
 166 LYS+ QD    184 VAL QG2    3.30
 166 LYS+ QE    184 VAL QG1    3.30
 166 LYS+ QE    184 VAL QG2    3.30
 167 ASP- HN    168 ASP- HA    5.00  #add 16jul4
 167 ASP- HN    170 CYS- HN    5.00  #rm 17jun4 add 14jul4
 167 ASP- HN    170 CYS- HB2   5.00
 167 ASP- HN    170 CYS- HB3   3.30  #adj 16jul4
 167 ASP- HN    188 HIS HE1    5.00  #5sa46gnon3d80.nv 17jun4
 167 ASP- HA    168 ASP- HN    2.70  #5sa46gnon3d80.nv 17jun4
 167 ASP- QB    169 SER HN     5.00  #evidence for Type I
 167 ASP- QB    170 CYS- HN    5.00  #rlx 16jul4
 167 ASP- QB    170 CYS- HB2   3.30
 167 ASP- QB    170 CYS- HB3   3.30
 167 ASP- QB    188 HIS HE1    2.70  #med-weak adj 16jul4
 168 ASP- HN    169 SER HN     2.70  #Type I turn 2.6 OVERLAP
#168 ASP- HN    170 CYS- HN    5.00  #Type I turn add WEAK 17jun4 rm 14jul4
 168 ASP- HA    170 CYS- HN    5.00  #Type I turn 3.6 OVERLAP
 169 SER HN     170 CYS- HN    2.70  #Type I turn 2.4
 169 SER HN     170 CYS- HB2   5.00
 169 SER HN     170 CYS- HB3   5.00
 170 CYS- HN    170 CYS- HB2   2.70  #chi-1
 170 CYS- HN    170 CYS- HB3   2.70  #chi-1
 170 CYS- HA    171 SER HN     2.70
 170 CYS- HB3   188 HIS HE1    3.30  #med-weak
 171 SER HN     172 PHE HN     2.70  #HN-S bond adj 17jun4
 172 PHE HN     172 PHE HB2    2.70  #chi-1
 172 PHE HN     172 PHE HB3    2.70  #chi-1
 172 PHE HB2    183 HIS HE1    3.30  #med-weak
 172 PHE HB3    183 HIS HD2    5.00
 172 PHE HB3    183 HIS HE1    5.00
 172 PHE QD     173 VAL HN     3.30  #MEDIUM
 172 PHE QD     174 GLY HN     5.00
 172 PHE QE     173 VAL HN     5.00  #WEAK
 172 PHE QE     174 GLY HN     3.30  #MEDIUM
 172 PHE QE     174 GLY HA2    3.30
 172 PHE QE     174 GLY HA3    3.30
 172 PHE QE     180 TYR HA     2.70
 172 PHE QE     180 TYR QD     5.00
 172 PHE QE     183 HIS HB3    3.30
 172 PHE QE     183 HIS HB2    5.00
 172 PHE HZ     174 GLY HA2    3.30  #med-weak
 172 PHE HZ     174 GLY HA3    3.30  #med-weak
 172 PHE HZ     179 LEU HB3    3.30  #med-weak
 172 PHE HZ     180 TYR HA     3.30  #med-weak
 172 PHE HZ     183 HIS HB3    5.00  
 172 PHE HZ     183 HIS HB2    5.00  #maybe med
 173 VAL HN     173 VAL HB     2.70
 173 VAL HN     173 VAL QG1    5.00
 173 VAL HN     173 VAL QG2    3.30
 173 VAL QG1    174 GLY HN     3.30
 173 VAL QG2    174 GLY HN     5.00
 174 GLY HN     174 GLY HA3    2.70  #orientation
 174 GLY HN     180 TYR QB     5.00  #?SD
 174 GLY HN     180 TYR QD     5.00  #?SD
 174 GLY HA2    175 LYS+ HN    2.70
 174 GLY HA2    176 THR HN     3.30
#174 GLY HA2    180 TYR QB     5.00
 174 GLY HA3    175 LYS+ HN    3.30
 174 GLY HA3    180 TYR QB     5.00  #weak-med
 175 LYS+ HN    176 THR HN     3.30  #med-strong
 175 LYS+ HN    179 LEU QD1    3.30
 176 THR HN     176 THR HG1    3.30  #25jun4
 176 THR HN     179 LEU HN     5.00  #med-weak rlx 15jul4
 176 THR HN     179 LEU HB2    2.70
 176 THR HN     179 LEU HB3    3.30
 176 THR HN     179 LEU HG     3.30
 176 THR HN     179 LEU QD1    3.30
 176 THR HN     180 TYR HN     5.00  #25jun4 rlx 7jul4
 176 THR HA     177 TRP HN     2.70  #25jun4
 176 THR HB     177 TRP HN     3.30  #25jun4
 176 THR HB     178 THR HN     5.00  #25jun4
 176 THR HB     178 THR QG2    5.00  #WEAK
 176 THR HB     179 LEU HN     5.00  #25jun4
 176 THR HG1    178 THR QG2    5.00  #MEDIUM 5sa46gnoesy80288.nv 23jun4 rlx 14jul4
 176 THR HG1    179 LEU HN     2.70  #25jun4
 176 THR HG1    179 LEU HG     3.30  #MEDIUM 5sa46gnoesy80288.nv 23jun4
 176 THR HG1    179 LEU QD1    3.30  #MEDIUM 5sa46gnoesy80288.nv 23jun4
 176 THR HG1    179 LEU QD2    5.00  #WEAK 5sa46gnoesy80288.nv 23jun4
#176 THR QG2    178 THR QG2    5.00  #WEAK overlap 179.qd2
 177 TRP HA     177 TRP HE3    2.70  #chi-2
 177 TRP HA     180 TYR QD     5.00
 177 TRP HB3    177 TRP HD1    2.70  #chi-2
 177 TRP HB3    178 THR HN     2.70  #CONFIRMED MEDIUM-WEAK chi-1
 177 TRP HD1    178 THR QG2    5.00  #8jul4
 177 TRP HD1    181 LEU QD1    3.30  #MEDIUM_STRONG 5sa46gnoesy80288.nv 27may4 rlx 7jul4
 177 TRP HD1    181 LEU QD2    6.00  #WEAK 5sa46gnoesy80288.nv 27may4 rlx 9jul4
 177 TRP HE1    181 LEU QD1    3.30  #MEDIUM_STRONG 5sa46gnoesy80288.nv 27may4 rlx 20jul4
 177 TRP HE1    181 LEU QD2    6.00  #WEAK 5sa46gnoesy80288.nv 27may4 rlx 20jul4
 177 TRP HZ2    181 LEU QD1    5.00  #WEAK 5sa46gnoesy80288.nv 27may4
 177 TRP HZ2    181 LEU QD2    3.30  #MEDIUM_STRONG 5sa46gnoesy80288.nv 27may4 rlx 20jul4
 177 TRP HH2    181 LEU QD1    5.00  #WEAK 5sa46gnoesy80288.nv 27may4
 177 TRP HH2    181 LEU QD2    3.30  #MEDIUM_STRONG 5sa46gnoesy80288.nv 27may4 rlx 20jul4
 177 TRP HZ3    181 LEU QD1    5.00
 177 TRP HZ3    181 LEU QD2    5.00  #rlx 20jul4
 178 THR HA     181 LEU HG     5.00
 178 THR HA     181 LEU QD1    3.30  #MEDIUM
#178 THR HA     181 LEU QD2    5.00  #WEAK S.D.
 178 THR QG2    181 LEU QD1    5.00  #WEAK
 179 LEU HN     179 LEU HG     2.70
 179 LEU HA     179 LEU QD2    2.70  #chi-2
 180 TYR HN     180 TYR QD     5.00
 180 TYR HA     180 TYR QD     2.70
 180 TYR QD     181 LEU HN     5.00
 180 TYR QD     181 LEU HA     5.00
 180 TYR QD     181 LEU HG     5.00
 180 TYR QD     181 LEU QD1    5.00
 180 TYR QD     181 LEU QD2    3.30
 180 TYR QE     181 LEU QD2    3.30
 180 TYR QE     184 VAL QG1    5.00
 180 TYR QE     184 VAL QG2    2.70  #SD?
 181 LEU HN     181 LEU HB2    2.70  #chi-1
 181 LEU HN     181 LEU HG     2.70  #chi-2
 181 LEU HA     181 LEU QD2    2.70  #chi-2
 181 LEU HA     184 VAL QG1    3.30
 181 LEU HB2    182 LYS+ HN    2.70
 181 LEU HB3    182 LYS+ HN    3.30
 181 LEU QD2    184 VAL HB     5.00  #weak
#181 LEU QD2    184 VAL QG1    5.00  #overlap
 182 LYS+ HG2   185 ALA QB     5.00  #?????????????
 183 HIS HN     183 HIS HB3    2.70  #chi-1
 183 HIS HN     183 HIS HB2    2.70  #chi-1
 183 HIS HN     183 HIS HD2    5.00
 183 HIS HA     183 HIS HB2    2.70  #chi-1
 183 HIS HB3    183 HIS HD2    2.70  #chi-2
 183 HIS HB3    184 VAL HN     2.70  #chi-1
 183 HIS HD1    187 CYS HB3    5.00  #WEAK
 183 HIS HD2    184 VAL HN     3.30
 183 HIS HD2    184 VAL HA     5.00  #weak
 183 HIS HD2    184 VAL QG1    5.00
 183 HIS HD2    184 VAL QG2    3.30
 183 HIS HD2    188 HIS HD2    3.30
 184 VAL HN     184 VAL QG1    2.70
#184 VAL HN     188 HIS HN     5.00  #weird rm 9jul4
 184 VAL HA     188 HIS HB2    5.00
 184 VAL HA     188 HIS HB3    3.30  #WEIRD!!!!!
 184 VAL HA     188 HIS HD2    2.70  #STRONG!!!!
 184 VAL HB     185 ALA HN     2.70  #chi-1
 184 VAL QG1    188 HIS HD2    2.70
 184 VAL QG1    185 ALA HA     3.30
 184 VAL QG1    188 HIS HB2    5.00
 184 VAL QG1    188 HIS HB3    3.30
 184 VAL QG1    188 HIS HD2    2.70
 184 VAL QG2    185 ALA HA     5.00
 185 ALA HN     188 HIS HD2    6.00  #rlx 9jul4
 185 ALA HA     189 GLN QG     5.00
 187 CYS HN     188 HIS HD2    5.00
 187 CYS HB2    188 HIS HD2    5.00
 187 CYS HB3    188 HIS HD2    3.30
 188 HIS HN     188 HIS HD2    3.30

#========================================
#-TFIIIA and 5S rRNA 
#-Intermolecular Restraints
#-Ramped during Docking
#-Multistep Annealing Protocol
#--1 annealing with all intra-molecular restraints active
#--2 heating to 400K all intra-molecular restraints active
#--3 cooling to 0K with docking restraints force constant ramped from 0.1 to 10 kcal/molA2 
#-   docking distance at 10A and interfinger and lys/arg restraints removed 
#--4 heating to 400K with all preceding restraints no ramping
#--5 cooling to 0K with docking restraints force constant ramped from 1.0 to 20.0 kcal/molA2
#-   docking distance ramped from 10.0A to final values and interfinger and lys/arg restraints removed 
#--6 heating to 400K with all preceding restraints no ramping
#--7 cooling to 0K with docking restraints force constant ramped from 1.0 to 20.0 kcal/molA2
#-   docking distance at final values and interfinger and lys/arg restraints removed
#--8 heating to 400K with all preceding restraints no ramping
#--9 cooling to 0K with docking restraints force constant ramped from 1.0 to 20.0 kcal/molA2
#-   docking distance and lys/arg restraints at final values and interfinger restraints removed
#-10 heating to 400K with all preceding restraints no ramping
#-11 cooling to 0K with docking restraints force constant ramped from 1.0 to 30.0 kcal/molA2
#-   docking distance and lys/arg restraints and interfinger restraints at final values
#-12 minimize with rdc restraints active to calculate alignment tensor
#-13 heating to 400K with all preceding restraints no ramping and no rdc restraints
#-14 cooling to 200K with all restraints active at force constant 30.0 kcal/molA2
#-   rdc restraints at 10% of final weight
#-15 cooling to 0K with all restraints active at force constant 30.0 kcal/molA2
#-   rdc restraints at 100% of final weight
#-16 heating to 400K with all preceding restraints no ramping and no rdc restraints
#-17 cooling to 200K with all restraints active at force constant 30.0 kcal/molA2
#-   rdc restraints at 10% of final weight
#-18 cooling to 0K with all restraints active at force constant 30.0 kcal/molA2
#-   rdc restraints at 100% of final weight
#-19 minimize with rdc restraints active to calculate alignment tensor
#-20 minimize with all restraints and no rdcs
#==================================================================================
 105 TYR QD      26 RGUA H8    3.30  #MEDIUM new 7nov3 relax 10nov3 tighten 2dec3
 105 TYR QD      26 RGUA H2'   3.30  #MEDIUM new 2dec3 rlx 9dec3 adj 30aug4
 105 TYR QD      26 RGUA H3'   5.00  #MEDIUM new 2dec3
#105 TYR QE      25 RADE H2    6.00  #WEAK 3DEF remove 8nov3
#105 TYR QE      26 RGUA H1    2.70  #STRONG WRONG!!! typo?
 105 TYR QE      26 RGUA H8    2.70  #STRONG new 7nov3
 105 TYR QE      26 RGUA H1'   5.00  #WEAK new 2dec3
 105 TYR QE      26 RGUA H2'   2.70  #STRONG new 12nov3
 105 TYR QE      26 RGUA H3'   3.30  #WEAK new 12nov3 tighten 2dec3
#117 LYS+ QB     25 RADE H2    5.00  #WEAK 3DEF remove 8nov3
 117 LYS+ QG     25 RADE H2    5.00  #MEDIUM-WEAK 3DEF relax 8nov3
 117 LYS+ QD     25 RADE H2    5.00  #MEDIUM-WEAK 3DEF relax 8nov3
#117 LYS+ QE     24 URA H6     3.30  #MEDIUM guessing 8nov3 rm 9aug4
 117 LYS+ QE     25 RADE H2    5.00  #MEDIUM 3DEF relax 8nov3
 117 LYS+ QE     25 RADE H1'   5.00  #MEDIUM relax 8nov3
#117 LYS+ QE     26 RGUA H8    3.30  #MEDIUM remove 8nov3 maybe SD
#117 LYS+ QE     26 RGUA H1'   5.00  #WEAK SD? remove 8nov3
#118 LYS+ HA     25 RADE H2    5.00  #WEAK 3DEF SD? remove 8nov3
 118 LYS+ HA     26 RGUA H8    3.30  #MEDIUM add 24nov3
#118 LYS+ QB     25 RADE H2    5.00  #WEAK 3DEF 4D remove 8nov3
#118 LYS+ QB     26 RGUA H8    5.00  #WEAK remove 8nov3
 118 LYS+ HG2    25 RADE H2    5.00  #MEDIUM-WEAK 3DEF relax 8nov3
 118 LYS+ HG3    25 RADE H2    5.00  #MEDIUM-WEAK 3DEF relax 8nov3
#118 LYS+ HG2    26 RGUA H8    5.00  #WEAK remove 8nov3
#118 LYS+ HG3    26 RGUA H8    5.00  #WEAK remove 8nov3
 118 LYS+ HD2    25 RADE H2    3.30  #MEDIUM 3DEF relax 8nov3 tighten 24nov3
 118 LYS+ HD3    25 RADE H2    3.30  #STRONG-MEDIUM 3DEF relax 8nov3 tighten 24nov3
 118 LYS+ HD2    25 RADE H1'   5.00  #WEAK remove 8nov3 add 24nov3
 118 LYS+ HD3    25 RADE H1'   5.00  #WEAK remove 8nov3 add 24nov3
 118 LYS+ HD2    26 RGUA H8    5.00  #MEDIUM relax 8nov3
 118 LYS+ HD3    26 RGUA H8    5.00  #MEDIUM relax 8nov3
 118 LYS+ HE2    25 RADE H2    3.30  #STRONG 3DEF relax 8nov3 tighten 24nov3 relax 31mar4
 118 LYS+ HE3    25 RADE H2    3.30  #STRONG 3DEF relax 8nov3 tighten 24nov3 relax 31mar4
 118 LYS+ HE2    25 RADE H1'   2.70  #STRONG relax 8nov3 adj 27aug4
 118 LYS+ HE3    25 RADE H1'   2.70  #STRONG relax 8nov3 adj 27aug4
 118 LYS+ HE2    26 RGUA H8    5.00  #MEDIUM relax 8nov3 weak add 31mar4 adj 27aug4
 118 LYS+ HE3    26 RGUA H8    5.00  #MEDIUM relax 8nov3 weak add 31mar4 adj 27aug4
 118 LYS+ HE2    26 RGUA H1'   5.00  #WEAK-MEDIUM
 118 LYS+ HE3    26 RGUA H1'   5.00  #WEAK-MEDIUM
#118 LYS+ HE2    27 URA H5     5.00  #MEDIUM add 8nov3 relaxed rm 27aug4
#118 LYS+ HE3    27 URA H5     5.00  #MEDIUM add 8nov3 relaxed rm 27aug4
#118 LYS+ HE2    27 URA H6     5.00  #WEAK add 8nov3
#118 LYS+ HE3    27 URA H6     5.00  #WEAK add 8nov3
 119 HIS HN      26 RGUA H8    2.70  #STRONG rlx 8nov3 adj 12nov3 rlx 2dec3 adj 5aug4
 119 HIS HA      26 RGUA H8    5.00  #WEAK d5sa46hcno3d.nv 5aug4
 119 HIS HD2     26 RGUA H8    3.30  #MEDIUM relax 8nov3 tighten 11nov3
#119 HIS HD2     26 RGUA H1'   6.00  #VERY WEAK 2dec3
 119 HIS HD2     26 RGUA H2'   5.00  #WEAK 12nov3 tighten 2dec3
 119 HIS HD2     41 RGUA H1    6.00  #VERY WEAK 12nov3 rm 2dec3 add 30aug4
 119 HIS HE1     26 RGUA H1    5.00  #MEDIUM-WEAK relax 8nov3 remove 11nov3 add 13nov3
 119 HIS HE1     40 RGUA H8    5.00  #MEDIUM new 7nov3 rlx 27aug4
 119 HIS HE1     40 RGUA H2'   5.00  #MEDIUM 2dec3 rlx 27aug4
 119 HIS HE1     40 RGUA H3'   2.70  #MEDIUM 2dec3
 119 HIS HE1     41 RGUA H8    2.70  #MEDIUM-STRONG relax 8nov3 med 9nov3 tighten 12nov3
#119 HIS HE1     41 RGUA H1'   6.00  #WEAK 2dec3 rm 9aug4
 119 HIS HE1     41 RGUA H3'   5.00  #NEW 27aug4
#120 ASN HN      26 RGUA H1    5.00  #WEAK remove 10dec3
 120 ASN HD21    26 RGUA H1    3.30  #MEDIUM
 120 ASN HD22    26 RGUA H1    3.30  #MEDIUM
#154 ARG+ QD      7 RCYT H5    5.00  #GUESS 30jun4 rm 1oct4
 154 ARG+ QD     18 RCYT H1'   5.00  #154.qg->xyz->50.h1 CONFIRM 24jun4
#154 ARG+ QD     18 RCYT H5    5.00  #154.qg->xyz->50.h1 CONFIRM 24jun4 SD rm 1jul4
#154 ARG+ QD     19 RCYT H1'   5.00  #GUESS 30jun4 rm 1oct4
 158 VAL QG1      5 RCYT H1'   5.00  #WEAK-MEDIUM 6.70, 89.25 5sc46kcno3d.nv 24may4
 158 VAL QG1      5 RCYT HO2'  5.00  #WEAK-MEDIUM 5sc46kcno3d.nv 4jun4
 158 VAL QG1      5 RCYT H6    5.00  #MEDIUM-STRONG 8.43, 143.53 5sc46kcno3d.nv 25may4 rlx 7jul4
 158 VAL QG1      5 RCYT H5    5.00  #WEAK-MEDIUM 6.81, 101.41 5sc46kcno3d.nv 25may4
 158 VAL QG2      5 RCYT H1'   5.00  #MEDIUM-STRONG 6.70, 89.25 5sc46kcno3d.nv 24may4
 158 VAL QG2      5 RCYT HO2'  3.30  #MEDIUM-STRONG 5sc46kcno3d.nv 4jun4
 158 VAL QG2      5 RCYT H6    3.30  #MEDIUM-STRONG 8.43, 143.53 5sc46kcno3d.nv 25may4
 158 VAL QG2      5 RCYT H5    5.00  #WEAK-MEDIUM 6.81, 101.41 5sc46kcno3d.nv 25may4 rlx 16jun4
 162 TYR HH       5 RCYT H1'   5.00  #WEAK-MEDIUM 2D 5sa46gnoesy80288.nv 25may4
 162 TYR HH       5 RCYT HO2'  3.30  #WEAK-MEDIUM 5sa46gnoesy80288.nv 4jun4 adj 2jul4
 162 TYR HH       5 RCYT H6    6.00  #WEAK 2D 5sa46gnoesy80288.nv 25may4 rlx 9jul4
#162 TYR HH       5 RCYT H5    5.00  #WEAK-MEDIUM 2D 5sa46gnoesy80288.nv 25may4 overlap 162.qe
 162 TYR HH       6 RADE H8    5.00  #WEAK-MEDIUM 5sa46gnoesy80288.nv 4jun4 rlx 7jun4
 176 THR QG2      5 RCYT H1'   5.00  #WEAK 6.70, 89.25 5sc46kcno3d.nv 24may4
 176 THR QG2      5 RCYT H6    5.00  #WEAK 8.43, 143.53 5sc46kcno3d.nv 25may4
 176 THR QG2      5 RCYT H5    3.30  #MEDIUM-STRONG 6.81, 101.41 5sc46kcno3d.nv 25may4
 177 TRP HN       5 RCYT HO2'  3.30  #MEDIUM-WEAK 2jul4
 177 TRP HD1      5 RCYT H1'   3.30  #MEDIUM 5sc46kcno3d.nv 24may4 adj 3aug4 rlx 12aug4
 177 TRP HD1      6 RADE H1'   5.00  #WEAK 5sc46kcno3d32.nv 2jun4
 177 TRP HD1      6 RADE H4'   5.00  #MEDIUM 5sc46kcno3d32.nv 2jun4 rlx 5aug4
 177 TRP HD1      6 RADE H8    3.30  #WEAK d5sa46hcno3d.nv 27may4 adj 3aug4
 177 TRP HD1      8 RADE H2    2.70  #STRONG 8.28, 156.50 2D d5sa46hnoe900.nv
 177 TRP HD1      8 RADE H1'   5.00  #WEAK 5sa46gnoesy80288.nv 5aug4
#177 TRP HD1      9 RCYT H1'   5.00  #WEAK S.D.?
#177 TRP HD1     16 RGUA H1    5.00  #WEAK-MEDIUM 2D 5sa46gnoesy80288.nv 14may4 rm 3jun4 overlap 9.h5
#177 TRP HD1     17 RGUA H1    5.00  #WEAK-MEDIUM 2D 5sa46gnoesy80288.nv 13may4 rm 3jun4 overlap 9.h5
#177 TRP HE1      5 RCYT H1'   5.00  #WEAK 5sc46kcno3d.nv 27may4 SD 7jul4
 177 TRP HE1      8 RADE H2    5.00  #MEDIUM 2D 5sa46gnoesy80288.nv 13may4 rlx 12aug4
 177 TRP HE1      8 RADE O2'   2.00  #H-BOND TEST
 177 TRP NE1      8 RADE O2'   3.00  #H-BOND TEST
 177 TRP HE1      6 RADE H1'   2.70  #MEDIUM-STRONG 5sa46gnoesy80288.nv 13may4 1jun4 adj 27aug4
 177 TRP HE1      8 RADE H1'   5.00  #WEAK 27aug4
 177 TRP HE1      6 RADE H4'   5.00  #MEDIUM-WEAK 5sa46gnoesy80288.nv 2jun4 rlx 3aug4
 177 TRP HE1      6 RADE H8    5.00  #MEDIUM 2D 5sa46gnoesy80288.nv 14may4 rlx 27aug4
 177 TRP HE1      8 RADE H8    6.00  #WEAK 2D 5sa46gnoesy80288.nv 14may4 rlx 9jul4
 177 TRP HE1      8 RADE HO2'  3.30  #MEDIUM 19jul4
 177 TRP HE1      9 RCYT H1'   5.00  #WEAK 5sc46kcno3d32.nv 2jun4
 177 TRP HZ2      6 RADE H8    5.00  #WEAK 5sc46kcno3d32.nv 27may4 adj 3aug4 rlx 26aug4
 177 TRP HZ2      6 RADE H2    6.00  #WEAK 5sc46kcno3d32.nv 27may4
 177 TRP HZ2      9 RCYT H1'   2.70  #STRONG-MEDIUM 5sc46kcno3d32.nv 2jun4 rlx 23jun4 adj 20jul4
 177 TRP HH2      6 RADE H8    5.00  #WEAK 5sc46kcno3d32.nv 27may4
 177 TRP HH2      6 RADE H2    5.00  #WEAK 5sc46kcno3d32.nv 27may4
 177 TRP HH2      9 RCYT H1'   2.70  #MEDIUM 5sc46kcno3d32.nv 2jun4 adj 23jun4 rlx 20jul4 adj 3aug4
 177 TRP HZ3      6 RADE H8    5.00  #WEAK 5sc46kcno3d32.nv 27may4
 177 TRP HZ3      9 RCYT H1'   5.00  #WEAK 5sc46kcno3d32.nv 2jun4 adj 23jun4 rlx 25jun4
 178 THR HN       5 RCYT H1'   5.00  #MED-WEAK 5sa46gnon3d80.nv 5aug4 rlx 27aug4
 178 THR HN       5 RCYT HO2'  5.00  #WEAK 5sa46gnon3d80.nv 5aug4
 178 THR HN       8 RADE H2    5.00  #WEAK 5sa46gnon3d80.nv 5aug4
 178 THR HA       8 RADE H2    3.30  #MEDIUM 3D 5sc46kcno3d.nv and 2D d5sa46hnoe900.nv 24may4 rlx 21jul4 adj 5aug4
 178 THR HB       8 RADE H2    5.00  #WEAK-MEDIUM 3D 5sc46kcno3d.nv and 2D d5sa46hnoe900.nv 24may4
 178 THR QG2      5 RCYT H1'   5.00  #WEAK d5sa46hnoe900.nv 21jun4
 178 THR QG2      8 RADE H2    2.70  #STRONG d5sa46hnoe900.nv 27may4
#179 LEU QD2      8 RADE H2    5.00  #WEAK SD? d5sa46hnoe900.nv 27may4
#181 LEU QD1      6 RADE H2    6.00  #WEAK 2D d5sa46hnoe900.nv 13may4 rlx 4jun4 rm 20jul4
#181 LEU QD2      6 RADE H2    6.00  #WEAK 2D d5sa46hnoe900.nv 13may4 rlx 4jun4 rm 20jul4
#181 LEU QD1      8 RADE H1'   6.00  #VERY WEAK d5sa46hnoe900.nv 2jun4 rm 25jun4
#181 LEU QD2      8 RADE H1'   5.00  #WEAK d5sa46hnoe900.nv 2jun4 rm 6jul4
 181 LEU QD1      8 RADE HO2'  3.30  #WEAK 19jul4 adj 20jul4
 181 LEU QD2      8 RADE HO2'  5.00  #WEAK 19jul4
 181 LEU QD1      8 RADE H2    3.30  #MEDIUM 2D d5sa46hnoe900.nv 13may4 rlx 27may4 rlx 20jul4 adj 3aug4
#181 LEU QD2      8 RADE H2    5.00  #WEAK 2D d5sa46hnoe900.nv 13may4 SD 7jul4
 181 LEU QD1      6 RADE H1'   5.00  #MEDIUM 2D d5sa46hnoe900.nv 13may4 1jun4 5sa46gnoesy80288.nv 23jun4 rlx 20jul4 adj 
3aug4 rlx 12aug4
#181 LEU QD2      6 RADE H1'   6.00  #WEAK 2D d5sa46hnoe900.nv 13may4 1jun4 5sa46gnoesy80288.nv 23jun4
 181 LEU QD1      9 RCYT H1'   5.00  #MEDIUM 2D d5sa46hnoe900.nv 1jun4 rlx 14jul4 adj 3aug4 rlx 12aug4
 181 LEU QD2      9 RCYT H1'   3.30  #STRONG 2D d5sa46hnoe900.nv 1jun4 rlx 14jul4 adj 3aug4
 181 LEU QD1      9 RCYT H6    5.00  #WEAK 2D d5sa46hnoe900.nv 25may4 rlx 20jul4 adj 3aug4
 181 LEU QD2      9 RCYT H6    5.00  #WEAK 2D d5sa46hnoe900.nv 25may4 rlx 20jul4 adj 3aug4
#181 LEU QD1      9 RCYT H5    5.00  #WEAK 2D d5sa46hnoe900.nv 25may4 rm 19jul4
#181 LEU QD2      9 RCYT H5    5.00  #VERY-WEAK 2D d5sa46hnoe900.nv 25may4
#========================
#-END RAMPED RESTRAINTS
#========================



#========================================
#Reference Klosterman, Shah & Steitz Biochemistry 1999
#NUmax=   45.8 +/- 1.0
#PPA=     12.0 +/- 2.8
#NU1=    -30.0 +/- 1.0   -31.0   -29.0
#NU2=     43.8 +/- 1.0    42.8    44.8
#DELTA=   79.0 +/- 2.2    76.8    81.2
#ZETA =  -70.6 +/- 1.7   -72.3   -68.9
#ALPHA=  -68.3 +/- 3.2   -71.5   -65.1
#BETA =  172.4 +/- 4.5   167.9   176.9
#GAMMA=   55.1 +/- 3.9    51.2    59.0
#EPSI = -151.3 +/- 3.2  -154.5  -149.1
#CHI  = -162.4 +/- 2.6  -165.0  -159.8
#
#Removed torsions for Loops and UU mismatches
#
#17sep3 tighten restraints to xray SD
#
#Num Res   Ang         Low    High
#Helix I
   1 RGUA  BETA      167.9   176.9
   1 RGUA  GAMMA      51.2    59.0
#  1 RGUA  DELTA      76.8    81.2
   1 RGUA  EPSI     -154.5  -149.1
   1 RGUA  CHI      -165.0  -159.8
#  1 RGUA  NU1       -31.0   -29.0
#  1 RGUA  NU2        42.8    44.8
   2 RGUA  ALPHA     -71.5   -65.1
   2 RGUA  BETA      167.9   176.9
   2 RGUA  GAMMA      51.2    59.0
#  2 RGUA  DELTA      76.8    81.2
   2 RGUA  EPSI     -154.5  -149.1
   2 RGUA  ZETA      -72.3   -68.9
   2 RGUA  CHI      -165.0  -159.8
#  2 RGUA  NU1       -31.0   -29.0
#  2 RGUA  NU2        42.8    44.8
   3 RGUA  ALPHA     -71.5   -65.1
   3 RGUA  BETA      167.9   176.9
   3 RGUA  GAMMA      51.2    59.0
#  3 RGUA  DELTA      76.8    81.2
   3 RGUA  EPSI     -154.5  -149.1
   3 RGUA  ZETA      -72.3   -68.9
   3 RGUA  CHI      -165.0  -159.8
#  3 RGUA  NU1       -31.0   -29.0
#  3 RGUA  NU2        42.8    44.8
   4 RCYT  ALPHA     -71.5   -65.1
   4 RCYT  BETA      167.9   176.9
   4 RCYT  GAMMA      51.2    59.0
#  4 RCYT  DELTA      76.8    81.2
   4 RCYT  EPSI     -142.2  -132.2 #1un6
   4 RCYT  ZETA      -72.3   -68.9
   4 RCYT  CHI      -165.0  -159.8
#  4 RCYT  NU1       -31.0   -29.0
#  4 RCYT  NU2        42.8    44.8
#Loop A
   5 RCYT  ALPHA     -86.4   -76.4 #1un6
   5 RCYT  BETA     -182.8  -172.8 #1un6
   5 RCYT  GAMMA      68.1    78.1 #1un6
   5 RCYT  DELTA     148.5   154.5 #1un6
   5 RCYT  EPSI      -98.8   -88.8 #1un6
   5 RCYT  ZETA      -50.5   -40.5 #1un6
#  5 RCYT  CHI      -140.0  -120.0
#  5 RCYT  NU1        27.0    47.0
#  5 RCYT  NU2       -45.0   -25.0
   6 RADE  ALPHA     -50.5   -40.5 #1un6
   6 RADE  BETA     -170.1  -160.1 #1un6
   6 RADE  GAMMA      52.6    62.6 #1un6
   6 RADE  DELTA      84.4    90.4 #1un6
   6 RADE  EPSI     -144.1  -134.1 #1un6
   6 RADE  ZETA      157.9   167.9 #1un6
#  6 RADE  CHI      -177.0  -157.0
#  6 RADE  NU1       -31.0   -29.0
#  6 RADE  NU2        42.8    44.8
   7 URA   ALPHA      56.9    66.9 #1un6
   7 URA   BETA     -148.9  -138.9 #1un6
   7 URA   GAMMA      61.5    71.5 #1un6
   7 URA   DELTA     140.1   146.1 #1un6
   7 URA   EPSI     -103.1   -93.1 #1un6
   7 URA   ZETA     -128.4  -118.4 #1un6
#  7 URA   CHI      -143.0  -123.0
#  7 URA   NU1        25.0    45.0
#  7 URA   NU2       -46.0   -26.0
   8 RADE  ALPHA     -85.4   -75.4 #1un6
   8 RADE  BETA     -175.1  -165.1 #1un6
   8 RADE  GAMMA      39.6    49.6 #1un6
   8 RADE  DELTA     134.5   140.5 #1un6
   8 RADE  EPSI     -122.5  -112.5 #1un6
   8 RADE  ZETA      -73.5   -63.5 #1un6
#  8 RADE  CHI      -158.0  -138.0
#  8 RADE  NU1        32.0    52.0
#  8 RADE  NU2       -48.0   -28.0
   9 RCYT  ALPHA     -81.3   -71.3 #1un6
   9 RCYT  BETA     -182.4  -172.4 #1un6
   9 RCYT  GAMMA      46.3    56.3 #1un6
#  9 RCYT  DELTA      76.8    81.2
   9 RCYT  EPSI     -154.5  -149.1
   9 RCYT  ZETA      -57.1   -47.1 #1un6
   9 RCYT  CHI      -165.0  -159.8
#  9 RCYT  NU1       -31.0   -29.0
#  9 RCYT  NU2        42.8    44.8
  10 RCYT  ALPHA     -71.5   -65.1
  10 RCYT  BETA      167.9   176.9
  10 RCYT  GAMMA      51.2    59.0
# 10 RCYT  DELTA      76.8    81.2
  10 RCYT  EPSI     -138.7  -118.7 #1jwc
  10 RCYT  ZETA      -72.3   -68.9
  10 RCYT  CHI      -165.0  -159.8
# 10 RCYT  NU1       -31.0   -29.0
# 10 RCYT  NU2        42.8    44.8
  11 URA   ALPHA     -83.6   -63.6 #1jwc
  11 URA   BETA      140.6   160.6 #1jwc
  11 URA   GAMMA      75.2    95.2 #1jwc
# 11 URA   DELTA      76.8    81.2
  11 URA   EPSI     -156.0  -136.0 #1jwc
  11 URA   ZETA      -68.1   -48.1 #1jwc
  11 URA   CHI      -154.6  -134.6 #1jwc
# 11 URA   NU1       -31.0   -29.0
# 11 URA   NU2        42.8    44.8
  12 RCYT  ALPHA    -100.7   -80.7 #1jwc
  12 RCYT  BETA      130.6   150.6 #1jwc
  12 RCYT  GAMMA     128.2   148.2 #1jwc
# 12 RCYT  DELTA     137.0   157.0 #DAC
  12 RCYT  EPSI     -133.9  -113.9 #1jwc
  12 RCYT  ZETA      -76.8   -56.8 #1jwc
  12 RCYT  CHI      -169.5  -149.5 #1jwc
# 12 RCYT  NU1        28.0    48.0 #DAC
# 12 RCYT  NU2       -48.0   -28.0 #DAC
  13 URA   ALPHA     -88.2   -68.2 #1jwc
  13 URA   BETA      152.7   172.7 #1jwc
  13 URA   GAMMA       3.5    23.5 #1jwc
# 13 URA   DELTA     142.0   162.0 #DAC
  13 URA   EPSI     -108.6   -88.6 #1jwc
  13 URA   ZETA      166.6   186.6 #1jwc
  13 URA   CHI      -166.8  -146.8 #1jwc
# 13 URA   NU1        16.0    36.0 #DAC
# 13 URA   NU2       -48.0   -28.0 #DAC
  14 URA   ALPHA     -94.1   -74.1 #1jwc
  14 URA   BETA       64.1    84.1 #1jwc
  14 URA   GAMMA     148.6   168.6 #1jwc
# 14 URA   DELTA      63.0    83.0 #DAC
  14 URA   EPSI     -115.6   -95.6 #1jwc
  14 URA   ZETA     -163.6  -143.6 #1jwc
  14 URA   CHI      -171.7  -151.7 #1jwc
# 14 URA   NU1       -17.0     3.0 #DAC
# 14 URA   NU2        17.0    37.0 #DAC
  15 RGUA  ALPHA      65.6    85.6 #1jwc
  15 RGUA  BETA     -168.5  -148.5 #1jwc
  15 RGUA  GAMMA    -168.2  -148.2 #1jwc
# 15 RGUA  DELTA      76.8    81.2
  15 RGUA  EPSI     -154.5  -149.1
  15 RGUA  ZETA      110.1   130.1 #1jwc
  15 RGUA  CHI      -165.0  -159.8
# 15 RGUA  NU1       -31.0   -29.0
# 15 RGUA  NU2        42.8    44.8
  16 RGUA  ALPHA     -71.5   -65.1
  16 RGUA  BETA      167.9   176.9
  16 RGUA  GAMMA      51.2    59.0
# 16 RGUA  DELTA      76.8    81.2
  16 RGUA  EPSI     -150.1  -140.1 #1un6
  16 RGUA  ZETA      -72.3   -68.9
  16 RGUA  CHI      -174.5  -164.5 #1un6
# 16 RGUA  NU1       -31.0   -29.0
# 16 RGUA  NU2        42.8    44.8
  17 RGUA  ALPHA     -78.6   -68.6 #1un6
  17 RGUA  BETA      162.4   172.4 #1un6
  17 RGUA  GAMMA      57.0    67.0 #1un6
  17 RGUA  DELTA      80.3    86.3 #1un6
  17 RGUA  EPSI     -146.8  -136.8 #1un6
  17 RGUA  ZETA      -69.2   -59.2 #1un6
  17 RGUA  CHI      -179.0  -169.0 #1un6
# 17 RGUA  NU1       -31.0   -29.0
# 17 RGUA  NU2        42.8    44.8
#Helix V
  18 RCYT  ALPHA     -71.5   -65.1
  18 RCYT  BETA      167.9   176.9
  18 RCYT  GAMMA      51.2    59.0
# 18 RCYT  DELTA      76.8    81.2
  18 RCYT  EPSI     -154.5  -149.1
  18 RCYT  ZETA      -72.3   -68.9
  18 RCYT  CHI      -165.0  -159.8
# 18 RCYT  NU1       -31.0   -29.0
# 18 RCYT  NU2        42.8    44.8
  19 RCYT  ALPHA     -71.5   -65.1
  19 RCYT  BETA      167.9   176.9
  19 RCYT  GAMMA      51.2    59.0
# 19 RCYT  DELTA      76.8    81.2
  19 RCYT  EPSI     -154.5  -149.1
  19 RCYT  ZETA      -72.3   -68.9
  19 RCYT  CHI      -165.0  -159.8
# 19 RCYT  NU1       -31.0   -29.0
# 19 RCYT  NU2        42.8    44.8
  20 URA   ALPHA     -71.5   -65.1
  20 URA   BETA      167.9   176.9
  20 URA   GAMMA      51.2    59.0
# 20 URA   DELTA      76.8    81.2
  20 URA   EPSI     -154.5  -149.1
  20 URA   ZETA      -72.3   -68.9
  20 URA   CHI      -165.0  -159.8
# 20 URA   NU1       -31.0   -29.0
# 20 URA   NU2        42.8    44.8
  21 RGUA  ALPHA     -71.5   -65.1
  21 RGUA  BETA      167.9   176.9
  21 RGUA  GAMMA      51.2    59.0
# 21 RGUA  DELTA      76.8    81.2
  21 RGUA  EPSI     -154.5  -149.1
  21 RGUA  ZETA      -72.3   -68.9
  21 RGUA  CHI      -165.0  -159.8
# 21 RGUA  NU1       -31.0   -29.0
# 21 RGUA  NU2        42.8    44.8
  22 RGUA  ALPHA     -71.5   -65.1
  22 RGUA  BETA      167.9   176.9
  22 RGUA  GAMMA      51.2    59.0
# 22 RGUA  DELTA      76.8    81.2
  22 RGUA  EPSI     -154.5  -149.1
  22 RGUA  ZETA      -72.3   -68.9
  22 RGUA  CHI      -165.0  -159.8
# 22 RGUA  NU1       -31.0   -29.0
# 22 RGUA  NU2        42.8    44.8
  23 URA   ALPHA     144.3   154.3 #1un6
  23 URA   BETA     -165.4  -155.4 #1un6
  23 URA   GAMMA     170.9   180.9 #1un6
# 23 URA   DELTA      76.8    81.2
  23 URA   EPSI     -123.3  -113.3 #1un6
  23 URA   ZETA      -82.2   -72.2 #1un6
  23 URA   CHI       173.5   183.5 #1un6
# 23 URA   NU1       -31.0   -29.0
# 23 URA   NU2        42.8    44.8
  24 URA   ALPHA     -49.7   -39.7 #1un6
  24 URA   BETA      152.6   162.6 #1un6
  24 URA   GAMMA      43.1    53.1 #1un6
# 24 URA   DELTA      76.8    81.2
  24 URA   EPSI     -156.1  -146.1 #1un6
  24 URA   ZETA      -86.4   -76.4 #1un6
  24 URA   CHI      -164.3  -154.3 #1un6
# 24 URA   NU1       -31.0   -29.0
# 24 URA   NU2        42.8    44.8
#Loop E
  25 RADE  ALPHA     169.3   175.7 #430D
  25 RADE  BETA      133.6   142.6 #430D
  25 RADE  GAMMA      39.4    47.2 #430D
# 25 RADE  DELTA     142.8   156.2 #430D rlx 18sep3 c2' endo
  25 RADE  EPSI     -128.9  -122.5 #430D
  25 RADE  ZETA       68.8    72.2 #430D
  25 RADE  CHI      -139.3  -134.1 #430D
# 25 RADE  NU1        36.2    43.7 #430D rlx 18sep3 c2' endo
# 25 RADE  NU2       -44.8   -41.1 #430D rlx 18sep3 c2' endo
  26 RGUA  ALPHA      70.0    76.4 #430D
  26 RGUA  BETA      -74.5   -65.5 #430D
  26 RGUA  GAMMA    -122.1  -114.3 #430D
# 26 RGUA  DELTA     134.6   153.6 #430D rlx 18sep3 c2' endo
  26 RGUA  EPSI     -172.2  -165.8 #430D
  26 RGUA  ZETA      122.5   125.9 #430D
  26 RGUA  CHI      -100.7   -95.5 #430D
# 26 RGUA  NU1        38.6    47.2 #430D rlx 18sep3 c2' endo
# 26 RGUA  NU2       -44.6   -38.2 #430D rlx 18sep3 c2' endo
  27 URA   ALPHA     -63.1   -56.7 #430D
  27 URA   BETA      149.3   158.3 #430D
  27 URA   GAMMA      23.1    30.9 #430D
# 27 URA   DELTA      88.6    93.0 #430D
  27 URA   EPSI     -160.8  -154.4 #430D
  27 URA   ZETA      141.0   144.4 #430D
  27 URA   CHI      -175.0  -169.8 #430D
# 27 URA   NU1       -33.4   -31.3 #430D
# 27 URA   NU2        36.1    38.1 #430D
  28 RADE  ALPHA     -87.5   -81.1 #430D
  28 RADE  BETA     -172.0  -163.0 #430D
  28 RADE  GAMMA      43.1    50.9 #430D
# 28 RADE  DELTA      84.5    88.9 #430D
  28 RADE  EPSI     -138.7  -132.3 #430D
  28 RADE  ZETA      -52.1   -48.7 #430D
  28 RADE  CHI      -179.1  -173.9 #430D
# 28 RADE  NU1       -31.5   -29.5 #430D
# 28 RADE  NU2        37.6    39.7 #430D
#Helix IV
  29 RCYT  ALPHA     -73.1   -63.1 #483D
  29 RCYT  BETA      166.7   176.7 #483D
  29 RCYT  GAMMA      46.0    56.0 #483D
# 29 RCYT  DELTA      76.8    81.2
  29 RCYT  EPSI     -154.7  -144.7 #483D
  29 RCYT  ZETA      -61.4   -51.4 #483D
  29 RCYT  CHI      -168.8  -158.8 #483D
# 29 RCYT  NU1       -31.0   -29.0
# 29 RCYT  NU2        42.8    44.8
  30 RCYT  ALPHA     -71.5   -65.1
  30 RCYT  BETA      167.9   176.9
  30 RCYT  GAMMA      51.2    59.0
# 30 RCYT  DELTA      76.8    81.2
  30 RCYT  EPSI     -154.5  -149.1
  30 RCYT  ZETA      -72.3   -68.9
  30 RCYT  CHI      -165.0  -159.8
# 30 RCYT  NU1       -31.0   -29.0
# 30 RCYT  NU2        42.8    44.8
  31 URA   ALPHA     -60.8   -54.4  #UU mis JJ2 1304
  31 URA   BETA      170.3   179.3  #UU mis JJ2 1304
  31 URA   GAMMA      49.4    57.2  #UU mis JJ2 1304
# 31 URA   DELTA      83.7    88.1  #UU mis JJ2 1304
  31 URA   EPSI     -132.2  -125.8  #UU mis JJ2 1304
  31 URA   ZETA      -87.6   -84.2  #UU mis JJ2 1304
  31 URA   CHI      -169.0  -163.8  #UU mis JJ2 1304
# 31 URA   NU1       -26.1   -24.1  #UU mis JJ2 1304
# 31 URA   NU2        35.6    37.6  #UU mis JJ2 1304
#UUCG Tetraloop
  32 RCYT  ALPHA     -64.5   -58.1  #1F7Y uucg 8-13
  32 RCYT  BETA      163.4  -176.6  #1F7Y uucg 8-13 rlx +/-10
  32 RCYT  GAMMA      45.9    53.7  #1F7Y uucg 8-13
# 32 RCYT  DELTA      77.1    81.5  #1F7Y uucg 8-13
  32 RCYT  EPSI     -152.0  -145.6  #1F7Y uucg 8-13
  32 RCYT  ZETA      -74.9   -71.5  #1F7Y uucg 8-13
  32 RCYT  CHI      -164.7  -159.5  #1F7Y uucg 8-13
# 32 RCYT  NU1       -23.4   -21.4  #1F7Y uucg 8-13
# 32 RCYT  NU2        36.7    38.7  #1F7Y uucg 8-13
  33 URA   ALPHA     -69.1   -62.7  #1F7Y uucg 8-13
  33 URA   BETA      177.8  -173.2  #1F7Y uucg 8-13
  33 URA   GAMMA      40.4    48.2  #1F7Y uucg 8-13
# 33 URA   DELTA      77.5    81.9  #1F7Y uucg 8-13
  33 URA   EPSI     -167.1  -160.7  #1F7Y uucg 8-13
  33 URA   ZETA      -64.4   -61.0  #1F7Y uucg 8-13
  33 URA   CHI      -151.6  -146.4  #1F7Y uucg 8-13
# 33 URA   NU1       -25.5   -23.5  #1F7Y uucg 8-13
# 33 URA   NU2        37.6    39.7  #1F7Y uucg 8-13
  34 URA   ALPHA     168.4   174.8  #1F7Y uucg 8-13
  34 URA   BETA     -174.7  -165.7  #1F7Y uucg 8-13
  34 URA   GAMMA      60.5    68.3  #1F7Y uucg 8-13
# 34 URA   DELTA     149.8   154.2  #1F7Y uucg 8-13
  34 URA   EPSI     -103.2   -96.8  #1F7Y uucg 8-13
  34 URA   ZETA     -124.5  -121.1  #1F7Y uucg 8-13
  34 URA   CHI      -140.4  -135.2  #1F7Y uucg 8-13
# 34 URA   NU1        34.9    36.9  #1F7Y uucg 8-13
# 34 URA   NU2       -38.2   -36.2  #1F7Y uucg 8-13
  35 RCYT  ALPHA     -84.9   -78.5  #1F7Y uucg 8-13
  35 RCYT  BETA     -167.7  -158.7  #1F7Y uucg 8-13
  35 RCYT  GAMMA      55.9    63.7  #1F7Y uucg 8-13
# 35 RCYT  DELTA     150.8   155.2  #1F7Y uucg 8-13
  35 RCYT  EPSI     -121.1  -114.7  #1F7Y uucg 8-13
  35 RCYT  ZETA      -62.9   -59.5  #1F7Y uucg 8-13
  35 RCYT  CHI      -160.0  -154.8  #1F7Y uucg 8-13
# 35 RCYT  NU1        37.4    39.4  #1F7Y uucg 8-13
# 35 RCYT  NU2       -40.1   -38.1  #1F7Y uucg 8-13
  36 RGUA  ALPHA      45.6    52.0  #1F7Y uucg 8-13
  36 RGUA  BETA     -149.8  -140.8  #1F7Y uucg 8-13
  36 RGUA  GAMMA     169.9   177.7  #1F7Y uucg 8-13
# 36 RGUA  DELTA      83.4    87.8  #1F7Y uucg 8-13
  36 RGUA  EPSI     -141.7  -135.3  #1F7Y uucg 8-13
  36 RGUA  ZETA      110.9   114.3  #1F7Y uucg 8-13
  36 RGUA  CHI        56.1    61.3  #1F7Y uucg 8-13
# 36 RGUA  NU1       -14.8   -12.8  #1F7Y uucg 8-13
# 36 RGUA  NU2        30.1    32.1  #1F7Y uucg 8-13
  37 RGUA  ALPHA     -61.3   -54.9  #1F7Y uucg 8-13
  37 RGUA  BETA      151.3   160.3  #1F7Y uucg 8-13
  37 RGUA  GAMMA      71.7    79.5  #1F7Y uucg 8-13
# 37 RGUA  DELTA      76.2    80.6  #1F7Y uucg 8-13
  37 RGUA  EPSI      168.7  -161.3  #1F7Y uucg 8-13 rlx +/-20
  37 RGUA  ZETA      -50.6   -47.2  #1F7Y uucg 8-13
  37 RGUA  CHI      -164.3  -159.1  #1F7Y uucg 8-13
# 37 RGUA  NU1       -27.3   -25.3  #1F7Y uucg 8-13
# 37 RGUA  NU2        41.3    43.3  #1F7Y uucg 8-13
#Helix IV
  38 URA   ALPHA     -59.1   -52.7  #UU mis JJ2 1350
  38 URA   BETA      166.3   175.3  #UU mis JJ2 1350
  38 URA   GAMMA      40.6    60.6  #UU mis JJ2 1350 rlx +/-10
# 38 URA   DELTA      75.1    83.5  #UU mis JJ2 1350 rlx c3' endo
  38 URA   EPSI     -139.9  -133.5  #UU mis JJ2 1350
  38 URA   ZETA      -67.6   -64.2  #UU mis JJ2 1350
  38 URA   CHI      -157.7  -152.5  #UU mis JJ2 1350
# 38 URA   NU1       -36.0   -14.1  #UU mis JJ2 1350 rlx c3' endo
# 38 URA   NU2        36.4    44.8  #UU mis JJ2 1350 rlx c3' endo
  39 RGUA  ALPHA     -71.5   -65.1
  39 RGUA  BETA      167.9   176.9
  39 RGUA  GAMMA      51.2    59.0
# 39 RGUA  DELTA      76.8    81.2
  39 RGUA  EPSI     -154.5  -149.1
  39 RGUA  ZETA      -72.3   -68.9
  39 RGUA  CHI      -165.0  -159.8
# 39 RGUA  NU1       -31.0   -29.0
# 39 RGUA  NU2        42.8    44.8
  40 RGUA  ALPHA     -71.5   -65.1
  40 RGUA  BETA      167.9   176.9
  40 RGUA  GAMMA      51.2    59.0
# 40 RGUA  DELTA      76.8    81.2
  40 RGUA  EPSI     -154.5  -149.1
  40 RGUA  ZETA      -72.3   -68.9
  40 RGUA  CHI      -165.0  -159.8
# 40 RGUA  NU1       -31.0   -29.0
# 40 RGUA  NU2        42.8    44.8
#Loop E
  41 RGUA  ALPHA     -71.8   -65.4 #430D
  41 RGUA  BETA      176.1  -174.9 #430D
  41 RGUA  GAMMA      41.5    49.3 #430D
# 41 RGUA  DELTA      78.0    82.4 #430D
  41 RGUA  EPSI     -162.4  -156.0 #430D
  41 RGUA  ZETA      -53.7   -50.3 #430D
  41 RGUA  CHI      -159.4  -154.2 #430D
# 41 RGUA  NU1       -31.7   -29.6 #430D
# 41 RGUA  NU2        42.7    44.8 #430D
  42 RADE  ALPHA    -111.9  -105.5 #430D -ac
  42 RADE  BETA       79.3    88.3 #430D
  42 RADE  GAMMA     156.5   164.3 #430D
# 42 RADE  DELTA      85.6    90.0 #430D
  42 RADE  EPSI     -125.2  -118.8 #430D
  42 RADE  ZETA      -84.2   -80.8 #430D
  42 RADE  CHI       179.5  -175.3 #430D
# 42 RADE  NU1       -28.9   -26.9 #430D
# 42 RADE  NU2        35.0    37.0 #430D
  43 RADE  ALPHA     -32.7   -26.3 #430D
  43 RADE  BETA      129.1   138.1 #430D
  43 RADE  GAMMA      36.0    43.8 #430D
# 43 RADE  DELTA      79.6    84.0 #430D
  43 RADE  EPSI     -136.2  -129.8 #430D
  43 RADE  ZETA      -99.5   -96.1 #430D
  43 RADE  CHI      -178.1  -172.9 #430D
# 43 RADE  NU1       -23.5   -21.5 #430D
# 43 RADE  NU2        35.0    37.0 #430D
#Helix V
  44 URA   ALPHA     -74.6   -64.6 #1un6
  44 URA   BETA      168.9   178.9 #1un6
  44 URA   GAMMA      46.4    56.4 #1un6
# 44 URA   DELTA      82.7    87.1
  44 URA   EPSI     -157.9  -147.9 #1un6
  44 URA   ZETA      -61.8   -51.8 #1un6
  44 URA   CHI      -153.1  -163.1 #1un6
# 44 URA   NU1       -28.1   -26.1
# 44 URA   NU2        36.3    38.3
  45 RADE  ALPHA     -71.5   -65.1
  45 RADE  BETA      167.9   176.9
  45 RADE  GAMMA      51.2    59.0
# 45 RADE  DELTA      76.8    81.2
  45 RADE  EPSI     -154.5  -149.1
  45 RADE  ZETA      -72.3   -68.9
  45 RADE  CHI      -165.0  -159.8
# 45 RADE  NU1       -31.0   -29.0
# 45 RADE  NU2        42.8    44.8
  46 RCYT  ALPHA     -71.5   -65.1
  46 RCYT  BETA      167.9   176.9
  46 RCYT  GAMMA      51.2    59.0
# 46 RCYT  DELTA      76.8    81.2
  46 RCYT  EPSI     -154.5  -149.1
  46 RCYT  ZETA      -72.3   -68.9
  46 RCYT  CHI      -165.0  -159.8
# 46 RCYT  NU1       -31.0   -29.0
# 46 RCYT  NU2        42.8    44.8
  47 RCYT  ALPHA     -71.5   -65.1
  47 RCYT  BETA      167.9   176.9
  47 RCYT  GAMMA      51.2    59.0
# 47 RCYT  DELTA      76.8    81.2
  47 RCYT  EPSI     -154.5  -149.1
  47 RCYT  ZETA      -72.3   -68.9
  47 RCYT  CHI      -165.0  -159.8
# 47 RCYT  NU1       -31.0   -29.0
# 47 RCYT  NU2        42.8    44.8
  48 RADE  ALPHA     -71.5   -65.1
  48 RADE  BETA      167.9   176.9
  48 RADE  GAMMA      51.2    59.0
# 48 RADE  DELTA      76.8    81.2
  48 RADE  EPSI     -154.5  -149.1
  48 RADE  ZETA      -72.3   -68.9
  48 RADE  CHI      -165.0  -159.8
# 48 RADE  NU1       -31.0   -29.0
# 48 RADE  NU2        42.8    44.8
  49 RGUA  ALPHA     -71.5   -65.1
  49 RGUA  BETA      167.9   176.9
  49 RGUA  GAMMA      51.2    59.0
# 49 RGUA  DELTA      76.8    81.2
  49 RGUA  EPSI     -154.5  -149.1
  49 RGUA  ZETA      -72.3   -68.9
  49 RGUA  CHI      -165.0  -159.8
# 49 RGUA  NU1       -31.0   -29.0
# 49 RGUA  NU2        42.8    44.8
  50 RGUA  ALPHA     -71.5   -65.1
  50 RGUA  BETA      167.9   176.9
  50 RGUA  GAMMA      51.2    59.0
# 50 RGUA  DELTA      76.8    81.2
  50 RGUA  EPSI     -153.5  -143.5 #1un6
  50 RGUA  ZETA      -72.3   -68.9
  50 RGUA  CHI      -173.7  -163.7 #1un6
# 50 RGUA  NU1       -31.0   -29.0
# 50 RGUA  NU2        42.8    44.8
#Loop A
  51 URA   ALPHA     -61.8   -51.8 #1un6
  51 URA   BETA      173.5   183.5 #1un6
  51 URA   GAMMA      47.2    57.2 #1un6
  51 URA   DELTA     131.8   137.8 #1un6
  51 URA   EPSI     -151.1  -141.1 #1un6
  51 URA   ZETA      -83.1   -73.1 #1un6
  51 URA   CHI      -129.8  -119.8 #1un6
# 51 URA   NU1        33.0    53.0 #JJ2
# 51 URA   NU2       -45.0   -25.0 #JJ2
#Helix I
  52 RGUA  ALPHA     -91.3   -81.3 #1un6
  52 RGUA  BETA       90.7   100.7 #1un6
  52 RGUA  GAMMA     168.0   178.0 #1un6
  52 RGUA  DELTA      79.6    85.6 #1un6
  52 RGUA  EPSI     -154.5  -149.1
  52 RGUA  ZETA      158.8   168.8 #1un6
  52 RGUA  CHI      -165.0  -159.8
# 52 RGUA  NU1       -31.0   -29.0
# 52 RGUA  NU2        42.8    44.8
  53 RCYT  ALPHA     -71.5   -65.1
  53 RCYT  BETA      167.9   176.9
  53 RCYT  GAMMA      51.2    59.0
# 53 RCYT  DELTA      76.8    81.2
  53 RCYT  EPSI     -154.5  -149.1
  53 RCYT  ZETA      -72.3   -68.9
  53 RCYT  CHI      -165.0  -159.8
# 53 RCYT  NU1       -31.0   -29.0
# 53 RCYT  NU2        42.8    44.8
  54 RCYT  ALPHA     -71.5   -65.1
  54 RCYT  BETA      167.9   176.9
  54 RCYT  GAMMA      51.2    59.0
# 54 RCYT  DELTA      76.8    81.2
  54 RCYT  EPSI     -154.5  -149.1
  54 RCYT  ZETA      -72.3   -68.9
  54 RCYT  CHI      -165.0  -159.8
# 54 RCYT  NU1       -31.0   -29.0
# 54 RCYT  NU2        42.8    44.8
  55 RCYT  ALPHA     -71.5   -65.1
  55 RCYT  BETA      167.9   176.9
  55 RCYT  GAMMA      51.2    59.0
# 55 RCYT  DELTA      76.8    81.2
  55 RCYT  ZETA      -72.3   -68.9
  55 RCYT  CHI      -165.0  -159.8
# 55 RCYT  NU1       -31.0   -29.0
# 55 RCYT  NU2        42.8    44.8
#Num Res   Ang     phi     psi             Dif Count Class
#104 MET   PHI    9999.0  9999.0	#  0.0  0/10 None
#104 MET   PSI    9999.0  9999.0	#  0.0
 105 TYR   PHI    -109.0   -83.0	# 13.0  8/10 Good
 105 TYR   PSI     113.0   145.0	# 16.0
 106 VAL   PHI    -121.0   -95.0	# 13.0 10/10 Good
 106 VAL   PSI     111.0   139.0	# 14.0
 107 CYSZ  PHI     -86.0   -54.0	# 16.0 10/10 Good
 107 CYSZ  PSI     127.0   143.0	#  8.0
#108 HIS   PHI    -110.0   -64.0	# 23.0  9/10 Bad
#108 HIS   PSI     103.0   165.0	# 31.0
#109 PHE   PHI     -91.0   -57.0	# 17.0  8/10 Bad
#109 PHE   PSI     122.0   154.0	# 16.0
#110 GLU-  PHI     -81.0   -59.0	# 11.0  8/10 Bad
#110 GLU-  PSI     -44.0   -12.0	# 16.0
 110 GLU-  PHI     -75.0   -45.0        # add Type II turn
 110 GLU-  PSI     115.0   145.0        # add Type II turn
#111 ASN   PHI    -115.0   -99.0	#  8.0  5/10 Bad
#111 ASN   PSI     -18.0    28.0	# 23.0
 111 ASN   PHI      70.0   100.0        # add Type II turn
 111 ASN   PSI     -15.0    15.0        # add Type II turn
#112 CYS-  PHI     -84.0   -56.0	# 14.0 10/10 Good
#112 CYS-  PSI     -43.0   -13.0	# 15.0
#113 GLY   PHI      83.0    97.0	#  7.0  7/10 Good
#113 GLY   PSI      -9.0     7.0	#  8.0
#114 LYS+  PHI    -111.0   -63.0	# 24.0  7/10 Good
#114 LYS+  PSI     111.0   147.0	# 18.0
 115 ALA   PHI    -134.0   -94.0	# 20.0  9/10 Good
 115 ALA   PSI     128.0   158.0	# 15.0
 116 PHE   PHI    -126.0   -96.0	# 15.0 10/10 Good
 116 PHE   PSI     120.0   160.0	# 20.0
#117 LYS+  PHI    -102.0   -66.0	# 18.0  6/10 Bad
#117 LYS+  PSI     -30.0    -6.0	# 12.0
#118 LYS+  PHI    -142.0   -88.0	# 27.0  8/10 Warn
#118 LYS+  PSI     140.0   174.0	# 17.0
 119 HIS   PHI     -68.0   -60.0	#  4.0 10/10 Good
 119 HIS   PSI     -45.0   -29.0	#  8.0
 120 ASN   PHI     -72.0   -64.0	#  4.0 10/10 Good
 120 ASN   PSI     -51.0   -29.0	# 11.0
 121 GLN   PHI     -73.0   -61.0	#  6.0 10/10 Good
 121 GLN   PSI     -48.0   -28.0	# 10.0
 122 LEU   PHI     -78.0   -60.0	#  9.0  9/10 Good
 122 LEU   PSI     -47.0   -35.0	#  6.0
 123 LYS+  PHI     -71.0   -57.0	#  7.0 10/10 Good
 123 LYS+  PSI     -47.0   -37.0	#  5.0
 124 VAL   PHI     -74.0   -58.0	#  8.0 10/10 Good
 124 VAL   PSI     -41.0   -35.0	#  3.0
 125 HIS   PHI     -71.0   -63.0	#  4.0 10/10 Good
 125 HIS   PSI     -45.0   -35.0	#  5.0
 126 GLN   PHI     -71.0   -55.0	#  8.0 10/10 Good
 126 GLN   PSI     -54.0   -32.0	# 11.0
 127 PHE   PHI     -71.0   -55.0	#  8.0 10/10 Good
 127 PHE   PSI     -49.0   -29.0	# 10.0
 128 SER   PHI     -70.0   -58.0	#  6.0  9/10 Good
 128 SER   PSI     -52.0   -24.0	# 14.0
 129 HIS   PHI     -92.0   -54.0	# 19.0  9/10 Good
 129 HIS   PSI     -36.0    -8.0	# 14.0
 130 THR   PHI    -114.0   -66.0	# 24.0 10/10 Good
 130 THR   PSI     -24.0     2.0	# 13.0
#131 GLN   PHI      46.0    58.0	#  6.0  5/10 Warn
#131 GLN   PSI      34.0    64.0	# 15.0
 131 GLN   PHI      40.0   100.0	# pseudo
 131 GLN   PSI      -5.0    55.0	# pseudo
#132 GLN   PHI    -153.0   -97.0	# 28.0  8/10 Warn
#132 GLN   PSI     129.0   165.0	# 18.0
 132 GLN   PHI    -155.0   -95.0	# pseudo
 132 GLN   PSI     100.0   160.0	# pseudo
#133 LEU   PHI    -100.0   -64.0	# 18.0  8/10 Warn
#133 LEU   PSI      93.0   141.0	# 24.0
 133 LEU   PHI    -100.0   -40.0	# pseudo
 133 LEU   PSI     100.0   160.0	# pseudo
#134 PRO   PHI     -83.0   -53.0	# 15.0  6/10 Warn
#134 PRO   PSI     -38.0    -6.0	# 16.0
#135 TYR   PHI    -115.0   -67.0	# 24.0  7/10 Warn
#135 TYR   PSI     100.0   152.0	# 26.0
 136 GLU-  PHI    -118.0   -88.0	# 15.0 10/10 Good
 136 GLU-  PSI     111.0   143.0	# 16.0
 137 CYSZ  PHI    -134.0   -74.0	# 30.0  9/10 Good
 137 CYSZ  PSI     107.0   137.0	# 15.0
#138 PRO   PHI    -101.0   -53.0	# 24.0 10/10 Bad
#138 PRO   PSI     117.0   147.0	# 15.0
 139 HIS   PHI     -88.0   -52.0	# 18.0 10/10 Good
 139 HIS   PSI     122.0   152.0	# 15.0
#140 GLU-  PHI     -83.0   -55.0	# 14.0  6/10 Bad
#140 GLU-  PSI     126.0   138.0	#  6.0
#141 GLY   PHI    -271.0   -83.0	# 94.0 10/10 Bad
#141 GLY   PSI    -106.0   110.0	#108.0
#142 CYS-  PHI    -111.0   -57.0	# 27.0  7/10 Warn
#142 CYS-  PSI     122.0   146.0	# 12.0
#143 ASP-  PHI     -89.0   -63.0	# 13.0  8/10 Bad
#143 ASP-  PSI     123.0   163.0	# 20.0
#144 LYS+  PHI    -108.0   -76.0	# 16.0  5/10 Bad
#144 LYS+  PSI     -39.0   -17.0	# 11.0
 145 ARG+  PHI    -160.0  -122.0	# 19.0  8/10 Good
 145 ARG+  PSI     141.0   163.0	# 11.0
 146 PHE   PHI    -134.0   -94.0	# 20.0 10/10 Good
 146 PHE   PSI     136.0   164.0	# 14.0
#147 SER   PHI    -134.0   -66.0	# 34.0  6/10 Bad
#147 SER   PSI     131.0   167.0	# 18.0
 148 LEU   PHI    -149.0  -109.0	# 20.0 10/10 Good
 148 LEU   PSI     110.0   166.0	# 28.0
#149 PRO   PHI     -69.0   -61.0	#  4.0 10/10 Good
 149 PRO   PSI     -41.0   -25.0	#  8.0
 150 SER   PHI     -73.0   -61.0	#  6.0 10/10 Good
 150 SER   PSI     -49.0   -29.0	# 10.0
 151 ARG+  PHI     -73.0   -61.0	#  6.0 10/10 Good
 151 ARG+  PSI     -49.0   -35.0	#  7.0
 152 LEU   PHI     -80.0   -62.0	#  9.0 10/10 Good
 152 LEU   PSI     -47.0   -35.0	#  6.0
 153 LYS+  PHI     -69.0   -55.0	#  7.0 10/10 Good
 153 LYS+  PSI     -49.0   -33.0	#  8.0
 154 ARG+  PHI     -74.0   -66.0	#  4.0 10/10 Good
 154 ARG+  PSI     -49.0   -29.0	# 10.0
 155 HIS   PHI     -71.0   -59.0	#  6.0 10/10 Good
 155 HIS   PSI     -44.0   -34.0	#  5.0
 156 GLU-  PHI     -69.0   -59.0	#  5.0 10/10 Good
 156 GLU-  PSI     -52.0   -32.0	# 10.0
 157 LYS+  PHI     -72.0   -60.0	#  6.0 10/10 Good
 157 LYS+  PSI     -52.0   -26.0	# 13.0
 158 VAL   PHI     -88.0   -62.0	# 13.0 10/10 Good
 158 VAL   PSI     -47.0   -27.0	# 10.0
 159 HIS   PHI     -77.0   -61.0	#  8.0  9/10 Good
 159 HIS   PSI     -44.0   -12.0	# 16.0
 160 ALA   PHI     -99.0   -71.0	# 14.0 10/10 Good
 160 ALA   PSI     -29.0    11.0	# 20.0
#161 GLY   PHI      76.0   102.0	# 13.0  5/10 Bad
#161 GLY   PSI       1.0    23.0	# 11.0
 162 TYR   PHI    -124.0   -90.0	# 17.0 10/10 Good
 162 TYR   PSI      95.0   151.0	# 28.0
#163 PRO   PHI     -80.0   -52.0	# 14.0  8/10 Warn
#163 PRO   PSI     126.0   158.0	# 16.0
#164 CYSZ  PHI     -93.0   -49.0	# 22.0  7/10 Warn
#164 CYSZ  PSI     130.0   152.0	# 11.0
#165 LYS+  PHI    -102.0   -74.0	# 14.0  5/10 Bad
#165 LYS+  PSI     125.0   177.0	# 26.0
#166 LYS+  PHI    -101.0   -75.0	# 13.0  6/10 Bad
#166 LYS+  PSI     -37.0    -9.0	# 14.0
#167 ASP-  PHI    -137.0   -67.0	# 35.0  7/10 Warn
#167 ASP-  PSI     119.0   163.0	# 22.0
 167 ASP-  PHI    -180.0  -120.0	# pseudo
 167 ASP-  PSI     115.0   175.0	# pseudo
#168 ASP-  PHI     -77.0   -65.0	#  6.0  6/10 Warn
#168 ASP-  PSI     -40.0   -18.0	# 11.0
 168 ASP-  PHI     -95.0   -35.0	# pseudo
 168 ASP-  PSI     -60.0     0.0	# pseudo
#169 SER   PHI    -110.0   -56.0	# 27.0  7/10 Bad
#169 SER   PSI      98.0   150.0	# 26.0
 169 SER   PHI    -125.0   -65.0	# pseudo
 169 SER   PSI     -10.0    50.0	# pseudo
#170 CYS-  PHI    -100.0   -56.0	# 22.0  8/10 Warn
#170 CYS-  PSI     118.0   142.0	# 12.0
#171 SER   PHI    -102.0   -70.0	# 16.0  8/10 Bad
#171 SER   PSI      97.0   163.0	# 33.0
 172 PHE   PHI     -97.0   -59.0	# 19.0 10/10 Good
 172 PHE   PSI     128.0   146.0	#  9.0
 173 VAL   PHI    -128.0   -80.0	# 24.0  9/10 Good
 173 VAL   PSI      93.0   147.0	# 27.0
#174 GLY   PHI     -93.0   -63.0	# 15.0  5/10 Warn
#174 GLY   PSI     133.0   157.0	# 12.0
#175 LYS+  PHI    -106.0   -66.0	# 20.0  8/10 Warn
#175 LYS+  PSI     -38.0     4.0	# 21.0
#176 THR   PHI    -153.0  -125.0	# 14.0  7/10 Warn
#176 THR   PSI     138.0   160.0	# 11.0
#177 TRP   PHI     -69.0   -59.0	#  5.0  8/10 Warn
#177 TRP   PSI     -47.0   -25.0	# 11.0
 178 THR   PHI     -73.0   -57.0	#  8.0 10/10 Good
 178 THR   PSI     -48.0   -32.0	#  8.0
 179 LEU   PHI     -74.0   -62.0	#  6.0 10/10 Good
 179 LEU   PSI     -45.0   -31.0	#  7.0
 180 TYR   PHI     -74.0   -64.0	#  5.0 10/10 Good
 180 TYR   PSI     -48.0   -34.0	#  7.0
 181 LEU   PHI     -69.0   -57.0	#  6.0 10/10 Good
 181 LEU   PSI     -47.0   -37.0	#  5.0
 182 LYS+  PHI     -72.0   -64.0	#  4.0 10/10 Good
 182 LYS+  PSI     -44.0   -30.0	#  7.0
 183 HIS   PHI     -72.0   -62.0	#  5.0 10/10 Good
 183 HIS   PSI     -51.0   -39.0	#  6.0
 184 VAL   PHI     -72.0   -60.0	#  6.0 10/10 Good
 184 VAL   PSI     -45.0   -29.0	#  8.0
 185 ALA   PHI     -71.0   -55.0	#  8.0 10/10 Good
 185 ALA   PSI     -47.0   -25.0	# 11.0
 186 GLU-  PHI     -89.0   -51.0	# 19.0 10/10 Good
 186 GLU-  PSI     -44.0   -20.0	# 12.0
#187 CYS   PHI    -105.0   -55.0	# 25.0  9/10 Warn
#187 CYS   PSI     -35.0     3.0	# 19.0
#188 HIS   PHI    -116.0   -90.0	# 13.0  7/10 Warn
#188 HIS   PSI     -12.0    20.0	# 16.0
#189 GLN   PHI    -102.0   -64.0	# 19.0 10/10 Bad
#189 GLN   PSI     118.0   148.0	# 15.0
#190 ASP-  PHI    9999.0  9999.0	#  0.0  0/10 None
#190 ASP-  PSI    9999.0  9999.0	#  0.0
DATA SEQUENCE MYVCHFENCG KAFKKHNQLK VHQFSHTQQL PYECPHEGCD 
DATA SEQUENCE KRFSLPSRLK RHEKVHAGYP CKKDDSCSFV GKTWTLYLKH 
DATA SEQUENCE VAECHQD

VARS   RESID_I RESNAME_I ATOMNAME_I RESID_J RESNAME_J ATOMNAME_J D DD W
FORMAT %5d     %6s       %6s        %5d     %6s    %6s %9.3f %9.3f %.2f
    1    GUA     H1     1    GUA     N1     13.864      1.000  1.00
    2    GUA     H1     2    GUA     N1     12.678      1.000  1.00
    3    GUA     H1     3    GUA     N1     19.245      1.000  1.00
   15    GUA     H1    15    GUA     N1      9.030      1.000  1.00
   16    GUA     H1    16    GUA     N1      7.479      1.000  1.00
   17    GUA     H1    17    GUA     N1     13.681      1.000  1.00
   20    URA     H3    20    URA     N3     11.401      1.000  1.00
   21    GUA     H1    21    GUA     N1      9.394      1.000  1.00
   22    GUA     H1    22    GUA     N1     11.401      1.000  1.00
   24    URA     H3    24    URA     N3      7.661      1.000  1.00
   26    GUA     H1    26    GUA     N1     -7.297      1.000  1.00
   27    URA     H3    27    URA     N3     -3.283      1.000  1.00
   31    URA     H3    31    URA     N3     14.593      1.000  1.00
   39    GUA     H1    39    GUA     N1     11.492      1.000  1.00
   40    GUA     H1    40    GUA     N1     10.945      1.000  1.00
   41    GUA     H1    41    GUA     N1     -5.655      1.000  1.00
   44    URA     H3    44    URA     N3      7.570      1.000  1.00
   49    GUA     H1    49    GUA     N1     16.144      1.000  1.00
   50    GUA     H1    50    GUA     N1     17.877      1.000  1.00
   51    URA     H3    51    URA     N3     13.864      1.000  1.00
   52    GUA     H1    52    GUA     N1      9.030      1.000  1.00
  105    TYR     HN   105    TYR      N    -20.887      1.000  1.00
  106    VAL     HN   106    VAL      N    -19.245      1.000  1.00
  107    CYS     HN   107    CYS      N      2.645      1.000  1.00
  108    HIS     HN   108    HIS      N     14.776      1.000  1.00
  109    PHE     HN   109    PHE      N     -5.108      1.000  1.00
  110    GLU     HN   110    GLU      N     11.948      1.000  1.00
  111    ASN     HN   111    ASN      N    -19.792      1.000  1.00
  112    CYS     HN   112    CYS      N     -2.098      1.000  1.00
  113    GLY     HN   113    GLY      N      8.847      1.000  1.00
  114    LYS     HN   114    LYS      N      5.381      1.000  1.00
  115    ALA     HN   115    ALA      N      6.749      1.000  1.00
  116    PHE     HN   116    PHE      N    -11.036      1.000  1.00
  117    LYS     HN   117    LYS      N    -20.704      1.000  1.00
  118    LYS     HN   118    LYS      N    -13.499      1.000  1.00
  119    HIS     HN   119    HIS      N      4.652      1.000  1.00
  120    ASN     HN   120    ASN      N     13.590      1.000  1.00
  121    GLN     HN   121    GLN      N     -7.844      1.000  1.00
  122    LEU     HN   122    LEU      N     -0.547      1.000  1.00
  123    LYS     HN   123    LYS      N      4.378      1.000  1.00
  125    HIS     HN   125    HIS      N     -3.648      1.000  1.00
  126    GLN     HN   126    GLN      N      5.472      1.000  1.00
  127    PHE     HN   127    PHE      N     10.398      1.000  1.00
  128    SER     HN   128    SER      N      1.824      1.000  1.00
  129    HIS     HN   129    HIS      N      3.740      1.000  1.00
  130    THR     HN   130    THR      N      9.850      1.000  1.00
  131    GLN     HN   131    GLN      N      9.577      1.000  1.00
  132    GLN     HN   132    GLN      N     -7.753      1.000  1.00
  136    GLU     HN   136    GLU      N    -21.890      1.000  1.00
  137    CYS     HN   137    CYS      N      2.098      1.000  1.00
  139    HIS     HN   139    HIS      N      8.300      1.000  1.00
  140    GLU     HN   140    GLU      N     13.408      1.000  1.00
  141    GLY     HN   141    GLY      N    -18.698      1.000  1.00
  142    CYS     HN   142    CYS      N    -14.228      1.000  1.00
  143    ASP     HN   143    ASP      N    -23.988      1.000  1.00
  144    LYS     HN   144    LYS      N     12.222      1.000  1.00
  145    ARG     HN   145    ARG      N     -6.567      1.000  1.00
  146    PHE     HN   146    PHE      N    -13.134      1.000  1.00
  147    SER     HN   147    SER      N    -24.809      1.000  1.00
  148    LEU     HN   148    LEU      N    -18.059      1.000  1.00
  150    SER     HN   150    SER      N      8.482      1.000  1.00
  151    ARG     HN   151    ARG      N     -8.574      1.000  1.00
  152    LEU     HN   152    LEU      N    -15.323      1.000  1.00
  153    LYS     HN   153    LYS      N      1.003      1.000  1.00
  156    GLU     HN   156    GLU      N     -6.749      1.000  1.00
  157    LYS     HN   157    LYS      N     19.427      1.000  1.00
  158    VAL     HN   158    VAL      N      1.642      1.000  1.00
  159    HIS     HN   159    HIS      N     -7.753      1.000  1.00
  160    ALA     HN   160    ALA      N     16.053      1.000  1.00
  161    GLY     HN   161    GLY      N     14.320      1.000  1.00
  162    TYR     HN   162    TYR      N      0.730      1.000  1.00
  164    CYS     HN   164    CYS      N     13.499      1.000  1.00
  165    LYS     HN   165    LYS      N      4.560      1.000  1.00
  166    LYS     HN   166    LYS      N      9.577      1.000  1.00
  167    ASP     HN   167    ASP      N     -5.472      1.000  1.00
  168    ASP     HN   168    ASP      N     -0.456      1.000  1.00
  169    SER     HN   169    SER      N    -10.945      1.000  1.00
  170    CYS     HN   170    CYS      N     -2.189      1.000  1.00
  171    SER     HN   171    SER      N    -10.763      1.000  1.00
  172    PHE     HN   172    PHE      N    -12.769      1.000  1.00
  173    VAL     HN   173    VAL      N      9.668      1.000  1.00
  174    GLY     HN   174    GLY      N     11.948      1.000  1.00
  175    LYS     HN   175    LYS      N    -13.043      1.000  1.00
  176    THR     HN   176    THR      N    -17.786      1.000  1.00
  177    TRP    HE1   177    TRP    NE1      8.300      1.000  1.00
  177    TRP     HN   177    TRP      N    -12.587      1.000  1.00
  178    THR     HN   178    THR      N     -4.378      1.000  1.00
  179    LEU     HN   179    LEU      N    -15.232      1.000  1.00
  180    TYR     HN   180    TYR      N     -8.756      1.000  1.00
  181    LEU     HN   181    LEU      N    -15.505      1.000  1.00
  182    LYS     HN   182    LYS      N    -17.421      1.000  1.00
  183    HIS     HN   183    HIS      N    -24.991      1.000  1.00
  184    VAL     HN   184    VAL      N     -7.935      1.000  1.00
  185    ALA     HN   185    ALA      N     -5.472      1.000  1.00
  186    GLU     HN   186    GLU      N    -25.082      1.000  1.00
  187    CYS     HN   187    CYS      N    -12.587      1.000  1.00
  188    HIS     HN   188    HIS      N     18.789      1.000  1.00
  189    GLN     HN   189    GLN      N     11.948      1.000  1.00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  -7.696  30.141 -13.602
    2   2H5*    G   1          2H5*        G   1  -8.637  28.678 -13.255
    3    H4*    G   1           H4*        G   1  -8.003  28.649 -15.572
    4    H3*    G   1           H3*        G   1  -6.316  26.715 -13.961
    5    H2*    G   1           H2*        G   1  -5.547  25.900 -16.121
    6   2HO*    G   1          2HO*        G   1  -7.739  26.439 -17.180
    7    H1*    G   1           H1*        G   1  -4.955  28.382 -17.005
    8    H8     G   1           H8         G   1  -4.396  28.811 -13.308
    9    H1     G   1           H1         G   1   0.370  25.707 -16.307
   10   1H2     G   1          1H2         G   1  -0.316  24.940 -18.215
   11   2H2     G   1          2H2         G   1  -1.885  25.371 -18.867
   12   1H5*    G   2          1H5*        G   2  -7.859  24.472 -17.014
   13   2H5*    G   2          2H5*        G   2  -8.486  22.908 -16.494
   14    H4*    G   2           H4*        G   2  -6.907  22.656 -18.333
   15    H3*    G   2           H3*        G   2  -5.875  21.586 -15.692
   16    H2*    G   2           H2*        G   2  -4.054  20.638 -17.004
   17   2HO*    G   2          2HO*        G   2  -5.586  20.319 -18.946
   18    H1*    G   2           H1*        G   2  -3.570  22.951 -18.328
   19    H8     G   2           H8         G   2  -4.729  24.204 -14.965
   20    H1     G   2           H1         G   2   1.262  21.872 -14.890
   21   1H2     G   2          1H2         G   2   1.583  20.598 -16.604
   22   2H2     G   2          2H2         G   2   0.404  20.456 -17.892
   23   1H5*    G   3          1H5*        G   3  -5.375  18.395 -18.389
   24   2H5*    G   3          2H5*        G   3  -6.004  16.879 -17.721
   25    H4*    G   3           H4*        G   3  -3.669  16.609 -18.450
   26    H3*    G   3           H3*        G   3  -4.153  16.511 -15.447
   27    H2*    G   3           H2*        G   3  -1.846  15.826 -15.269
   28   2HO*    G   3          2HO*        G   3  -2.103  14.548 -17.401
   29    H1*    G   3           H1*        G   3  -0.905  17.626 -17.115
   30    H8     G   3           H8         G   3  -3.551  19.481 -15.120
   31    H1     G   3           H1         G   3   2.146  19.002 -12.160
   32   1H2     G   3          1H2         G   3   3.281  17.375 -13.004
   33   2H2     G   3          2H2         G   3   2.764  16.541 -14.458
   34   1H5*    C   4          1H5*        C   4  -2.040  13.004 -15.920
   35   2H5*    C   4          2H5*        C   4  -2.819  11.682 -15.051
   36    H4*    C   4           H4*        C   4  -0.569  11.885 -14.253
   37    H3*    C   4           H3*        C   4  -2.556  12.971 -12.226
   38    H2*    C   4           H2*        C   4  -0.697  13.132 -10.743
   39   2HO*    C   4          2HO*        C   4   0.204  11.001 -11.591
   40    H1*    C   4           H1*        C   4   1.084  14.007 -12.704
   41   1H4     C   4          1H4         C   4  -1.026  18.890  -9.184
   42   2H4     C   4          2H4         C   4  -2.513  18.957 -10.099
   43    H5     C   4           H5         C   4  -3.015  17.456 -11.900
   44    H6     C   4           H6         C   4  -2.248  15.466 -13.100
   45   1H5*    C   5          1H5*        C   5  -1.510  11.466  -9.324
   46   2H5*    C   5          2H5*        C   5  -2.630  10.308  -8.618
   47    H4*    C   5           H4*        C   5  -1.986  12.218  -7.172
   48    H3*    C   5           H3*        C   5  -4.472  11.009  -7.139
   49    H2*    C   5           H2*        C   5  -5.458  12.640  -8.649
   50   2HO*    C   5          2HO*        C   5  -5.776  13.405  -5.938
   51    H1*    C   5           H1*        C   5  -4.145  14.814  -7.088
   52   1H4     C   5          1H4         C   5  -6.027  18.348 -11.976
   53   2H4     C   5          2H4         C   5  -5.802  17.044 -13.109
   54    H5     C   5           H5         C   5  -5.048  14.869 -12.460
   55    H6     C   5           H6         C   5  -4.502  13.441 -10.552
   56   1H5*    A   6          1H5*        A   6  -2.388  14.196  -4.790
   57   2H5*    A   6          2H5*        A   6  -1.064  13.033  -4.761
   58    H4*    A   6           H4*        A   6  -0.371  14.921  -3.671
   59    H3*    A   6           H3*        A   6  -0.815  12.657  -1.783
   60    H2*    A   6           H2*        A   6  -0.430  14.091   0.117
   61   2HO*    A   6          2HO*        A   6   1.381  15.272  -0.369
   62    H1*    A   6           H1*        A   6  -1.523  16.427  -0.818
   63    H8     A   6           H8         A   6  -4.283  14.523  -2.020
   64   1H6     A   6          1H6         A   6  -6.188  13.698   3.835
   65   2H6     A   6          2H6         A   6  -6.604  13.495   2.151
   66    H2     A   6           H2         A   6  -2.057  15.306   3.984
   67   1H5*    U   7          1H5*        U   7   2.848  11.867   0.538
   68   2H5*    U   7          2H5*        U   7   1.943  13.278  -0.008
   69    H4*    U   7           H4*        U   7   3.826  13.955   1.353
   70    H3*    U   7           H3*        U   7   3.198  15.160  -1.081
   71    H2*    U   7           H2*        U   7   4.829  13.929  -2.291
   72   2HO*    U   7          2HO*        U   7   5.840  16.400  -1.396
   73    H1*    U   7           H1*        U   7   6.782  14.307   0.013
   74    H3     U   7           H3         U   7  10.047  12.224  -2.263
   75    H5     U   7           H5         U   7   6.924   9.440  -2.202
   76    H6     U   7           H6         U   7   5.431  11.206  -1.390
   77   1H5*    A   8          1H5*        A   8   4.305  18.797  -1.221
   78   2H5*    A   8          2H5*        A   8   3.669  19.701   0.157
   79    H4*    A   8           H4*        A   8   2.958  20.834  -1.770
   80    H3*    A   8           H3*        A   8   1.095  20.041   0.055
   81    H2*    A   8           H2*        A   8   0.516  18.067  -1.243
   82   2HO*    A   8          2HO*        A   8  -1.473  19.165  -0.708
   83    H1*    A   8           H1*        A   8   0.412  20.000  -3.557
   84    H8     A   8           H8         A   8   2.329  16.682  -3.484
   85   1H6     A   8          1H6         A   8  -1.527  15.038  -8.046
   86   2H6     A   8          2H6         A   8   0.019  14.721  -7.297
   87    H2     A   8           H2         A   8  -3.148  18.721  -6.155
   88   1H5*    C   9          1H5*        C   9  -2.079  21.639  -0.791
   89   2H5*    C   9          2H5*        C   9  -2.261  23.182   0.055
   90    H4*    C   9           H4*        C   9  -3.926  21.693   0.851
   91    H3*    C   9           H3*        C   9  -1.775  22.155   2.898
   92    H2*    C   9           H2*        C   9  -3.067  20.760   4.393
   93   2HO*    C   9          2HO*        C   9  -5.158  21.647   3.244
   94    H1*    C   9           H1*        C   9  -3.602  18.803   2.595
   95   1H4     C   9          1H4         C   9   2.050  17.315   5.280
   96   2H4     C   9          2H4         C   9   2.820  17.772   3.771
   97    H5     C   9           H5         C   9   1.681  18.993   2.066
   98    H6     C   9           H6         C   9  -0.474  19.863   1.342
   99   1H5*    C  10          1H5*        C  10  -5.182  22.554   5.008
  100   2H5*    C  10          2H5*        C  10  -5.255  23.966   6.060
  101    H4*    C  10           H4*        C  10  -5.517  21.874   7.333
  102    H3*    C  10           H3*        C  10  -2.920  23.353   7.875
  103    H2*    C  10           H2*        C  10  -2.612  21.797   9.684
  104   2HO*    C  10          2HO*        C  10  -4.977  21.703  10.209
  105    H1*    C  10           H1*        C  10  -3.258  19.603   8.138
  106   1H4     C  10          1H4         C  10   2.997  20.024   7.374
  107   2H4     C  10          2H4         C  10   2.751  20.897   5.878
  108    H5     C  10           H5         C  10   0.606  21.709   5.166
  109    H6     C  10           H6         C  10  -1.768  21.823   5.756
  110   1H5*    U  11          1H5*        U  11  -4.093  23.696  11.771
  111   2H5*    U  11          2H5*        U  11  -3.611  25.285  12.383
  112    H4*    U  11           H4*        U  11  -2.395  23.284  13.345
  113    H3*    U  11           H3*        U  11  -0.784  25.417  11.949
  114    H2*    U  11           H2*        U  11   1.130  24.360  12.919
  115   2HO*    U  11          2HO*        U  11  -0.037  23.883  15.004
  116    H1*    U  11           H1*        U  11   0.243  21.818  12.368
  117    H3     U  11           H3         U  11   3.770  22.541   9.543
  118    H5     U  11           H5         U  11   0.616  24.633   7.750
  119    H6     U  11           H6         U  11  -0.757  24.154   9.730
  120   1H5*    C  12          1H5*        C  12   1.197  26.253  15.955
  121   2H5*    C  12          2H5*        C  12   2.063  27.692  15.440
  122    H4*    C  12           H4*        C  12   2.892  24.900  15.528
  123    H3*    C  12           H3*        C  12   4.091  27.278  16.101
  124    H2*    C  12           H2*        C  12   3.996  27.984  13.760
  125   2HO*    C  12          2HO*        C  12   6.502  27.268  14.740
  126    H1*    C  12           H1*        C  12   5.246  25.275  13.168
  127   1H4     C  12          1H4         C  12   4.803  27.452   7.210
  128   2H4     C  12          2H4         C  12   3.111  27.826   7.414
  129    H5     C  12           H5         C  12   1.950  27.559   9.497
  130    H6     C  12           H6         C  12   2.188  26.867  11.837
  131   1H5*    U  13          1H5*        U  13   5.332  23.103  17.379
  132   2H5*    U  13          2H5*        U  13   6.307  23.340  18.830
  133    H4*    U  13           H4*        U  13   7.088  21.277  18.251
  134    H3*    U  13           H3*        U  13   9.036  23.136  17.574
  135    H2*    U  13           H2*        U  13   8.198  23.360  15.311
  136   2HO*    U  13          2HO*        U  13  10.327  21.465  15.404
  137    H1*    U  13           H1*        U  13   8.100  20.315  15.285
  138    H3     U  13           H3         U  13   7.337  20.515  10.811
  139    H5     U  13           H5         U  13   4.658  23.337  12.332
  140    H6     U  13           H6         U  13   5.570  22.925  14.573
  141   1H5*    U  14          1H5*        U  14  11.264  18.150  18.701
  142   2H5*    U  14          2H5*        U  14  12.698  18.634  17.797
  143    H4*    U  14           H4*        U  14   9.835  18.516  16.796
  144    H3*    U  14           H3*        U  14  11.990  16.629  16.728
  145    H2*    U  14           H2*        U  14  13.174  17.863  15.130
  146   2HO*    U  14          2HO*        U  14  11.383  16.103  13.807
  147    H1*    U  14           H1*        U  14  10.484  18.611  13.891
  148    H3     U  14           H3         U  14  12.785  20.321  10.337
  149    H5     U  14           H5         U  14  14.719  22.027  13.630
  150    H6     U  14           H6         U  14  13.300  20.668  15.104
  151   1H5*    G  15          1H5*        G  15   7.041  14.175  15.624
  152   2H5*    G  15          2H5*        G  15   7.604  15.542  14.645
  153    H4*    G  15           H4*        G  15   5.473  15.881  16.775
  154    H3*    G  15           H3*        G  15   5.112  15.069  13.880
  155    H2*    G  15           H2*        G  15   2.910  16.086  14.096
  156   2HO*    G  15          2HO*        G  15   2.691  15.458  16.450
  157    H1*    G  15           H1*        G  15   3.964  18.338  15.187
  158    H8     G  15           H8         G  15   6.747  17.396  12.876
  159    H1     G  15           H1         G  15   1.546  19.520   9.751
  160   1H2     G  15          1H2         G  15  -0.185  19.396  11.037
  161   2H2     G  15          2H2         G  15  -0.048  19.045  12.748
  162   1H5*    G  16          1H5*        G  16   1.424  14.006  15.520
  163   2H5*    G  16          2H5*        G  16   0.955  12.382  15.011
  164    H4*    G  16           H4*        G  16  -0.824  13.971  14.579
  165    H3*    G  16           H3*        G  16   0.482  12.959  12.039
  166    H2*    G  16           H2*        G  16  -1.386  14.034  10.911
  167   2HO*    G  16          2HO*        G  16  -2.932  13.507  12.734
  168    H1*    G  16           H1*        G  16  -1.123  16.348  12.299
  169    H8     G  16           H8         G  16   2.459  15.279  12.064
  170    H1     G  16           H1         G  16   0.078  16.875   6.334
  171   1H2     G  16          1H2         G  16  -2.056  17.294   6.474
  172   2H2     G  16          2H2         G  16  -2.952  16.946   7.941
  173   1H5*    G  17          1H5*        G  17  -3.406  12.067  11.062
  174   2H5*    G  17          2H5*        G  17  -3.514  10.471  10.307
  175    H4*    G  17           H4*        G  17  -4.315  12.256   8.829
  176    H3*    G  17           H3*        G  17  -1.786  10.899   7.859
  177    H2*    G  17           H2*        G  17  -2.143  12.187   5.801
  178   2HO*    G  17          2HO*        G  17  -4.552  12.074   6.023
  179    H1*    G  17           H1*        G  17  -2.359  14.511   7.076
  180    H8     G  17           H8         G  17  -0.185  12.810   9.568
  181    H1     G  17           H1         G  17   2.922  14.670   4.262
  182   1H2     G  17          1H2         G  17   1.495  15.193   2.706
  183   2H2     G  17          2H2         G  17  -0.228  14.918   2.904
  184   1H5*    C  18          1H5*        C  18  -3.686  10.392   4.477
  185   2H5*    C  18          2H5*        C  18  -3.578   8.747   3.828
  186    H4*    C  18           H4*        C  18  -2.595  10.259   2.277
  187    H3*    C  18           H3*        C  18  -0.417   8.740   3.700
  188    H2*    C  18           H2*        C  18   1.101   9.738   2.011
  189   2HO*    C  18          2HO*        C  18  -0.027  10.059   0.130
  190    H1*    C  18           H1*        C  18   0.268  12.174   2.581
  191   1H4     C  18          1H4         C  18   4.430  10.824   7.200
  192   2H4     C  18          2H4         C  18   3.101  10.469   8.274
  193    H5     C  18           H5         C  18   0.806  10.464   7.575
  194    H6     C  18           H6         C  18  -0.670  10.714   5.654
  195   1H5*    C  19          1H5*        C  19   0.782   8.184  -0.110
  196   2H5*    C  19          2H5*        C  19   1.129   6.485  -0.454
  197    H4*    C  19           H4*        C  19   3.029   7.874  -1.041
  198    H3*    C  19           H3*        C  19   3.600   6.173   1.411
  199    H2*    C  19           H2*        C  19   5.897   6.802   0.990
  200   2HO*    C  19          2HO*        C  19   5.611   6.813  -1.414
  201    H1*    C  19           H1*        C  19   5.289   9.469   0.743
  202   1H4     C  19          1H4         C  19   6.268   8.230   6.946
  203   2H4     C  19          2H4         C  19   4.571   7.869   7.161
  204    H5     C  19           H5         C  19   3.002   7.784   5.350
  205    H6     C  19           H6         C  19   2.726   8.133   2.943
  206   1H5*    U  20          1H5*        U  20   6.574   4.882  -1.152
  207   2H5*    U  20          2H5*        U  20   6.651   3.116  -1.187
  208    H4*    U  20           H4*        U  20   8.815   4.068  -0.707
  209    H3*    U  20           H3*        U  20   7.675   2.734   1.755
  210    H2*    U  20           H2*        U  20   9.957   2.905   2.584
  211   2HO*    U  20          2HO*        U  20  10.984   2.650   0.395
  212    H1*    U  20           H1*        U  20  10.077   5.532   1.924
  213    H3     U  20           H3         U  20   9.269   5.095   6.455
  214    H5     U  20           H5         U  20   5.471   5.133   4.703
  215    H6     U  20           H6         U  20   6.542   5.010   2.494
  216   1H5*    G  21          1H5*        G  21  11.192   0.813   0.800
  217   2H5*    G  21          2H5*        G  21  11.151  -0.927   1.060
  218    H4*    G  21           H4*        G  21  13.100   0.087   2.123
  219    H3*    G  21           H3*        G  21  11.045  -0.966   4.091
  220    H2*    G  21           H2*        G  21  12.774  -0.574   5.773
  221   2HO*    G  21          2HO*        G  21  14.553  -1.057   4.071
  222    H1*    G  21           H1*        G  21  13.257   1.944   4.901
  223    H8     G  21           H8         G  21   9.572   1.448   4.146
  224    H1     G  21           H1         G  21  10.799   2.380  10.391
  225   1H2     G  21          1H2         G  21  12.901   2.072  10.786
  226   2H2     G  21          2H2         G  21  14.062   1.832   9.497
  227   1H5*    G  22          1H5*        G  22  14.606  -2.685   5.167
  228   2H5*    G  22          2H5*        G  22  14.501  -4.422   5.428
  229    H4*    G  22           H4*        G  22  15.577  -3.317   7.313
  230    H3*    G  22           H3*        G  22  12.846  -4.493   7.951
  231    H2*    G  22           H2*        G  22  13.249  -3.898  10.218
  232   2HO*    G  22          2HO*        G  22  15.543  -4.546  10.180
  233    H1*    G  22           H1*        G  22  14.373  -1.443   9.690
  234    H8     G  22           H8         G  22  11.506  -1.730   7.247
  235    H1     G  22           H1         G  22   9.585  -0.573  13.273
  236   1H2     G  22          1H2         G  22  11.181  -0.993  14.657
  237   2H2     G  22          2H2         G  22  12.791  -1.439  14.121
  238   1H5*    U  23          1H5*        U  23  12.801  -8.334  10.865
  239   2H5*    U  23          2H5*        U  23  11.795  -7.024  10.209
  240    H4*    U  23           H4*        U  23  13.309  -6.906  12.830
  241    H3*    U  23           H3*        U  23  10.367  -7.057  12.065
  242    H2*    U  23           H2*        U  23   9.941  -6.283  14.284
  243   2HO*    U  23          2HO*        U  23  11.819  -7.382  15.305
  244    H1*    U  23           H1*        U  23  11.748  -4.251  13.933
  245    H3     U  23           H3         U  23   7.248  -2.994  13.477
  246    H5     U  23           H5         U  23   8.614  -3.761   9.600
  247    H6     U  23           H6         U  23  10.723  -4.593  10.558
  248   1H5*    U  24          1H5*        U  24   9.949  -9.004  15.182
  249   2H5*    U  24          2H5*        U  24   9.258 -10.632  15.137
  250    H4*    U  24           H4*        U  24   7.901  -9.291  16.579
  251    H3*    U  24           H3*        U  24   6.576  -9.565  13.876
  252    H2*    U  24           H2*        U  24   4.600  -8.792  14.905
  253   2HO*    U  24          2HO*        U  24   4.894  -9.905  16.995
  254    H1*    U  24           H1*        U  24   5.982  -6.784  16.230
  255    H3     U  24           H3         U  24   3.360  -5.090  12.786
  256    H5     U  24           H5         U  24   6.921  -6.280  10.927
  257    H6     U  24           H6         U  24   7.691  -7.180  13.079
  258   1H5*    A  25          1H5*        A  25   5.126 -13.442  12.170
  259   2H5*    A  25          2H5*        A  25   6.838 -13.734  11.933
  260    H4*    A  25           H4*        A  25   5.945 -13.107   9.826
  261    H3*    A  25           H3*        A  25   8.066 -11.602  10.797
  262    H2*    A  25           H2*        A  25   6.497  -9.893  11.618
  263   2HO*    A  25          2HO*        A  25   8.201  -8.931  10.407
  264    H1*    A  25           H1*        A  25   5.301 -10.277   8.817
  265    H8     A  25           H8         A  25   3.791  -9.618  12.398
  266   1H6     A  25          1H6         A  25   0.719  -5.035   9.496
  267   2H6     A  25          2H6         A  25   0.761  -6.023  10.942
  268    H2     A  25           H2         A  25   3.626  -6.803   6.630
  269   1H5*    G  26          1H5*        G  26   8.062 -14.019   5.407
  270   2H5*    G  26          2H5*        G  26   8.071 -12.264   5.369
  271    H4*    G  26           H4*        G  26   6.059 -13.104   7.288
  272    H3*    G  26           H3*        G  26   6.300 -15.193   5.467
  273    H2*    G  26           H2*        G  26   6.129 -13.548   3.724
  274   2HO*    G  26          2HO*        G  26   3.665 -14.990   3.978
  275    H1*    G  26           H1*        G  26   3.673 -12.745   5.320
  276    H8     G  26           H8         G  26   5.544 -12.183   2.048
  277    H1     G  26           H1         G  26   0.792  -8.052   3.158
  278   1H2     G  26          1H2         G  26   0.518  -7.841   5.287
  279   2H2     G  26          2H2         G  26   1.168  -9.003   6.433
  280   1H5*    U  27          1H5*        U  27   4.955 -15.993   8.601
  281   2H5*    U  27          2H5*        U  27   4.238 -17.616   8.740
  282    H4*    U  27           H4*        U  27   3.929 -16.837  10.883
  283    H3*    U  27           H3*        U  27   1.406 -15.889   9.460
  284    H2*    U  27           H2*        U  27   0.761 -14.818  11.502
  285   2HO*    U  27          2HO*        U  27   1.877 -16.670  12.782
  286    H1*    U  27           H1*        U  27   3.124 -13.640  12.011
  287    H3     U  27           H3         U  27   0.454 -10.425  10.111
  288    H5     U  27           H5         U  27   3.019 -11.782   7.120
  289    H6     U  27           H6         U  27   3.523 -13.740   8.505
  290   1H5*    A  28          1H5*        A  28  -0.277 -16.501  13.032
  291   2H5*    A  28          2H5*        A  28  -1.554 -17.703  12.879
  292    H4*    A  28           H4*        A  28  -2.467 -15.710  13.884
  293    H3*    A  28           H3*        A  28  -3.389 -16.053  11.003
  294    H2*    A  28           H2*        A  28  -4.826 -14.147  11.419
  295   2HO*    A  28          2HO*        A  28  -5.180 -14.848  13.755
  296    H1*    A  28           H1*        A  28  -2.875 -12.675  12.612
  297    H8     A  28           H8         A  28  -0.747 -14.292  10.062
  298   1H6     A  28          1H6         A  28  -3.131 -10.252   5.967
  299   2H6     A  28          2H6         A  28  -1.871 -11.446   6.227
  300    H2     A  28           H2         A  28  -5.952 -10.591   9.367
  301   1H5*    C  29          1H5*        C  29  -6.903 -15.396  12.254
  302   2H5*    C  29          2H5*        C  29  -8.129 -16.556  11.730
  303    H4*    C  29           H4*        C  29  -8.613 -14.371  10.806
  304    H3*    C  29           H3*        C  29  -7.628 -16.323   8.712
  305    H2*    C  29           H2*        C  29  -8.160 -14.582   7.086
  306   2HO*    C  29          2HO*        C  29 -10.107 -13.847   8.370
  307    H1*    C  29           H1*        C  29  -6.960 -12.613   8.428
  308   1H4     C  29          1H4         C  29  -2.334 -15.204   4.885
  309   2H4     C  29          2H4         C  29  -1.802 -16.121   6.275
  310    H5     C  29           H5         C  29  -3.029 -16.236   8.325
  311    H6     C  29           H6         C  29  -5.016 -15.427   9.494
  312   1H5*    C  30          1H5*        C  30 -11.260 -15.143   7.057
  313   2H5*    C  30          2H5*        C  30 -12.153 -16.505   6.366
  314    H4*    C  30           H4*        C  30 -11.644 -14.804   4.672
  315    H3*    C  30           H3*        C  30 -10.066 -17.362   4.277
  316    H2*    C  30           H2*        C  30  -9.462 -16.401   2.127
  317   2HO*    C  30          2HO*        C  30 -11.676 -15.259   1.989
  318    H1*    C  30           H1*        C  30  -8.865 -13.968   3.231
  319   1H4     C  30          1H4         C  30  -3.643 -17.658   3.085
  320   2H4     C  30          2H4         C  30  -3.995 -18.260   4.689
  321    H5     C  30           H5         C  30  -5.989 -17.685   5.903
  322    H6     C  30           H6         C  30  -8.089 -16.429   5.784
  323   1H5*    U  31          1H5*        U  31 -12.200 -16.551   0.625
  324   2H5*    U  31          2H5*        U  31 -13.167 -17.939   0.129
  325    H4*    U  31           H4*        U  31 -12.080 -16.949  -1.789
  326    H3*    U  31           H3*        U  31 -10.888 -19.635  -1.072
  327    H2*    U  31           H2*        U  31  -9.692 -19.490  -3.145
  328   2HO*    U  31          2HO*        U  31 -11.567 -18.405  -4.272
  329    H1*    U  31           H1*        U  31  -8.944 -16.881  -2.783
  330    H3     U  31           H3         U  31  -5.184 -19.458  -2.028
  331    H5     U  31           H5         U  31  -7.101 -19.164   1.688
  332    H6     U  31           H6         U  31  -9.063 -18.233   0.551
  333   1H5*    C  32          1H5*        C  32 -12.101 -20.546  -4.732
  334   2H5*    C  32          2H5*        C  32 -12.882 -22.124  -4.884
  335    H4*    C  32           H4*        C  32 -10.844 -22.073  -6.204
  336    H3*    C  32           H3*        C  32 -10.501 -23.786  -3.719
  337    H2*    C  32           H2*        C  32  -8.334 -24.354  -4.617
  338   2HO*    C  32          2HO*        C  32  -9.296 -24.280  -6.930
  339    H1*    C  32           H1*        C  32  -7.728 -21.782  -5.402
  340   1H4     C  32          1H4         C  32  -5.256 -22.900   0.375
  341   2H4     C  32          2H4         C  32  -6.788 -22.554   1.143
  342    H5     C  32           H5         C  32  -8.778 -22.006  -0.080
  343    H6     C  32           H6         C  32  -9.720 -21.752  -2.327
  344   1H5*    U  33          1H5*        U  33  -8.731 -26.215  -6.086
  345   2H5*    U  33          2H5*        U  33  -9.478 -27.812  -6.168
  346    H4*    U  33           H4*        U  33  -7.153 -28.119  -5.579
  347    H3*    U  33           H3*        U  33  -8.979 -28.429  -3.176
  348    H2*    U  33           H2*        U  33  -7.181 -29.000  -1.908
  349   2HO*    U  33          2HO*        U  33  -5.248 -29.362  -4.001
  350    H1*    U  33           H1*        U  33  -5.339 -27.327  -3.255
  351    H3     U  33           H3         U  33  -5.239 -26.139   1.157
  352    H5     U  33           H5         U  33  -9.144 -25.180   0.007
  353    H6     U  33           H6         U  33  -8.643 -26.045  -2.238
  354   1H5*    U  34          1H5*        U  34  -9.289 -34.079  -3.097
  355   2H5*    U  34          2H5*        U  34  -8.529 -33.295  -1.709
  356    H4*    U  34           H4*        U  34  -7.445 -35.414  -2.245
  357    H3*    U  34           H3*        U  34  -5.982 -33.172  -1.649
  358    H2*    U  34           H2*        U  34  -5.680 -32.532  -3.941
  359   2HO*    U  34          2HO*        U  34  -3.466 -34.146  -3.129
  360    H1*    U  34           H1*        U  34  -5.051 -35.455  -4.515
  361    H3     U  34           H3         U  34  -4.060 -34.508  -8.817
  362    H5     U  34           H5         U  34  -7.350 -32.026  -8.104
  363    H6     U  34           H6         U  34  -7.407 -32.853  -5.792
  364   1H5*    C  35          1H5*        C  35  -2.526 -33.554  -0.987
  365   2H5*    C  35          2H5*        C  35  -2.191 -34.606   0.388
  366    H4*    C  35           H4*        C  35  -1.104 -32.446   0.617
  367    H3*    C  35           H3*        C  35  -2.331 -33.677   2.726
  368    H2*    C  35           H2*        C  35  -4.434 -32.585   2.372
  369   2HO*    C  35          2HO*        C  35  -2.902 -31.109   4.268
  370    H1*    C  35           H1*        C  35  -2.994 -29.935   2.015
  371   1H4     C  35          1H4         C  35  -9.151 -28.703   0.854
  372   2H4     C  35          2H4         C  35  -9.179 -29.879  -0.449
  373    H5     C  35           H5         C  35  -7.339 -31.316  -0.925
  374    H6     C  35           H6         C  35  -4.986 -31.760  -0.451
  375   1H5*    G  36          1H5*        G  36   2.267 -30.587   3.007
  376   2H5*    G  36          2H5*        G  36   0.710 -30.497   2.167
  377    H4*    G  36           H4*        G  36   3.200 -31.879   1.094
  378    H3*    G  36           H3*        G  36   1.800 -29.279   0.358
  379    H2*    G  36           H2*        G  36   2.571 -29.631  -1.856
  380   2HO*    G  36          2HO*        G  36   4.785 -30.339  -0.860
  381    H1*    G  36           H1*        G  36   2.503 -32.466  -1.651
  382    H8     G  36           H8         G  36   1.170 -32.632  -3.911
  383    H1     G  36           H1         G  36  -3.289 -28.428  -1.927
  384   1H2     G  36          1H2         G  36  -2.808 -27.670   0.009
  385   2H2     G  36          2H2         G  36  -1.349 -28.124   0.862
  386   1H5*    G  37          1H5*        G  37   4.380 -28.153  -1.551
  387   2H5*    G  37          2H5*        G  37   4.907 -26.474  -1.425
  388    H4*    G  37           H4*        G  37   3.540 -27.137  -3.489
  389    H3*    G  37           H3*        G  37   2.536 -24.843  -1.762
  390    H2*    G  37           H2*        G  37   0.989 -24.497  -3.651
  391   2HO*    G  37          2HO*        G  37   2.702 -25.373  -5.261
  392    H1*    G  37           H1*        G  37   0.248 -27.082  -3.721
  393    H8     G  37           H8         G  37   1.087 -26.220  -0.076
  394    H1     G  37           H1         G  37  -4.415 -23.641  -2.162
  395   1H2     G  37          1H2         G  37  -4.614 -23.955  -4.287
  396   2H2     G  37          2H2         G  37  -3.505 -24.968  -5.187
  397   1H5*    U  38          1H5*        U  38   2.040 -23.428  -5.470
  398   2H5*    U  38          2H5*        U  38   2.786 -21.877  -5.817
  399    H4*    U  38           H4*        U  38   0.456 -21.899  -6.486
  400    H3*    U  38           H3*        U  38   0.946 -20.106  -4.125
  401    H2*    U  38           H2*        U  38  -1.243 -19.201  -4.547
  402   2HO*    U  38          2HO*        U  38  -1.223 -19.323  -6.892
  403    H1*    U  38           H1*        U  38  -2.372 -21.675  -4.704
  404    H3     U  38           H3         U  38  -3.394 -20.277  -0.449
  405    H5     U  38           H5         U  38   0.443 -21.901  -0.119
  406    H6     U  38           H6         U  38   0.524 -22.078  -2.559
  407   1H5*    G  39          1H5*        G  39   0.009 -17.421  -7.123
  408   2H5*    G  39          2H5*        G  39   0.937 -15.932  -6.963
  409    H4*    G  39           H4*        G  39  -1.401 -15.453  -6.989
  410    H3*    G  39           H3*        G  39  -0.368 -15.077  -4.172
  411    H2*    G  39           H2*        G  39  -2.570 -14.077  -3.783
  412   2HO*    G  39          2HO*        G  39  -2.726 -13.222  -6.088
  413    H1*    G  39           H1*        G  39  -3.832 -16.199  -4.860
  414    H8     G  39           H8         G  39  -0.530 -17.466  -3.363
  415    H1     G  39           H1         G  39  -5.106 -16.288   0.989
  416   1H2     G  39          1H2         G  39  -6.715 -15.173   0.076
  417   2H2     G  39          2H2         G  39  -6.784 -14.880  -1.648
  418   1H5*    G  40          1H5*        G  40  -2.229 -11.560  -5.176
  419   2H5*    G  40          2H5*        G  40  -1.398 -10.130  -4.543
  420    H4*    G  40           H4*        G  40  -3.769 -10.108  -3.993
  421    H3*    G  40           H3*        G  40  -1.828 -10.306  -1.666
  422    H2*    G  40           H2*        G  40  -3.795 -10.084  -0.243
  423   2HO*    G  40          2HO*        G  40  -4.852  -8.575  -1.934
  424    H1*    G  40           H1*        G  40  -5.279 -11.888  -1.567
  425    H8     G  40           H8         G  40  -1.822 -13.342  -1.908
  426    H1     G  40           H1         G  40  -4.077 -13.688   4.096
  427   1H2     G  40          1H2         G  40  -5.874 -12.514   4.294
  428   2H2     G  40          2H2         G  40  -6.529 -11.592   2.957
  429   1H5*    G  41          1H5*        G  41  -4.093  -7.912   0.083
  430   2H5*    G  41          2H5*        G  41  -3.309  -6.466   0.703
  431    H4*    G  41           H4*        G  41  -4.206  -7.659   2.580
  432    H3*    G  41           H3*        G  41  -1.205  -7.994   2.366
  433    H2*    G  41           H2*        G  41  -1.325  -9.032   4.571
  434   2HO*    G  41          2HO*        G  41  -3.112  -7.813   5.477
  435    H1*    G  41           H1*        G  41  -3.265 -10.723   3.810
  436    H8     G  41           H8         G  41  -1.456 -10.122   0.544
  437    H1     G  41           H1         G  41   1.587 -14.250   4.408
  438   1H2     G  41          1H2         G  41   0.826 -14.134   6.401
  439   2H2     G  41          2H2         G  41  -0.483 -13.066   6.864
  440   1H5*    A  42          1H5*        A  42  -0.455  -4.453   6.384
  441   2H5*    A  42          2H5*        A  42  -0.204  -5.890   7.374
  442    H4*    A  42           H4*        A  42  -2.857  -4.979   6.191
  443    H3*    A  42           H3*        A  42  -1.718  -5.311   8.986
  444    H2*    A  42           H2*        A  42  -3.962  -5.778   9.772
  445   2HO*    A  42          2HO*        A  42  -4.955  -4.272   8.069
  446    H1*    A  42           H1*        A  42  -4.406  -7.654   7.903
  447    H8     A  42           H8         A  42  -0.879  -8.395   7.935
  448   1H6     A  42          1H6         A  42  -1.492 -10.829  13.626
  449   2H6     A  42          2H6         A  42  -0.513 -10.821  12.176
  450    H2     A  42           H2         A  42  -5.115  -8.415  12.782
  451   1H5*    A  43          1H5*        A  43  -4.520  -2.945   9.618
  452   2H5*    A  43          2H5*        A  43  -4.571  -1.408  10.452
  453    H4*    A  43           H4*        A  43  -5.838  -3.013  11.735
  454    H3*    A  43           H3*        A  43  -3.133  -2.477  13.030
  455    H2*    A  43           H2*        A  43  -3.750  -4.026  14.766
  456   2HO*    A  43          2HO*        A  43  -6.097  -3.204  14.635
  457    H1*    A  43           H1*        A  43  -4.866  -5.902  13.039
  458    H8     A  43           H8         A  43  -1.930  -4.914  11.064
  459   1H6     A  43          1H6         A  43   1.448  -8.690  14.633
  460   2H6     A  43          2H6         A  43   1.362  -7.891  13.074
  461    H2     A  43           H2         A  43  -2.327  -7.788  16.794
  462   1H5*    U  44          1H5*        U  44  -4.978  -1.985  16.345
  463   2H5*    U  44          2H5*        U  44  -4.546  -0.465  17.146
  464    H4*    U  44           H4*        U  44  -3.691  -2.285  18.473
  465    H3*    U  44           H3*        U  44  -1.475  -0.944  16.887
  466    H2*    U  44           H2*        U  44   0.038  -2.260  18.205
  467   2HO*    U  44          2HO*        U  44  -1.429  -2.080  20.187
  468    H1*    U  44           H1*        U  44  -1.425  -4.559  17.919
  469    H3     U  44           H3         U  44   2.228  -5.077  15.170
  470    H5     U  44           H5         U  44  -0.353  -2.630  12.967
  471    H6     U  44           H6         U  44  -1.778  -2.436  14.951
  472   1H5*    A  45          1H5*        A  45  -0.054  -0.636  20.707
  473   2H5*    A  45          2H5*        A  45   0.731   0.919  21.004
  474    H4*    A  45           H4*        A  45   2.259  -0.929  21.394
  475    H3*    A  45           H3*        A  45   3.024   0.643  18.900
  476    H2*    A  45           H2*        A  45   5.084  -0.608  19.035
  477   2HO*    A  45          2HO*        A  45   5.038  -0.680  21.492
  478    H1*    A  45           H1*        A  45   3.792  -2.978  19.328
  479    H8     A  45           H8         A  45   1.525  -0.764  17.195
  480   1H6     A  45          1H6         A  45   5.054  -2.460  12.353
  481   2H6     A  45          2H6         A  45   3.530  -1.738  12.832
  482    H2     A  45           H2         A  45   7.013  -3.904  16.052
  483   1H5*    C  46          1H5*        C  46   6.283   0.819  21.411
  484   2H5*    C  46          2H5*        C  46   6.997   2.431  21.464
  485    H4*    C  46           H4*        C  46   8.661   0.759  20.907
  486    H3*    C  46           H3*        C  46   8.004   2.546  18.532
  487    H2*    C  46           H2*        C  46  10.011   1.592  17.587
  488   2HO*    C  46          2HO*        C  46  11.096   1.436  19.798
  489    H1*    C  46           H1*        C  46   9.290  -0.957  18.289
  490   1H4     C  46          1H4         C  46   7.015   0.174  12.429
  491   2H4     C  46          2H4         C  46   5.498   0.721  13.108
  492    H5     C  46           H5         C  46   5.130   0.996  15.465
  493    H6     C  46           H6         C  46   6.162   0.777  17.680
  494   1H5*    C  47          1H5*        C  47  12.025   3.069  19.228
  495   2H5*    C  47          2H5*        C  47  12.532   4.752  19.075
  496    H4*    C  47           H4*        C  47  13.850   3.299  17.635
  497    H3*    C  47           H3*        C  47  11.969   5.073  16.047
  498    H2*    C  47           H2*        C  47  13.329   4.390  14.152
  499   2HO*    C  47          2HO*        C  47  15.371   4.266  15.517
  500    H1*    C  47           H1*        C  47  13.230   1.756  14.890
  501   1H4     C  47          1H4         C  47   8.256   2.789  11.033
  502   2H4     C  47          2H4         C  47   7.269   3.272  12.394
  503    H5     C  47           H5         C  47   8.115   3.479  14.631
  504    H6     C  47           H6         C  47  10.114   3.251  16.032
  505   1H5*    A  48          1H5*        A  48  15.849   6.013  14.776
  506   2H5*    A  48          2H5*        A  48  16.060   7.744  14.514
  507    H4*    A  48           H4*        A  48  16.735   6.462  12.562
  508    H3*    A  48           H3*        A  48  14.192   8.039  12.072
  509    H2*    A  48           H2*        A  48  14.599   7.492   9.730
  510   2HO*    A  48          2HO*        A  48  17.053   7.513  10.056
  511    H1*    A  48           H1*        A  48  14.958   4.862  10.290
  512    H8     A  48           H8         A  48  12.486   6.026  12.915
  513   1H6     A  48          1H6         A  48   8.096   5.543   8.529
  514   2H6     A  48          2H6         A  48   8.401   5.781  10.238
  515    H2     A  48           H2         A  48  12.052   5.147   6.552
  516   1H5*    G  49          1H5*        G  49  16.869   9.250   9.179
  517   2H5*    G  49          2H5*        G  49  16.861  10.988   8.897
  518    H4*    G  49           H4*        G  49  16.575   9.745   6.822
  519    H3*    G  49           H3*        G  49  14.054  11.231   7.645
  520    H2*    G  49           H2*        G  49  13.301  10.672   5.383
  521   2HO*    G  49          2HO*        G  49  15.667  10.782   4.549
  522    H1*    G  49           H1*        G  49  14.013   8.073   5.636
  523    H8     G  49           H8         G  49  12.988   9.016   9.151
  524    H1     G  49           H1         G  49   8.007   8.458   5.119
  525   1H2     G  49          1H2         G  49   8.701   8.555   3.078
  526   2H2     G  49          2H2         G  49  10.405   8.493   2.673
  527   1H5*    G  50          1H5*        G  50  14.666  12.332   3.792
  528   2H5*    G  50          2H5*        G  50  14.608  14.071   3.527
  529    H4*    G  50           H4*        G  50  13.156  12.871   1.963
  530    H3*    G  50           H3*        G  50  11.634  14.546   3.994
  531    H2*    G  50           H2*        G  50   9.683  14.058   2.605
  532   2HO*    G  50          2HO*        G  50  11.062  14.067   0.552
  533    H1*    G  50           H1*        G  50  10.283  11.400   2.394
  534    H8     G  50           H8         G  50  11.367  12.042   5.917
  535    H1     G  50           H1         G  50   4.969  11.831   5.211
  536   1H2     G  50          1H2         G  50   4.459  11.897   3.135
  537   2H2     G  50          2H2         G  50   5.653  12.183   1.887
  538   1H5*    U  51          1H5*        U  51  10.184  15.785   0.403
  539   2H5*    U  51          2H5*        U  51  10.431  17.501   0.066
  540    H4*    U  51           H4*        U  51   8.121  16.863  -0.392
  541    H3*    U  51           H3*        U  51   8.893  19.017   1.260
  542    H2*    U  51           H2*        U  51   8.227  18.140   3.225
  543   2HO*    U  51          2HO*        U  51   5.513  18.641   2.509
  544    H1*    U  51           H1*        U  51   5.940  16.606   2.003
  545    H3     U  51           H3         U  51   4.925  15.099   6.063
  546    H5     U  51           H5         U  51   9.092  15.472   6.287
  547    H6     U  51           H6         U  51   9.116  16.027   3.895
  548   1H5*    G  52          1H5*        G  52   7.853  21.433  -2.599
  549   2H5*    G  52          2H5*        G  52   6.238  21.695  -3.227
  550    H4*    G  52           H4*        G  52   7.587  18.987  -2.911
  551    H3*    G  52           H3*        G  52   6.702  20.707  -5.263
  552    H2*    G  52           H2*        G  52   6.602  18.651  -6.529
  553   2HO*    G  52          2HO*        G  52   8.533  17.718  -5.327
  554    H1*    G  52           H1*        G  52   5.275  17.337  -4.527
  555    H8     G  52           H8         G  52   4.009  20.932  -4.506
  556    H1     G  52           H1         G  52   1.310  17.178  -8.974
  557   1H2     G  52          1H2         G  52   2.578  15.476  -9.369
  558   2H2     G  52          2H2         G  52   3.992  15.123  -8.395
  559   1H5*    C  53          1H5*        C  53   9.467  18.265  -7.176
  560   2H5*    C  53          2H5*        C  53  10.452  19.193  -8.313
  561    H4*    C  53           H4*        C  53   9.349  17.334  -9.422
  562    H3*    C  53           H3*        C  53   8.159  19.995 -10.286
  563    H2*    C  53           H2*        C  53   7.092  18.674 -12.018
  564   2HO*    C  53          2HO*        C  53   9.032  17.149 -12.147
  565    H1*    C  53           H1*        C  53   6.276  16.753 -10.258
  566   1H4     C  53          1H4         C  53   1.554  21.006 -10.365
  567   2H4     C  53          2H4         C  53   2.319  21.921  -9.086
  568    H5     C  53           H5         C  53   4.545  21.483  -8.305
  569    H6     C  53           H6         C  53   6.428  19.921  -8.457
  570   1H5*    C  54          1H5*        C  54   9.326  18.201 -13.840
  571   2H5*    C  54          2H5*        C  54  10.084  19.343 -14.946
  572    H4*    C  54           H4*        C  54   8.222  18.200 -16.010
  573    H3*    C  54           H3*        C  54   7.606  21.132 -15.494
  574    H2*    C  54           H2*        C  54   5.711  20.745 -16.949
  575   2HO*    C  54          2HO*        C  54   6.982  19.122 -18.308
  576    H1*    C  54           H1*        C  54   5.011  18.429 -15.681
  577   1H4     C  54          1H4         C  54   1.890  23.077 -12.651
  578   2H4     C  54          2H4         C  54   3.231  23.288 -11.550
  579    H5     C  54           H5         C  54   5.338  22.174 -11.811
  580    H6     C  54           H6         C  54   6.573  20.545 -13.165
  581   1H5*    C  55          1H5*        C  55   7.010  20.672 -19.603
  582   2H5*    C  55          2H5*        C  55   7.724  22.020 -20.501
  583    H4*    C  55           H4*        C  55   5.367  21.753 -21.065
  584    H3*    C  55           H3*        C  55   5.967  24.253 -19.460
  585    H2*    C  55           H2*        C  55   3.722  24.917 -19.927
  586   2HO*    C  55          2HO*        C  55   3.803  24.056 -22.198
  587    H1*    C  55           H1*        C  55   2.651  22.396 -19.513
  588   1H4     C  55          1H4         C  55   2.019  25.856 -14.177
  589   2H4     C  55          2H4         C  55   3.645  25.445 -13.681
  590    H5     C  55           H5         C  55   5.148  24.154 -15.032
  591    H6     C  55           H6         C  55   5.400  22.986 -17.172
  592   1H    MET 104          1H        MET 104  10.506 -15.326   3.469
  593    HA   MET 104           HA       MET 104  11.126 -12.465   3.016
  594   1HB   MET 104          1HB       MET 104  13.027 -13.478   4.337
  595   2HB   MET 104          2HB       MET 104  13.297 -14.612   3.021
  596   1HG   MET 104          1HG       MET 104  14.554 -13.128   1.955
  597   2HG   MET 104          2HG       MET 104  13.247 -11.955   1.890
  598   1HE   MET 104          1HE       MET 104  13.820  -9.721   5.035
  599   2HE   MET 104          2HE       MET 104  13.233  -9.670   3.365
  600   3HE   MET 104          3HE       MET 104  12.573 -10.868   4.510
  601    H    TYR 105           H        TYR 105  10.896 -11.940   0.919
  602    HA   TYR 105           HA       TYR 105  10.552 -14.182  -1.047
  603   1HB   TYR 105          1HB       TYR 105   9.279 -11.442  -0.766
  604   2HB   TYR 105          2HB       TYR 105   9.238 -12.314  -2.291
  605    HD1  TYR 105           HD1      TYR 105   7.577 -13.880  -2.730
  606    HD2  TYR 105           HD2      TYR 105   8.454 -12.968   1.421
  607    HE1  TYR 105           HE1      TYR 105   5.714 -15.350  -1.983
  608    HE2  TYR 105           HE2      TYR 105   6.743 -14.601   2.127
  609    HH   TYR 105           HH       TYR 105   4.957 -15.848   1.483
  610    H    VAL 106           H        VAL 106  11.979 -14.398  -2.645
  611    HA   VAL 106           HA       VAL 106  14.024 -12.231  -2.935
  612    HB   VAL 106           HB       VAL 106  14.205 -15.219  -3.467
  613   1HG1  VAL 106          1HG1      VAL 106  16.667 -14.877  -3.492
  614   2HG1  VAL 106          2HG1      VAL 106  15.879 -14.042  -4.821
  615   3HG1  VAL 106          3HG1      VAL 106  16.421 -13.123  -3.396
  616   1HG2  VAL 106          1HG2      VAL 106  13.961 -14.780  -1.080
  617   2HG2  VAL 106          2HG2      VAL 106  15.608 -15.297  -1.469
  618   3HG2  VAL 106          3HG2      VAL 106  15.265 -13.561  -1.162
  619    H    CYS 107           H        CYS 107  14.621 -11.414  -4.869
  620    HA   CYS 107           HA       CYS 107  13.057 -12.022  -7.264
  621   1HB   CYS 107          1HB       CYS 107  13.805  -9.704  -6.718
  622   2HB   CYS 107          2HB       CYS 107  15.485 -10.239  -6.811
  623    H    HIS 108           H        HIS 108  13.579 -13.468  -8.777
  624    HA   HIS 108           HA       HIS 108  16.262 -14.766  -8.605
  625   1HB   HIS 108          1HB       HIS 108  13.620 -15.836  -9.703
  626   2HB   HIS 108          2HB       HIS 108  15.150 -16.723  -9.673
  627    HD2  HIS 108           HD2      HIS 108  12.148 -16.934  -7.852
  628    HE1  HIS 108           HE1      HIS 108  14.937 -16.980  -4.613
  629    HE2  HIS 108           HE2      HIS 108  12.523 -17.454  -5.297
  630    H    PHE 109           H        PHE 109  15.445 -12.229 -10.112
  631    HA   PHE 109           HA       PHE 109  15.648 -12.787 -12.943
  632   1HB   PHE 109          1HB       PHE 109  15.068 -10.543 -11.643
  633   2HB   PHE 109          2HB       PHE 109  16.805 -10.283 -11.651
  634    HD1  PHE 109           HD1      PHE 109  13.717 -10.380 -13.546
  635    HD2  PHE 109           HD2      PHE 109  17.986  -9.861 -13.759
  636    HE1  PHE 109           HE1      PHE 109  13.464  -9.579 -15.892
  637    HE2  PHE 109           HE2      PHE 109  17.741  -9.015 -16.123
  638    HZ   PHE 109           HZ       PHE 109  15.467  -8.869 -17.170
  639    H    GLU 110           H        GLU 110  17.544 -12.582 -14.292
  640    HA   GLU 110           HA       GLU 110  19.591 -14.287 -13.486
  641   1HB   GLU 110          1HB       GLU 110  19.002 -13.697 -15.834
  642   2HB   GLU 110          2HB       GLU 110  19.778 -12.123 -15.639
  643   1HG   GLU 110          1HG       GLU 110  21.957 -13.252 -15.221
  644   2HG   GLU 110          2HG       GLU 110  21.169 -14.826 -15.326
  645    H    ASN 111           H        ASN 111  20.999 -14.037 -11.847
  646    HA   ASN 111           HA       ASN 111  22.898 -13.290 -10.760
  647   1HB   ASN 111          1HB       ASN 111  23.559 -12.569 -13.182
  648   2HB   ASN 111          2HB       ASN 111  23.140 -10.928 -12.680
  649   1HD2  ASN 111          1HD2      ASN 111  25.108 -13.748 -11.537
  650   2HD2  ASN 111          2HD2      ASN 111  26.430 -12.732 -10.981
  651    H    CYS 112           H        CYS 112  19.991 -12.028 -10.511
  652    HA   CYS 112           HA       CYS 112  20.575  -9.431  -9.277
  653   1HB   CYS 112          1HB       CYS 112  18.523  -9.806 -10.561
  654   2HB   CYS 112          2HB       CYS 112  17.967 -11.022  -9.385
  655    H    GLY 113           H        GLY 113  18.537 -12.072  -7.909
  656   1HA   GLY 113          1HA       GLY 113  18.639 -13.219  -5.902
  657   2HA   GLY 113          2HA       GLY 113  20.321 -12.687  -5.744
  658    H    LYS 114           H        LYS 114  18.029 -10.064  -6.079
  659    HA   LYS 114           HA       LYS 114  18.590  -9.085  -3.393
  660   1HB   LYS 114          1HB       LYS 114  17.998  -7.824  -5.607
  661   2HB   LYS 114          2HB       LYS 114  16.318  -8.072  -5.117
  662   1HG   LYS 114          1HG       LYS 114  16.676  -6.767  -3.089
  663   2HG   LYS 114          2HG       LYS 114  18.443  -6.790  -3.322
  664   1HD   LYS 114          1HD       LYS 114  18.226  -5.478  -5.394
  665   2HD   LYS 114          2HD       LYS 114  16.474  -5.539  -5.236
  666   1HE   LYS 114          1HE       LYS 114  17.197  -3.386  -4.656
  667   2HE   LYS 114          2HE       LYS 114  16.527  -4.184  -3.222
  668   1HZ   LYS 114          1HZ       LYS 114  18.816  -4.605  -2.475
  669   2HZ   LYS 114          2HZ       LYS 114  19.435  -3.895  -3.812
  670   3HZ   LYS 114          3HZ       LYS 114  18.612  -3.008  -2.719
  671    H    ALA 115           H        ALA 115  17.284  -9.013  -1.560
  672    HA   ALA 115           HA       ALA 115  14.883 -10.811  -1.627
  673   1HB   ALA 115          1HB       ALA 115  15.535 -11.539   0.609
  674   2HB   ALA 115          2HB       ALA 115  16.853 -11.813  -0.539
  675   3HB   ALA 115          3HB       ALA 115  16.937 -10.442   0.600
  676    H    PHE 116           H        PHE 116  13.017 -10.168  -0.660
  677    HA   PHE 116           HA       PHE 116  13.010  -7.501   0.710
  678   1HB   PHE 116          1HB       PHE 116  10.778  -8.628  -1.022
  679   2HB   PHE 116          2HB       PHE 116  10.957  -7.026  -0.370
  680    HD1  PHE 116           HD1      PHE 116  12.362  -9.420  -2.860
  681    HD2  PHE 116           HD2      PHE 116  12.204  -5.316  -1.553
  682    HE1  PHE 116           HE1      PHE 116  13.837  -8.801  -4.722
  683    HE2  PHE 116           HE2      PHE 116  13.722  -4.689  -3.445
  684    HZ   PHE 116           HZ       PHE 116  14.570  -6.487  -4.981
  685    H    LYS 117           H        LYS 117  11.415  -7.121   2.286
  686    HA   LYS 117           HA       LYS 117  10.844  -9.313   4.001
  687   1HB   LYS 117          1HB       LYS 117  11.054  -6.835   4.578
  688   2HB   LYS 117          2HB       LYS 117   9.390  -6.619   4.014
  689   1HG   LYS 117          1HG       LYS 117   8.593  -8.239   5.668
  690   2HG   LYS 117          2HG       LYS 117  10.268  -8.661   6.052
  691   1HD   LYS 117          1HD       LYS 117  10.546  -6.216   6.829
  692   2HD   LYS 117          2HD       LYS 117   8.788  -6.069   6.688
  693   1HE   LYS 117          1HE       LYS 117   9.581  -6.601   9.008
  694   2HE   LYS 117          2HE       LYS 117   8.432  -7.782   8.355
  695   1HZ   LYS 117          1HZ       LYS 117  11.344  -8.182   8.305
  696   2HZ   LYS 117          2HZ       LYS 117  10.337  -8.796   9.488
  697   3HZ   LYS 117          3HZ       LYS 117  10.149  -9.296   7.947
  698    H    LYS 118           H        LYS 118   8.820  -7.639   1.544
  699    HA   LYS 118           HA       LYS 118   6.726  -9.770   1.925
  700   1HB   LYS 118          1HB       LYS 118   6.200  -6.800   1.496
  701   2HB   LYS 118          2HB       LYS 118   4.979  -8.038   1.756
  702   1HG   LYS 118          1HG       LYS 118   7.096  -7.235   3.821
  703   2HG   LYS 118          2HG       LYS 118   5.497  -6.533   3.733
  704   1HD   LYS 118          1HD       LYS 118   4.416  -8.407   4.463
  705   2HD   LYS 118          2HD       LYS 118   5.690  -9.505   3.911
  706   1HE   LYS 118          1HE       LYS 118   5.289  -9.324   6.454
  707   2HE   LYS 118          2HE       LYS 118   6.912  -9.380   5.796
  708   1HZ   LYS 118          1HZ       LYS 118   7.073  -6.974   6.096
  709   2HZ   LYS 118          2HZ       LYS 118   5.495  -6.858   6.490
  710   3HZ   LYS 118          3HZ       LYS 118   6.486  -7.631   7.507
  711    H    HIS 119           H        HIS 119   5.457 -10.299   0.075
  712    HA   HIS 119           HA       HIS 119   7.071 -10.433  -2.276
  713   1HB   HIS 119          1HB       HIS 119   5.094 -11.503  -3.339
  714   2HB   HIS 119          2HB       HIS 119   5.551 -12.176  -1.798
  715    HD1  HIS 119           HD1      HIS 119   2.805  -9.471  -2.685
  716    HD2  HIS 119           HD2      HIS 119   3.644 -13.019  -0.545
  717    HE1  HIS 119           HE1      HIS 119   0.701 -10.013  -1.276
  718    HE2  HIS 119           HE2      HIS 119   1.186 -12.217  -0.114
  719    H    ASN 120           H        ASN 120   4.517  -8.129  -1.396
  720    HA   ASN 120           HA       ASN 120   4.067  -7.102  -4.059
  721   1HB   ASN 120          1HB       ASN 120   3.561  -4.932  -2.440
  722   2HB   ASN 120          2HB       ASN 120   2.435  -6.197  -2.833
  723   1HD2  ASN 120          1HD2      ASN 120   1.265  -6.937  -1.129
  724   2HD2  ASN 120          2HD2      ASN 120   1.869  -7.017   0.500
  725    H    GLN 121           H        GLN 121   6.610  -6.566  -1.635
  726    HA   GLN 121           HA       GLN 121   7.777  -4.237  -2.996
  727   1HB   GLN 121          1HB       GLN 121   9.196  -6.113  -1.112
  728   2HB   GLN 121          2HB       GLN 121   9.555  -4.416  -1.500
  729   1HG   GLN 121          1HG       GLN 121   7.539  -3.720  -0.285
  730   2HG   GLN 121          2HG       GLN 121   7.236  -5.432   0.139
  731   1HE2  GLN 121          1HE2      GLN 121   8.941  -2.574   1.145
  732   2HE2  GLN 121          2HE2      GLN 121   9.841  -3.413   2.435
  733    H    LEU 122           H        LEU 122   8.298  -7.809  -2.927
  734    HA   LEU 122           HA       LEU 122  10.543  -7.881  -4.662
  735   1HB   LEU 122          1HB       LEU 122   9.883  -9.842  -3.428
  736   2HB   LEU 122          2HB       LEU 122   8.279  -9.851  -4.127
  737    HG   LEU 122           HG       LEU 122   9.128 -10.502  -6.308
  738   1HD1  LEU 122          1HD1      LEU 122  11.369  -9.384  -6.158
  739   2HD1  LEU 122          2HD1      LEU 122  11.833 -10.599  -4.943
  740   3HD1  LEU 122          3HD1      LEU 122  11.423 -11.074  -6.619
  741   1HD2  LEU 122          1HD2      LEU 122   9.914 -12.748  -5.779
  742   2HD2  LEU 122          2HD2      LEU 122  10.323 -12.286  -4.124
  743   3HD2  LEU 122          3HD2      LEU 122   8.622 -12.302  -4.649
  744    H    LYS 123           H        LYS 123   7.017  -8.185  -5.442
  745    HA   LYS 123           HA       LYS 123   7.250  -8.143  -8.250
  746   1HB   LYS 123          1HB       LYS 123   5.066  -7.197  -6.348
  747   2HB   LYS 123          2HB       LYS 123   4.906  -7.004  -8.103
  748   1HG   LYS 123          1HG       LYS 123   5.360  -9.416  -8.431
  749   2HG   LYS 123          2HG       LYS 123   5.426  -9.651  -6.677
  750   1HD   LYS 123          1HD       LYS 123   3.082  -9.081  -6.443
  751   2HD   LYS 123          2HD       LYS 123   2.991  -8.527  -8.132
  752   1HE   LYS 123          1HE       LYS 123   3.515 -10.801  -8.935
  753   2HE   LYS 123          2HE       LYS 123   3.638 -11.382  -7.268
  754   1HZ   LYS 123          1HZ       LYS 123   1.455 -11.837  -8.291
  755   2HZ   LYS 123          2HZ       LYS 123   1.326 -10.937  -6.939
  756   3HZ   LYS 123          3HZ       LYS 123   1.153 -10.233  -8.419
  757    H    VAL 124           H        VAL 124   7.132  -5.381  -5.954
  758    HA   VAL 124           HA       VAL 124   7.108  -3.260  -7.859
  759    HB   VAL 124           HB       VAL 124   8.124  -3.548  -5.040
  760   1HG1  VAL 124          1HG1      VAL 124   8.429  -1.016  -6.680
  761   2HG1  VAL 124          2HG1      VAL 124   8.487  -1.098  -4.907
  762   3HG1  VAL 124          3HG1      VAL 124   9.723  -1.919  -5.857
  763   1HG2  VAL 124          1HG2      VAL 124   5.673  -3.252  -5.895
  764   2HG2  VAL 124          2HG2      VAL 124   6.255  -2.385  -4.487
  765   3HG2  VAL 124          3HG2      VAL 124   6.193  -1.566  -6.091
  766    H    HIS 125           H        HIS 125   9.844  -5.121  -6.449
  767    HA   HIS 125           HA       HIS 125  11.884  -3.570  -7.693
  768   1HB   HIS 125          1HB       HIS 125  12.341  -4.939  -5.774
  769   2HB   HIS 125          2HB       HIS 125  11.830  -6.410  -6.599
  770    HD1  HIS 125           HD1      HIS 125  14.725  -3.864  -6.725
  771    HD2  HIS 125           HD2      HIS 125  13.533  -7.674  -8.077
  772    HE1  HIS 125           HE1      HIS 125  16.800  -4.942  -7.724
  773    H    GLN 126           H        GLN 126  10.305  -6.675  -8.666
  774    HA   GLN 126           HA       GLN 126  11.964  -7.114 -10.952
  775   1HB   GLN 126          1HB       GLN 126   9.173  -8.135 -10.246
  776   2HB   GLN 126          2HB       GLN 126  10.092  -8.629 -11.701
  777   1HG   GLN 126          1HG       GLN 126  12.063  -9.111 -10.147
  778   2HG   GLN 126          2HG       GLN 126  10.993  -8.913  -8.771
  779   1HE2  GLN 126          1HE2      GLN 126  12.571 -11.157  -9.402
  780   2HE2  GLN 126          2HE2      GLN 126  11.457 -12.521  -9.703
  781    H    PHE 127           H        PHE 127   8.988  -5.219 -10.526
  782    HA   PHE 127           HA       PHE 127   8.308  -4.780 -13.233
  783   1HB   PHE 127          1HB       PHE 127   6.790  -3.568 -12.326
  784   2HB   PHE 127          2HB       PHE 127   7.468  -3.857 -10.777
  785    HD1  PHE 127           HD1      PHE 127   7.288  -2.099  -9.461
  786    HD2  PHE 127           HD2      PHE 127   8.177  -1.275 -13.574
  787    HE1  PHE 127           HE1      PHE 127   7.689   0.173  -8.827
  788    HE2  PHE 127           HE2      PHE 127   8.459   1.092 -13.049
  789    HZ   PHE 127           HZ       PHE 127   8.353   1.873 -10.648
  790    H    SER 128           H        SER 128  11.016  -3.519 -11.335
  791    HA   SER 128           HA       SER 128  11.743  -1.365 -13.143
  792   1HB   SER 128          1HB       SER 128  12.482  -1.643 -10.737
  793   2HB   SER 128          2HB       SER 128  13.585  -2.929 -11.285
  794    HG   SER 128           HG       SER 128  14.586  -0.840 -11.205
  795    H    HIS 129           H        HIS 129  12.845  -4.810 -12.785
  796    HA   HIS 129           HA       HIS 129  14.768  -4.723 -14.933
  797   1HB   HIS 129          1HB       HIS 129  13.172  -7.059 -13.800
  798   2HB   HIS 129          2HB       HIS 129  14.487  -7.172 -14.944
  799    HD1  HIS 129           HD1      HIS 129  17.015  -6.528 -13.958
  800    HD2  HIS 129           HD2      HIS 129  13.864  -7.682 -11.466
  801    HE1  HIS 129           HE1      HIS 129  18.063  -7.510 -11.829
  802    H    THR 130           H        THR 130  11.277  -5.475 -14.804
  803    HA   THR 130           HA       THR 130  11.145  -6.257 -17.631
  804    HB   THR 130           HB       THR 130   8.696  -6.309 -17.237
  805    HG1  THR 130           HG1      THR 130   9.413  -5.150 -14.802
  806   1HG2  THR 130          1HG2      THR 130   9.969  -7.550 -14.732
  807   2HG2  THR 130          2HG2      THR 130   8.557  -8.081 -15.643
  808   3HG2  THR 130          3HG2      THR 130  10.183  -8.255 -16.348
  809    H    GLN 131           H        GLN 131  11.013  -3.294 -15.846
  810    HA   GLN 131           HA       GLN 131  10.556  -1.122 -16.367
  811   1HB   GLN 131          1HB       GLN 131  12.122  -1.939 -18.405
  812   2HB   GLN 131          2HB       GLN 131  10.660  -1.614 -19.339
  813   1HG   GLN 131          1HG       GLN 131  11.457   0.535 -19.333
  814   2HG   GLN 131          2HG       GLN 131  10.718   0.638 -17.733
  815   1HE2  GLN 131          1HE2      GLN 131  12.603  -0.660 -16.005
  816   2HE2  GLN 131          2HE2      GLN 131  14.109   0.205 -16.174
  817    H    GLN 132           H        GLN 132   8.298  -3.080 -16.186
  818    HA   GLN 132           HA       GLN 132   6.280  -1.221 -17.398
  819   1HB   GLN 132          1HB       GLN 132   4.728  -3.047 -17.754
  820   2HB   GLN 132          2HB       GLN 132   6.185  -3.222 -18.719
  821   1HG   GLN 132          1HG       GLN 132   5.529  -5.397 -18.042
  822   2HG   GLN 132          2HG       GLN 132   6.982  -4.972 -17.162
  823   1HE2  GLN 132          1HE2      GLN 132   6.922  -5.335 -15.000
  824   2HE2  GLN 132          2HE2      GLN 132   5.446  -5.487 -14.028
  825    H    LEU 133           H        LEU 133   4.260  -1.106 -16.153
  826    HA   LEU 133           HA       LEU 133   4.989  -1.116 -13.297
  827   1HB   LEU 133          1HB       LEU 133   2.950   0.373 -14.953
  828   2HB   LEU 133          2HB       LEU 133   2.874   0.444 -13.186
  829    HG   LEU 133           HG       LEU 133   5.491   1.039 -14.718
  830   1HD1  LEU 133          1HD1      LEU 133   3.739   2.609 -15.506
  831   2HD1  LEU 133          2HD1      LEU 133   3.364   3.028 -13.817
  832   3HD1  LEU 133          3HD1      LEU 133   4.956   3.417 -14.505
  833   1HD2  LEU 133          1HD2      LEU 133   4.592   1.936 -11.995
  834   2HD2  LEU 133          2HD2      LEU 133   5.655   0.539 -12.288
  835   3HD2  LEU 133          3HD2      LEU 133   6.171   2.164 -12.752
  836    HA   PRO 134           HA       PRO 134   2.415  -4.602 -12.620
  837   1HB   PRO 134          1HB       PRO 134   2.537  -4.511  -9.797
  838   2HB   PRO 134          2HB       PRO 134   3.730  -5.280 -10.885
  839   1HG   PRO 134          1HG       PRO 134   3.979  -2.824  -9.285
  840   2HG   PRO 134          2HG       PRO 134   5.235  -3.771 -10.096
  841   1HD   PRO 134          1HD       PRO 134   4.100  -1.283 -10.944
  842   2HD   PRO 134          2HD       PRO 134   5.251  -2.315 -11.788
  843    H    TYR 135           H        TYR 135   1.673  -1.668 -10.697
  844    HA   TYR 135           HA       TYR 135  -0.966  -2.774  -9.952
  845   1HB   TYR 135          1HB       TYR 135   0.419  -0.192  -9.081
  846   2HB   TYR 135          2HB       TYR 135  -1.029  -0.871  -8.381
  847    HD1  TYR 135           HD1      TYR 135   2.618  -1.009  -8.413
  848    HD2  TYR 135           HD2      TYR 135  -0.987  -3.033  -7.174
  849    HE1  TYR 135           HE1      TYR 135   3.972  -2.407  -6.850
  850    HE2  TYR 135           HE2      TYR 135   0.398  -4.548  -5.707
  851    HH   TYR 135           HH       TYR 135   3.942  -4.303  -5.473
  852    H    GLU 136           H        GLU 136  -2.382  -2.566 -11.649
  853    HA   GLU 136           HA       GLU 136  -2.469   0.058 -13.082
  854   1HB   GLU 136          1HB       GLU 136  -3.802  -1.173 -14.774
  855   2HB   GLU 136          2HB       GLU 136  -2.191  -1.824 -14.522
  856   1HG   GLU 136          1HG       GLU 136  -3.141  -3.694 -13.173
  857   2HG   GLU 136          2HG       GLU 136  -4.764  -3.048 -13.446
  858    H    CYS 137           H        CYS 137  -4.345   1.272 -13.190
  859    HA   CYS 137           HA       CYS 137  -6.369   0.851 -11.124
  860   1HB   CYS 137          1HB       CYS 137  -5.646   3.093 -11.646
  861   2HB   CYS 137          2HB       CYS 137  -6.037   2.900 -13.337
  862    HA   PRO 138           HA       PRO 138  -8.767  -1.613 -13.986
  863   1HB   PRO 138          1HB       PRO 138 -10.409  -2.853 -12.224
  864   2HB   PRO 138          2HB       PRO 138  -8.636  -3.086 -12.142
  865   1HG   PRO 138          1HG       PRO 138 -10.330  -1.141 -10.521
  866   2HG   PRO 138          2HG       PRO 138  -9.126  -2.317  -9.913
  867   1HD   PRO 138          1HD       PRO 138  -8.545   0.345 -10.413
  868   2HD   PRO 138          2HD       PRO 138  -7.340  -0.972 -10.562
  869    H    HIS 139           H        HIS 139  -9.756   1.291 -12.706
  870    HA   HIS 139           HA       HIS 139 -12.619   1.132 -12.718
  871   1HB   HIS 139          1HB       HIS 139 -11.228   2.948 -11.666
  872   2HB   HIS 139          2HB       HIS 139 -10.887   3.573 -13.285
  873    HD2  HIS 139           HD2      HIS 139 -12.668   5.207 -14.295
  874    HE1  HIS 139           HE1      HIS 139 -15.909   4.493 -11.615
  875    HE2  HIS 139           HE2      HIS 139 -15.108   5.899 -13.585
  876    H    GLU 140           H        GLU 140 -14.171   1.736 -14.257
  877    HA   GLU 140           HA       GLU 140 -13.596   1.036 -16.983
  878   1HB   GLU 140          1HB       GLU 140 -15.999   2.437 -15.715
  879   2HB   GLU 140          2HB       GLU 140 -15.927   1.884 -17.395
  880   1HG   GLU 140          1HG       GLU 140 -15.531  -0.446 -16.608
  881   2HG   GLU 140          2HG       GLU 140 -15.675   0.097 -14.934
  882    H    GLY 141           H        GLY 141 -12.574   2.225 -18.485
  883   1HA   GLY 141          1HA       GLY 141 -12.409   4.112 -19.924
  884   2HA   GLY 141          2HA       GLY 141 -13.193   5.122 -18.696
  885    H    CYS 142           H        CYS 142 -10.889   3.337 -17.059
  886    HA   CYS 142           HA       CYS 142  -8.839   5.502 -17.341
  887   1HB   CYS 142          1HB       CYS 142 -10.095   5.050 -15.104
  888   2HB   CYS 142          2HB       CYS 142  -9.120   3.589 -15.000
  889    H    ASP 143           H        ASP 143  -6.582   4.874 -17.216
  890    HA   ASP 143           HA       ASP 143  -5.930   2.016 -17.705
  891   1HB   ASP 143          1HB       ASP 143  -6.492   3.140 -19.924
  892   2HB   ASP 143          2HB       ASP 143  -5.122   4.213 -19.656
  893    H    LYS 144           H        LYS 144  -5.362   4.496 -15.798
  894    HA   LYS 144           HA       LYS 144  -2.533   5.051 -16.003
  895   1HB   LYS 144          1HB       LYS 144  -4.405   5.164 -13.603
  896   2HB   LYS 144          2HB       LYS 144  -2.799   5.883 -13.670
  897   1HG   LYS 144          1HG       LYS 144  -4.917   6.745 -15.666
  898   2HG   LYS 144          2HG       LYS 144  -4.937   7.351 -14.012
  899   1HD   LYS 144          1HD       LYS 144  -2.731   8.326 -14.238
  900   2HD   LYS 144          2HD       LYS 144  -2.520   7.581 -15.829
  901   1HE   LYS 144          1HE       LYS 144  -3.054   9.925 -16.095
  902   2HE   LYS 144          2HE       LYS 144  -4.348   8.935 -16.758
  903   1HZ   LYS 144          1HZ       LYS 144  -4.492  10.184 -14.049
  904   2HZ   LYS 144          2HZ       LYS 144  -5.103  10.867 -15.406
  905   3HZ   LYS 144          3HZ       LYS 144  -5.700   9.435 -14.860
  906    H    ARG 145           H        ARG 145  -0.762   4.141 -14.948
  907    HA   ARG 145           HA       ARG 145  -1.250   1.722 -13.240
  908   1HB   ARG 145          1HB       ARG 145   1.119   1.851 -15.106
  909   2HB   ARG 145          2HB       ARG 145   0.353   0.469 -14.271
  910   1HG   ARG 145          1HG       ARG 145  -1.526   0.536 -15.864
  911   2HG   ARG 145          2HG       ARG 145  -0.793   1.926 -16.683
  912   1HD   ARG 145          1HD       ARG 145  -0.233  -0.011 -17.975
  913   2HD   ARG 145          2HD       ARG 145   1.230   0.566 -17.193
  914    HE   ARG 145           HE       ARG 145   1.301  -1.378 -15.840
  915   1HH1  ARG 145          1HH1      ARG 145  -1.716  -1.478 -17.690
  916   2HH1  ARG 145          2HH1      ARG 145  -2.093  -3.051 -16.978
  917   1HH2  ARG 145          1HH2      ARG 145   0.712  -3.357 -15.154
  918   2HH2  ARG 145          2HH2      ARG 145  -0.864  -4.010 -15.655
  919    H    PHE 146           H        PHE 146   0.292   1.329 -11.656
  920    HA   PHE 146           HA       PHE 146   2.026   3.677 -11.002
  921   1HB   PHE 146          1HB       PHE 146   0.263   2.119  -9.045
  922   2HB   PHE 146          2HB       PHE 146   1.208   3.541  -8.729
  923    HD1  PHE 146           HD1      PHE 146   0.664   5.731  -9.542
  924    HD2  PHE 146           HD2      PHE 146  -1.895   2.360 -10.371
  925    HE1  PHE 146           HE1      PHE 146  -1.055   7.255 -10.520
  926    HE2  PHE 146           HE2      PHE 146  -3.635   3.860 -11.190
  927    HZ   PHE 146           HZ       PHE 146  -3.160   6.315 -11.414
  928    H    SER 147           H        SER 147   3.626   3.293  -9.355
  929    HA   SER 147           HA       SER 147   5.027   0.798  -9.929
  930   1HB   SER 147          1HB       SER 147   6.769   1.957  -8.379
  931   2HB   SER 147          2HB       SER 147   6.362   2.769  -9.910
  932    HG   SER 147           HG       SER 147   6.363   4.215  -8.135
  933    H    LEU 148           H        LEU 148   3.142   2.167  -7.265
  934    HA   LEU 148           HA       LEU 148   3.777  -0.263  -5.631
  935   1HB   LEU 148          1HB       LEU 148   3.872   2.659  -4.876
  936   2HB   LEU 148          2HB       LEU 148   3.278   1.543  -3.680
  937    HG   LEU 148           HG       LEU 148   5.601   2.070  -3.297
  938   1HD1  LEU 148          1HD1      LEU 148   6.521  -0.317  -3.236
  939   2HD1  LEU 148          2HD1      LEU 148   4.948  -0.068  -2.477
  940   3HD1  LEU 148          3HD1      LEU 148   5.033  -0.793  -4.098
  941   1HD2  LEU 148          1HD2      LEU 148   7.416   1.452  -4.675
  942   2HD2  LEU 148          2HD2      LEU 148   6.371   0.613  -5.820
  943   3HD2  LEU 148          3HD2      LEU 148   6.297   2.387  -5.689
  944    HA   PRO 149           HA       PRO 149  -0.585  -0.792  -5.259
  945   1HB   PRO 149          1HB       PRO 149  -0.806  -1.779  -2.642
  946   2HB   PRO 149          2HB       PRO 149  -0.323  -2.715  -4.067
  947   1HG   PRO 149          1HG       PRO 149   1.405  -1.589  -1.899
  948   2HG   PRO 149          2HG       PRO 149   1.599  -3.101  -2.860
  949   1HD   PRO 149          1HD       PRO 149   3.023  -0.773  -3.324
  950   2HD   PRO 149          2HD       PRO 149   2.711  -1.990  -4.527
  951    H    SER 150           H        SER 150   0.989   0.851  -2.477
  952    HA   SER 150           HA       SER 150  -1.347   2.191  -1.509
  953   1HB   SER 150          1HB       SER 150   1.564   3.033  -1.380
  954   2HB   SER 150          2HB       SER 150   0.261   3.706  -0.391
  955    HG   SER 150           HG       SER 150   1.478   2.029   0.655
  956    H    ARG 151           H        ARG 151   0.911   2.926  -4.157
  957    HA   ARG 151           HA       ARG 151   0.028   5.678  -4.531
  958   1HB   ARG 151          1HB       ARG 151   2.249   4.582  -5.314
  959   2HB   ARG 151          2HB       ARG 151   1.307   3.898  -6.630
  960   1HG   ARG 151          1HG       ARG 151   2.330   5.840  -7.471
  961   2HG   ARG 151          2HG       ARG 151   0.631   6.263  -7.286
  962   1HD   ARG 151          1HD       ARG 151   2.646   6.891  -5.107
  963   2HD   ARG 151          2HD       ARG 151   2.543   7.906  -6.542
  964    HE   ARG 151           HE       ARG 151   0.022   8.110  -5.923
  965   1HH1  ARG 151          1HH1      ARG 151   2.640   8.126  -3.555
  966   2HH1  ARG 151          2HH1      ARG 151   1.794   9.354  -2.616
  967   1HH2  ARG 151          1HH2      ARG 151  -0.856   9.758  -4.573
  968   2HH2  ARG 151          2HH2      ARG 151   0.043  10.119  -3.113
  969    H    LEU 152           H        LEU 152  -0.853   2.495  -5.935
  970    HA   LEU 152           HA       LEU 152  -2.803   3.519  -7.833
  971   1HB   LEU 152          1HB       LEU 152  -1.900   1.298  -8.093
  972   2HB   LEU 152          2HB       LEU 152  -2.356   0.855  -6.445
  973    HG   LEU 152           HG       LEU 152  -4.707   0.815  -7.008
  974   1HD1  LEU 152          1HD1      LEU 152  -5.528   1.131  -9.250
  975   2HD1  LEU 152          2HD1      LEU 152  -4.722   2.621  -8.785
  976   3HD1  LEU 152          3HD1      LEU 152  -3.897   1.486  -9.868
  977   1HD2  LEU 152          1HD2      LEU 152  -3.200  -1.190  -7.435
  978   2HD2  LEU 152          2HD2      LEU 152  -4.685  -1.142  -8.420
  979   3HD2  LEU 152          3HD2      LEU 152  -3.132  -0.681  -9.131
  980    H    LYS 153           H        LYS 153  -2.983   2.207  -4.462
  981    HA   LYS 153           HA       LYS 153  -5.758   2.486  -4.011
  982   1HB   LYS 153          1HB       LYS 153  -4.232   1.384  -2.441
  983   2HB   LYS 153          2HB       LYS 153  -3.407   2.897  -2.152
  984   1HG   LYS 153          1HG       LYS 153  -5.728   3.728  -1.194
  985   2HG   LYS 153          2HG       LYS 153  -6.131   2.009  -1.186
  986   1HD   LYS 153          1HD       LYS 153  -5.273   2.563   0.996
  987   2HD   LYS 153          2HD       LYS 153  -4.006   1.628   0.179
  988   1HE   LYS 153          1HE       LYS 153  -2.941   3.855  -0.498
  989   2HE   LYS 153          2HE       LYS 153  -4.158   4.676   0.475
  990   1HZ   LYS 153          1HZ       LYS 153  -2.198   2.710   1.540
  991   2HZ   LYS 153          2HZ       LYS 153  -2.038   4.338   1.603
  992   3HZ   LYS 153          3HZ       LYS 153  -3.254   3.598   2.432
  993    H    ARG 154           H        ARG 154  -3.147   4.939  -3.658
  994    HA   ARG 154           HA       ARG 154  -4.849   7.084  -2.762
  995   1HB   ARG 154          1HB       ARG 154  -2.103   6.925  -4.052
  996   2HB   ARG 154          2HB       ARG 154  -2.870   8.476  -3.825
  997   1HG   ARG 154          1HG       ARG 154  -3.042   6.850  -1.370
  998   2HG   ARG 154          2HG       ARG 154  -1.383   6.989  -1.922
  999   1HD   ARG 154          1HD       ARG 154  -2.163   8.709  -0.249
 1000   2HD   ARG 154          2HD       ARG 154  -1.344   9.333  -1.678
 1001    HE   ARG 154           HE       ARG 154  -3.877   9.591  -2.501
 1002   1HH1  ARG 154          1HH1      ARG 154  -2.256  10.893   0.325
 1003   2HH1  ARG 154          2HH1      ARG 154  -3.504  12.115   0.493
 1004   1HH2  ARG 154          1HH2      ARG 154  -5.091  11.239  -2.360
 1005   2HH2  ARG 154          2HH2      ARG 154  -5.082  12.311  -0.964
 1006    H    HIS 155           H        HIS 155  -3.744   6.045  -6.024
 1007    HA   HIS 155           HA       HIS 155  -4.984   8.134  -7.509
 1008   1HB   HIS 155          1HB       HIS 155  -3.388   6.669  -8.558
 1009   2HB   HIS 155          2HB       HIS 155  -4.382   5.238  -8.256
 1010    HD1  HIS 155           HD1      HIS 155  -4.502   8.450 -10.382
 1011    HD2  HIS 155           HD2      HIS 155  -6.363   4.705  -9.924
 1012    HE1  HIS 155           HE1      HIS 155  -6.384   8.407 -12.076
 1013    H    GLU 156           H        GLU 156  -6.290   4.989  -6.323
 1014    HA   GLU 156           HA       GLU 156  -8.770   5.045  -7.618
 1015   1HB   GLU 156          1HB       GLU 156  -7.664   3.280  -5.996
 1016   2HB   GLU 156          2HB       GLU 156  -8.563   4.137  -4.729
 1017   1HG   GLU 156          1HG       GLU 156 -10.664   3.776  -6.062
 1018   2HG   GLU 156          2HG       GLU 156  -9.715   2.906  -7.270
 1019    H    LYS 157           H        LYS 157  -7.671   6.950  -4.829
 1020    HA   LYS 157           HA       LYS 157 -10.223   7.845  -3.860
 1021   1HB   LYS 157          1HB       LYS 157  -7.892   8.082  -2.773
 1022   2HB   LYS 157          2HB       LYS 157  -7.670   9.498  -3.824
 1023   1HG   LYS 157          1HG       LYS 157  -9.670  10.562  -2.857
 1024   2HG   LYS 157          2HG       LYS 157 -10.003   9.107  -1.901
 1025   1HD   LYS 157          1HD       LYS 157  -7.882   9.437  -0.651
 1026   2HD   LYS 157          2HD       LYS 157  -7.509  10.832  -1.669
 1027   1HE   LYS 157          1HE       LYS 157  -8.365  11.669   0.410
 1028   2HE   LYS 157          2HE       LYS 157  -9.558  11.986  -0.852
 1029   1HZ   LYS 157          1HZ       LYS 157  -9.699   9.726   1.082
 1030   2HZ   LYS 157          2HZ       LYS 157 -10.573  11.098   1.188
 1031   3HZ   LYS 157          3HZ       LYS 157 -10.828  10.072  -0.051
 1032    H    VAL 158           H        VAL 158  -8.287   8.738  -6.692
 1033    HA   VAL 158           HA       VAL 158  -9.488  11.276  -7.283
 1034    HB   VAL 158           HB       VAL 158  -8.505   9.186  -9.299
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.606  12.206  -9.416
 1036   2HG1  VAL 158          2HG1      VAL 158  -7.987  11.137 -10.687
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.717  11.110 -10.305
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.366  10.494  -9.286
 1039   2HG2  VAL 158          2HG2      VAL 158  -7.061  11.489  -7.984
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.649   9.801  -7.666
 1041    H    HIS 159           H        HIS 159 -10.465   7.917  -8.048
 1042    HA   HIS 159           HA       HIS 159 -12.809   8.757  -9.580
 1043   1HB   HIS 159          1HB       HIS 159 -11.887   6.064  -8.469
 1044   2HB   HIS 159          2HB       HIS 159 -13.363   6.286  -9.428
 1045    HD1  HIS 159           HD1      HIS 159 -12.650   7.845 -11.880
 1046    HD2  HIS 159           HD2      HIS 159  -9.811   5.446  -9.914
 1047    HE1  HIS 159           HE1      HIS 159 -10.734   7.479 -13.526
 1048    H    ALA 160           H        ALA 160 -12.088   7.897  -6.200
 1049    HA   ALA 160           HA       ALA 160 -14.862   7.681  -5.357
 1050   1HB   ALA 160          1HB       ALA 160 -12.913   6.667  -4.126
 1051   2HB   ALA 160          2HB       ALA 160 -12.393   8.313  -3.681
 1052   3HB   ALA 160          3HB       ALA 160 -13.944   7.687  -3.103
 1053    H    GLY 161           H        GLY 161 -12.529  10.344  -5.733
 1054   1HA   GLY 161          1HA       GLY 161 -13.129  12.612  -6.019
 1055   2HA   GLY 161          2HA       GLY 161 -14.709  12.284  -5.343
 1056    H    TYR 162           H        TYR 162 -13.622  14.529  -4.521
 1057    HA   TYR 162           HA       TYR 162 -12.575  13.940  -1.772
 1058   1HB   TYR 162          1HB       TYR 162 -11.890  16.251  -3.628
 1059   2HB   TYR 162          2HB       TYR 162 -11.380  16.132  -1.932
 1060    HD1  TYR 162           HD1      TYR 162  -9.511  14.737  -1.311
 1061    HD2  TYR 162           HD2      TYR 162 -11.155  14.551  -5.302
 1062    HE1  TYR 162           HE1      TYR 162  -7.618  13.282  -2.045
 1063    HE2  TYR 162           HE2      TYR 162  -9.510  12.868  -5.920
 1064    HH   TYR 162           HH       TYR 162  -7.230  12.166  -5.362
 1065    HA   PRO 163           HA       PRO 163 -16.515  16.114  -1.352
 1066   1HB   PRO 163          1HB       PRO 163 -17.412  14.890   0.930
 1067   2HB   PRO 163          2HB       PRO 163 -17.412  14.064  -0.655
 1068   1HG   PRO 163          1HG       PRO 163 -15.355  13.819   1.553
 1069   2HG   PRO 163          2HG       PRO 163 -16.150  12.511   0.621
 1070   1HD   PRO 163          1HD       PRO 163 -13.673  13.511  -0.005
 1071   2HD   PRO 163          2HD       PRO 163 -14.804  12.901  -1.256
 1072    H    CYS 164           H        CYS 164 -17.026  17.962  -0.263
 1073    HA   CYS 164           HA       CYS 164 -15.013  19.186   1.403
 1074   1HB   CYS 164          1HB       CYS 164 -16.738  20.292  -0.198
 1075   2HB   CYS 164          2HB       CYS 164 -17.881  20.149   1.156
 1076    H    LYS 165           H        LYS 165 -14.972  19.634   3.549
 1077    HA   LYS 165           HA       LYS 165 -17.225  18.798   5.272
 1078   1HB   LYS 165          1HB       LYS 165 -15.751  17.592   6.839
 1079   2HB   LYS 165          2HB       LYS 165 -15.763  16.822   5.258
 1080   1HG   LYS 165          1HG       LYS 165 -13.565  17.848   4.713
 1081   2HG   LYS 165          2HG       LYS 165 -13.544  18.653   6.294
 1082   1HD   LYS 165          1HD       LYS 165 -13.589  16.444   7.421
 1083   2HD   LYS 165          2HD       LYS 165 -13.612  15.639   5.835
 1084   1HE   LYS 165          1HE       LYS 165 -11.436  16.694   5.268
 1085   2HE   LYS 165          2HE       LYS 165 -11.415  17.510   6.836
 1086   1HZ   LYS 165          1HZ       LYS 165 -11.362  15.320   7.904
 1087   2HZ   LYS 165          2HZ       LYS 165 -11.377  14.562   6.457
 1088   3HZ   LYS 165          3HZ       LYS 165 -10.096  15.474   6.888
 1089    H    LYS 166           H        LYS 166 -15.454  21.225   4.219
 1090    HA   LYS 166           HA       LYS 166 -14.325  22.429   6.618
 1091   1HB   LYS 166          1HB       LYS 166 -15.287  23.597   3.997
 1092   2HB   LYS 166          2HB       LYS 166 -14.478  24.550   5.228
 1093   1HG   LYS 166          1HG       LYS 166 -13.278  22.212   3.687
 1094   2HG   LYS 166          2HG       LYS 166 -12.970  23.924   3.417
 1095   1HD   LYS 166          1HD       LYS 166 -12.172  22.346   5.894
 1096   2HD   LYS 166          2HD       LYS 166 -11.115  22.872   4.580
 1097   1HE   LYS 166          1HE       LYS 166 -11.645  25.251   5.097
 1098   2HE   LYS 166          2HE       LYS 166 -12.666  24.723   6.443
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.686  23.731   7.465
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.744  24.223   6.223
 1101   3HZ   LYS 166          3HZ       LYS 166 -10.441  25.323   7.205
 1102    H    ASP 167           H        ASP 167 -17.577  22.140   5.336
 1103    HA   ASP 167           HA       ASP 167 -18.609  23.510   7.747
 1104   1HB   ASP 167          1HB       ASP 167 -18.416  25.255   5.889
 1105   2HB   ASP 167          2HB       ASP 167 -19.595  24.319   4.975
 1106    H    ASP 168           H        ASP 168 -20.601  22.719   8.418
 1107    HA   ASP 168           HA       ASP 168 -21.271  20.087   7.608
 1108   1HB   ASP 168          1HB       ASP 168 -21.700  21.097   9.858
 1109   2HB   ASP 168          2HB       ASP 168 -22.978  22.087   9.150
 1110    H    SER 169           H        SER 169 -22.496  23.231   6.496
 1111    HA   SER 169           HA       SER 169 -24.772  21.947   5.071
 1112   1HB   SER 169          1HB       SER 169 -23.967  24.879   5.355
 1113   2HB   SER 169          2HB       SER 169 -25.446  24.285   4.582
 1114    HG   SER 169           HG       SER 169 -25.781  24.912   6.775
 1115    H    CYS 170           H        CYS 170 -21.755  21.756   4.308
 1116    HA   CYS 170           HA       CYS 170 -21.933  22.812   1.514
 1117   1HB   CYS 170          1HB       CYS 170 -19.802  22.981   3.141
 1118   2HB   CYS 170          2HB       CYS 170 -19.517  21.340   2.591
 1119    H    SER 171           H        SER 171 -21.403  21.269  -0.252
 1120    HA   SER 171           HA       SER 171 -21.867  18.393   0.339
 1121   1HB   SER 171          1HB       SER 171 -23.783  18.273  -1.224
 1122   2HB   SER 171          2HB       SER 171 -24.132  19.314   0.162
 1123    HG   SER 171           HG       SER 171 -24.787  20.267  -1.824
 1124    H    PHE 172           H        PHE 172 -20.092  20.660  -1.264
 1125    HA   PHE 172           HA       PHE 172 -19.952  19.691  -3.953
 1126   1HB   PHE 172          1HB       PHE 172 -19.061  21.849  -3.494
 1127   2HB   PHE 172          2HB       PHE 172 -18.097  21.261  -2.148
 1128    HD1  PHE 172           HD1      PHE 172 -15.996  20.053  -2.456
 1129    HD2  PHE 172           HD2      PHE 172 -18.232  21.478  -5.843
 1130    HE1  PHE 172           HE1      PHE 172 -14.046  19.625  -3.919
 1131    HE2  PHE 172           HE2      PHE 172 -16.206  21.238  -7.276
 1132    HZ   PHE 172           HZ       PHE 172 -14.093  20.357  -6.295
 1133    H    VAL 173           H        VAL 173 -18.758  18.099  -4.925
 1134    HA   VAL 173           HA       VAL 173 -16.660  16.728  -3.303
 1135    HB   VAL 173           HB       VAL 173 -18.565  15.364  -5.243
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.459  13.268  -4.450
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.251  14.309  -5.195
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.365  14.213  -3.428
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.438  15.425  -2.201
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.814  15.767  -3.255
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.243  14.103  -3.093
 1142    H    GLY 174           H        GLY 174 -14.736  17.035  -4.188
 1143   1HA   GLY 174          1HA       GLY 174 -14.563  18.027  -6.958
 1144   2HA   GLY 174          2HA       GLY 174 -13.229  17.850  -5.803
 1145    H    LYS 175           H        LYS 175 -14.004  16.927  -8.762
 1146    HA   LYS 175           HA       LYS 175 -13.738  14.083  -8.773
 1147   1HB   LYS 175          1HB       LYS 175 -12.930  16.126 -10.902
 1148   2HB   LYS 175          2HB       LYS 175 -13.057  14.387 -11.149
 1149   1HG   LYS 175          1HG       LYS 175 -15.468  14.447 -10.592
 1150   2HG   LYS 175          2HG       LYS 175 -15.372  16.186 -10.302
 1151   1HD   LYS 175          1HD       LYS 175 -16.313  15.837 -12.476
 1152   2HD   LYS 175          2HD       LYS 175 -14.705  16.550 -12.671
 1153   1HE   LYS 175          1HE       LYS 175 -13.772  14.304 -13.189
 1154   2HE   LYS 175          2HE       LYS 175 -15.363  13.577 -12.937
 1155   1HZ   LYS 175          1HZ       LYS 175 -16.187  14.899 -14.814
 1156   2HZ   LYS 175          2HZ       LYS 175 -14.715  15.570 -15.046
 1157   3HZ   LYS 175          3HZ       LYS 175 -14.932  13.974 -15.293
 1158    H    THR 176           H        THR 176 -11.402  16.512  -8.018
 1159    HA   THR 176           HA       THR 176  -9.310  14.445  -7.771
 1160    HB   THR 176           HB       THR 176  -7.742  16.432  -8.800
 1161    HG1  THR 176           HG1      THR 176  -8.929  17.702  -9.901
 1162   1HG2  THR 176          1HG2      THR 176  -7.538  14.089  -9.398
 1163   2HG2  THR 176          2HG2      THR 176  -9.024  14.192 -10.391
 1164   3HG2  THR 176          3HG2      THR 176  -7.597  15.093 -10.865
 1165    H    TRP 177           H        TRP 177  -7.457  15.203  -6.504
 1166    HA   TRP 177           HA       TRP 177  -8.282  16.480  -4.146
 1167   1HB   TRP 177          1HB       TRP 177  -6.396  15.017  -4.154
 1168   2HB   TRP 177          2HB       TRP 177  -5.558  15.963  -5.354
 1169    HD1  TRP 177           HD1      TRP 177  -3.553  16.878  -4.399
 1170    HE1  TRP 177           HE1      TRP 177  -2.801  18.109  -2.256
 1171    HE3  TRP 177           HE3      TRP 177  -7.850  16.420  -1.710
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.665  17.949   0.496
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.800  16.791   0.747
 1174    HH2  TRP 177           HH2      TRP 177  -5.698  17.486   1.862
 1175    H    THR 178           H        THR 178  -6.532  17.884  -6.970
 1176    HA   THR 178           HA       THR 178  -6.025  20.465  -5.919
 1177    HB   THR 178           HB       THR 178  -6.337  21.220  -8.347
 1178    HG1  THR 178           HG1      THR 178  -6.179  18.640  -9.236
 1179   1HG2  THR 178          1HG2      THR 178  -4.120  20.706  -7.501
 1180   2HG2  THR 178          2HG2      THR 178  -4.336  18.999  -7.918
 1181   3HG2  THR 178          3HG2      THR 178  -4.312  20.225  -9.195
 1182    H    LEU 179           H        LEU 179  -8.936  19.269  -7.682
 1183    HA   LEU 179           HA       LEU 179 -10.286  21.739  -7.769
 1184   1HB   LEU 179          1HB       LEU 179 -11.453  18.923  -7.635
 1185   2HB   LEU 179          2HB       LEU 179 -12.352  20.372  -8.074
 1186    HG   LEU 179           HG       LEU 179 -10.041  19.158  -9.601
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.165  17.959  -9.790
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.995  19.456 -10.281
 1189   3HD1  LEU 179          3HD1      LEU 179 -11.745  18.731 -11.321
 1190   1HD2  LEU 179          1HD2      LEU 179  -9.910  21.574  -9.933
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.588  20.836 -11.381
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.665  21.661 -10.231
 1193    H    TYR 180           H        TYR 180 -10.114  19.347  -5.141
 1194    HA   TYR 180           HA       TYR 180 -12.232  20.580  -3.551
 1195   1HB   TYR 180          1HB       TYR 180 -11.826  18.364  -3.000
 1196   2HB   TYR 180          2HB       TYR 180 -10.071  18.525  -3.049
 1197    HD1  TYR 180           HD1      TYR 180 -13.037  19.899  -1.141
 1198    HD2  TYR 180           HD2      TYR 180  -8.899  18.687  -1.032
 1199    HE1  TYR 180           HE1      TYR 180 -12.930  20.461   1.277
 1200    HE2  TYR 180           HE2      TYR 180  -8.831  19.144   1.417
 1201    HH   TYR 180           HH       TYR 180 -11.678  20.383   3.198
 1202    H    LEU 181           H        LEU 181  -8.625  20.611  -3.463
 1203    HA   LEU 181           HA       LEU 181  -8.358  22.471  -1.354
 1204   1HB   LEU 181          1HB       LEU 181  -6.639  21.903  -3.805
 1205   2HB   LEU 181          2HB       LEU 181  -6.160  23.037  -2.579
 1206    HG   LEU 181           HG       LEU 181  -6.692  20.042  -2.146
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.161  21.660  -2.562
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.140  20.123  -1.702
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.685  20.157  -3.379
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.550  20.398   0.086
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.724  22.156  -0.202
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.153  21.116  -0.059
 1213    H    LYS 182           H        LYS 182  -8.702  23.081  -4.887
 1214    HA   LYS 182           HA       LYS 182  -8.501  25.964  -4.739
 1215   1HB   LYS 182          1HB       LYS 182  -9.742  24.072  -6.793
 1216   2HB   LYS 182          2HB       LYS 182  -9.736  25.831  -6.976
 1217   1HG   LYS 182          1HG       LYS 182  -7.231  25.820  -6.722
 1218   2HG   LYS 182          2HG       LYS 182  -7.267  24.057  -6.755
 1219   1HD   LYS 182          1HD       LYS 182  -8.388  24.196  -9.038
 1220   2HD   LYS 182          2HD       LYS 182  -8.175  25.958  -8.953
 1221   1HE   LYS 182          1HE       LYS 182  -5.657  25.352  -8.454
 1222   2HE   LYS 182          2HE       LYS 182  -6.066  23.781  -9.152
 1223   1HZ   LYS 182          1HZ       LYS 182  -5.215  25.302 -10.836
 1224   2HZ   LYS 182          2HZ       LYS 182  -6.784  25.023 -11.197
 1225   3HZ   LYS 182          3HZ       LYS 182  -6.339  26.430 -10.466
 1226    H    HIS 183           H        HIS 183 -11.276  23.685  -4.570
 1227    HA   HIS 183           HA       HIS 183 -13.359  25.637  -4.518
 1228   1HB   HIS 183          1HB       HIS 183 -13.967  23.359  -4.860
 1229   2HB   HIS 183          2HB       HIS 183 -13.105  22.807  -3.437
 1230    HD1  HIS 183           HD1      HIS 183 -16.449  24.482  -4.312
 1231    HD2  HIS 183           HD2      HIS 183 -14.270  22.968  -1.047
 1232    HE1  HIS 183           HE1      HIS 183 -18.060  24.418  -2.332
 1233    H    VAL 184           H        VAL 184 -11.350  24.213  -1.900
 1234    HA   VAL 184           HA       VAL 184 -12.752  25.379   0.296
 1235    HB   VAL 184           HB       VAL 184  -9.905  24.393  -0.069
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.583  24.577   2.362
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.715  26.174   1.612
 1238   3HG1  VAL 184          3HG1      VAL 184 -11.107  25.491   2.498
 1239   1HG2  VAL 184          1HG2      VAL 184 -11.427  22.617   0.043
 1240   2HG2  VAL 184          2HG2      VAL 184 -10.874  22.746   1.688
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.477  23.432   1.242
 1242    H    ALA 185           H        ALA 185  -9.957  26.562  -1.600
 1243    HA   ALA 185           HA       ALA 185  -9.458  28.831   0.012
 1244   1HB   ALA 185          1HB       ALA 185  -7.871  27.929  -1.669
 1245   2HB   ALA 185          2HB       ALA 185  -8.955  28.441  -2.981
 1246   3HB   ALA 185          3HB       ALA 185  -8.178  29.654  -1.940
 1247    H    GLU 186           H        GLU 186 -11.812  28.303  -2.607
 1248    HA   GLU 186           HA       GLU 186 -12.450  31.183  -2.832
 1249   1HB   GLU 186          1HB       GLU 186 -13.527  28.686  -4.201
 1250   2HB   GLU 186          2HB       GLU 186 -14.149  30.303  -4.517
 1251   1HG   GLU 186          1HG       GLU 186 -11.242  29.479  -4.945
 1252   2HG   GLU 186          2HG       GLU 186 -12.479  29.491  -6.194
 1253    H    CYS 187           H        CYS 187 -13.959  28.182  -1.567
 1254    HA   CYS 187           HA       CYS 187 -16.467  29.659  -0.978
 1255   1HB   CYS 187          1HB       CYS 187 -15.776  26.683  -0.854
 1256   2HB   CYS 187          2HB       CYS 187 -17.374  27.372  -0.538
 1257    HG   CYS 187           HG       CYS 187 -15.518  27.565  -3.270
 1258    H    HIS 188           H        HIS 188 -13.655  28.505   0.743
 1259    HA   HIS 188           HA       HIS 188 -15.015  29.139   3.336
 1260   1HB   HIS 188          1HB       HIS 188 -13.097  26.808   2.891
 1261   2HB   HIS 188          2HB       HIS 188 -13.884  27.247   4.416
 1262    HD1  HIS 188           HD1      HIS 188 -16.734  27.013   4.301
 1263    HD2  HIS 188           HD2      HIS 188 -14.364  25.187   1.348
 1264    HE1  HIS 188           HE1      HIS 188 -18.228  25.281   3.153
 1265    H    GLN 189           H        GLN 189 -13.404  30.875   1.714
 1266    HA   GLN 189           HA       GLN 189 -10.664  31.018   2.452
 1267   1HB   GLN 189          1HB       GLN 189 -11.617  33.696   2.239
 1268   2HB   GLN 189          2HB       GLN 189 -10.766  32.743   1.063
 1269   1HG   GLN 189          1HG       GLN 189 -12.668  33.731   0.020
 1270   2HG   GLN 189          2HG       GLN 189 -12.900  31.996   0.072
 1271   1HE2  GLN 189          1HE2      GLN 189 -15.196  32.245  -0.211
 1272   2HE2  GLN 189          2HE2      GLN 189 -16.197  32.836   1.121
 1273    H    ASP 190           H        ASP 190 -13.593  32.047   4.196
 1274    HA   ASP 190           HA       ASP 190 -11.986  32.415   6.659
 1275   1HB   ASP 190          1HB       ASP 190 -12.089  34.670   5.575
 1276   2HB   ASP 190          2HB       ASP 190 -13.850  34.582   5.582
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  -6.352  31.059 -13.365
    2   2H5*    G   1          2H5*        G   1  -7.314  29.577 -13.238
    3    H4*    G   1           H4*        G   1  -6.480  29.815 -15.494
    4    H3*    G   1           H3*        G   1  -5.089  27.609 -13.961
    5    H2*    G   1           H2*        G   1  -4.101  26.984 -16.091
    6   2HO*    G   1          2HO*        G   1  -6.129  27.710 -17.313
    7    H1*    G   1           H1*        G   1  -3.323  29.507 -16.666
    8    H8     G   1           H8         G   1  -3.064  29.601 -12.929
    9    H1     G   1           H1         G   1   1.786  26.491 -15.780
   10   1H2     G   1          1H2         G   1   1.186  25.810 -17.752
   11   2H2     G   1          2H2         G   1  -0.306  26.358 -18.495
   12   1H5*    G   2          1H5*        G   2  -6.383  25.665 -17.435
   13   2H5*    G   2          2H5*        G   2  -7.161  24.131 -17.038
   14    H4*    G   2           H4*        G   2  -5.382  23.805 -18.667
   15    H3*    G   2           H3*        G   2  -4.746  22.670 -15.932
   16    H2*    G   2           H2*        G   2  -2.869  21.587 -17.020
   17   2HO*    G   2          2HO*        G   2  -4.149  21.314 -19.118
   18    H1*    G   2           H1*        G   2  -2.082  23.858 -18.288
   19    H8     G   2           H8         G   2  -3.506  25.155 -15.035
   20    H1     G   2           H1         G   2   2.334  22.526 -14.432
   21   1H2     G   2          1H2         G   2   2.721  21.200 -16.094
   22   2H2     G   2          2H2         G   2   1.663  21.129 -17.489
   23   1H5*    G   3          1H5*        G   3  -4.207  19.361 -18.398
   24   2H5*    G   3          2H5*        G   3  -5.021  17.941 -17.730
   25    H4*    G   3           H4*        G   3  -2.660  17.465 -18.151
   26    H3*    G   3           H3*        G   3  -3.386  17.642 -15.209
   27    H2*    G   3           H2*        G   3  -1.205  16.685 -14.816
   28   2HO*    G   3          2HO*        G   3  -1.376  15.293 -16.839
   29    H1*    G   3           H1*        G   3   0.037  18.325 -16.627
   30    H8     G   3           H8         G   3  -2.636  20.439 -14.929
   31    H1     G   3           H1         G   3   2.783  19.739 -11.522
   32   1H2     G   3          1H2         G   3   3.890  18.035 -12.238
   33   2H2     G   3          2H2         G   3   3.430  17.175 -13.695
   34   1H5*    C   4          1H5*        C   4  -1.825  13.795 -15.407
   35   2H5*    C   4          2H5*        C   4  -2.820  12.667 -14.485
   36    H4*    C   4           H4*        C   4  -0.498  12.625 -13.714
   37    H3*    C   4           H3*        C   4  -2.453  13.775 -11.712
   38    H2*    C   4           H2*        C   4  -0.623  14.010 -10.201
   39   2HO*    C   4          2HO*        C   4   0.243  11.811 -10.990
   40    H1*    C   4           H1*        C   4   1.278  14.753 -12.094
   41   1H4     C   4          1H4         C   4  -0.873  19.884  -8.975
   42   2H4     C   4          2H4         C   4  -2.316  19.924  -9.959
   43    H5     C   4           H5         C   4  -2.801  18.292 -11.650
   44    H6     C   4           H6         C   4  -1.996  16.254 -12.728
   45   1H5*    C   5          1H5*        C   5  -1.227  12.397  -8.728
   46   2H5*    C   5          2H5*        C   5  -2.286  11.246  -7.916
   47    H4*    C   5           H4*        C   5  -1.759  13.248  -6.592
   48    H3*    C   5           H3*        C   5  -4.218  12.018  -6.536
   49    H2*    C   5           H2*        C   5  -5.081  13.462  -8.280
   50   2HO*    C   5          2HO*        C   5  -6.414  13.702  -6.211
   51    H1*    C   5           H1*        C   5  -3.987  15.796  -6.773
   52   1H4     C   5          1H4         C   5  -5.775  18.918 -11.978
   53   2H4     C   5          2H4         C   5  -5.442  17.541 -13.007
   54    H5     C   5           H5         C   5  -4.652  15.464 -12.154
   55    H6     C   5           H6         C   5  -4.176  14.189 -10.125
   56   1H5*    A   6          1H5*        A   6  -2.166  15.335  -4.403
   57   2H5*    A   6          2H5*        A   6  -0.880  14.134  -4.270
   58    H4*    A   6           H4*        A   6  -0.237  16.139  -3.327
   59    H3*    A   6           H3*        A   6  -0.481  13.883  -1.434
   60    H2*    A   6           H2*        A   6  -0.196  15.296   0.494
   61   2HO*    A   6          2HO*        A   6   1.515  16.613   0.048
   62    H1*    A   6           H1*        A   6  -1.504  17.541  -0.359
   63    H8     A   6           H8         A   6  -4.017  15.422  -1.754
   64   1H6     A   6          1H6         A   6  -6.073  14.234   3.975
   65   2H6     A   6          2H6         A   6  -6.383  14.010   2.271
   66    H2     A   6           H2         A   6  -2.144  16.247   4.341
   67   1H5*    U   7          1H5*        U   7   3.338  13.280   0.695
   68   2H5*    U   7          2H5*        U   7   2.280  14.599   0.225
   69    H4*    U   7           H4*        U   7   4.024  15.414   1.617
   70    H3*    U   7           H3*        U   7   3.344  16.695  -0.747
   71    H2*    U   7           H2*        U   7   5.149  15.692  -1.957
   72   2HO*    U   7          2HO*        U   7   5.838  18.215  -0.913
   73    H1*    U   7           H1*        U   7   6.951  16.211   0.438
   74    H3     U   7           H3         U   7  10.573  14.623  -1.659
   75    H5     U   7           H5         U   7   7.820  11.484  -1.877
   76    H6     U   7           H6         U   7   6.064  13.034  -1.163
   77   1H5*    A   8          1H5*        A   8   4.102  20.347  -0.605
   78   2H5*    A   8          2H5*        A   8   3.353  21.153   0.775
   79    H4*    A   8           H4*        A   8   2.623  22.293  -1.137
   80    H3*    A   8           H3*        A   8   0.767  21.279   0.593
   81    H2*    A   8           H2*        A   8   0.400  19.321  -0.778
   82   2HO*    A   8          2HO*        A   8  -1.682  20.276  -0.288
   83    H1*    A   8           H1*        A   8   0.200  21.272  -3.069
   84    H8     A   8           H8         A   8   2.383  18.109  -2.868
   85   1H6     A   8          1H6         A   8  -1.201  16.014  -7.468
   86   2H6     A   8          2H6         A   8   0.336  15.827  -6.660
   87    H2     A   8           H2         A   8  -3.094  19.675  -5.816
   88   1H5*    C   9          1H5*        C   9  -2.481  22.696  -0.227
   89   2H5*    C   9          2H5*        C   9  -2.773  24.178   0.694
   90    H4*    C   9           H4*        C   9  -4.329  22.529   1.404
   91    H3*    C   9           H3*        C   9  -2.231  23.005   3.504
   92    H2*    C   9           H2*        C   9  -3.519  21.477   4.892
   93   2HO*    C   9          2HO*        C   9  -5.610  22.317   3.725
   94    H1*    C   9           H1*        C   9  -3.870  19.603   2.952
   95   1H4     C   9          1H4         C   9   1.712  18.278   5.858
   96   2H4     C   9          2H4         C   9   2.538  18.901   4.445
   97    H5     C   9           H5         C   9   1.423  20.159   2.747
   98    H6     C   9           H6         C   9  -0.743  20.944   1.953
   99   1H5*    C  10          1H5*        C  10  -5.736  23.103   5.521
  100   2H5*    C  10          2H5*        C  10  -5.923  24.465   6.625
  101    H4*    C  10           H4*        C  10  -6.176  22.319   7.800
  102    H3*    C  10           H3*        C  10  -3.671  23.871   8.531
  103    H2*    C  10           H2*        C  10  -3.386  22.271  10.293
  104   2HO*    C  10          2HO*        C  10  -5.765  22.083  10.717
  105    H1*    C  10           H1*        C  10  -3.919  20.100   8.673
  106   1H4     C  10          1H4         C  10   2.375  20.732   8.317
  107   2H4     C  10          2H4         C  10   2.197  21.665   6.848
  108    H5     C  10           H5         C  10   0.076  22.433   6.024
  109    H6     C  10           H6         C  10  -2.336  22.438   6.453
  110   1H5*    U  11          1H5*        U  11  -5.191  23.979  12.399
  111   2H5*    U  11          2H5*        U  11  -4.782  25.537  13.126
  112    H4*    U  11           H4*        U  11  -3.644  23.505  14.110
  113    H3*    U  11           H3*        U  11  -1.945  25.705  12.951
  114    H2*    U  11           H2*        U  11  -0.102  24.643  14.059
  115   2HO*    U  11          2HO*        U  11  -1.492  24.067  15.994
  116    H1*    U  11           H1*        U  11  -0.895  22.109  13.326
  117    H3     U  11           H3         U  11   2.866  23.051  10.881
  118    H5     U  11           H5         U  11  -0.185  25.077   8.849
  119    H6     U  11           H6         U  11  -1.713  24.503  10.684
  120   1H5*    C  12          1H5*        C  12  -0.398  26.436  17.268
  121   2H5*    C  12          2H5*        C  12   0.598  27.806  16.773
  122    H4*    C  12           H4*        C  12   1.135  24.844  16.670
  123    H3*    C  12           H3*        C  12   2.164  26.884  18.169
  124    H2*    C  12           H2*        C  12   2.884  28.158  16.273
  125   2HO*    C  12          2HO*        C  12   4.797  27.153  17.800
  126    H1*    C  12           H1*        C  12   4.107  25.610  15.163
  127   1H4     C  12          1H4         C  12   5.267  29.755  10.466
  128   2H4     C  12          2H4         C  12   3.594  30.254  10.415
  129    H5     C  12           H5         C  12   1.926  29.401  11.916
  130    H6     C  12           H6         C  12   1.523  27.877  13.794
  131   1H5*    U  13          1H5*        U  13   3.247  22.359  18.999
  132   2H5*    U  13          2H5*        U  13   3.985  22.305  20.602
  133    H4*    U  13           H4*        U  13   5.095  20.536  19.671
  134    H3*    U  13           H3*        U  13   6.847  22.715  19.733
  135    H2*    U  13           H2*        U  13   6.311  23.339  17.464
  136   2HO*    U  13          2HO*        U  13   8.635  21.689  17.521
  137    H1*    U  13           H1*        U  13   6.575  20.367  16.820
  138    H3     U  13           H3         U  13   6.445  21.388  12.399
  139    H5     U  13           H5         U  13   3.366  23.738  13.971
  140    H6     U  13           H6         U  13   3.965  22.934  16.213
  141   1H5*    U  14          1H5*        U  14   9.567  17.891  20.203
  142   2H5*    U  14          2H5*        U  14  11.042  18.713  19.703
  143    H4*    U  14           H4*        U  14   8.415  18.563  18.191
  144    H3*    U  14           H3*        U  14  10.807  16.959  18.115
  145    H2*    U  14           H2*        U  14  12.004  18.604  16.967
  146   2HO*    U  14          2HO*        U  14  10.595  17.018  15.082
  147    H1*    U  14           H1*        U  14   9.405  19.363  15.557
  148    H3     U  14           H3         U  14  11.879  22.019  12.785
  149    H5     U  14           H5         U  14  13.221  23.111  16.594
  150    H6     U  14           H6         U  14  11.808  21.339  17.546
  151   1H5*    G  15          1H5*        G  15   6.207  14.430  16.042
  152   2H5*    G  15          2H5*        G  15   6.742  15.991  15.392
  153    H4*    G  15           H4*        G  15   4.493  15.853  17.411
  154    H3*    G  15           H3*        G  15   4.310  15.403  14.425
  155    H2*    G  15           H2*        G  15   2.047  16.260  14.632
  156   2HO*    G  15          2HO*        G  15   1.745  15.341  16.880
  157    H1*    G  15           H1*        G  15   2.893  18.426  16.019
  158    H8     G  15           H8         G  15   5.892  17.926  13.857
  159    H1     G  15           H1         G  15   0.798  20.035  10.549
  160   1H2     G  15          1H2         G  15  -1.009  19.698  11.682
  161   2H2     G  15          2H2         G  15  -0.976  19.156  13.347
  162   1H5*    G  16          1H5*        G  16   0.640  13.931  15.677
  163   2H5*    G  16          2H5*        G  16   0.320  12.343  14.972
  164    H4*    G  16           H4*        G  16  -1.532  13.855  14.567
  165    H3*    G  16           H3*        G  16   0.024  13.206  12.049
  166    H2*    G  16           H2*        G  16  -1.838  14.260  10.894
  167   2HO*    G  16          2HO*        G  16  -3.462  13.433  12.528
  168    H1*    G  16           H1*        G  16  -1.859  16.426  12.528
  169    H8     G  16           H8         G  16   1.808  15.667  12.455
  170    H1     G  16           H1         G  16  -0.318  17.616   6.735
  171   1H2     G  16          1H2         G  16  -2.482  17.898   6.771
  172   2H2     G  16          2H2         G  16  -3.440  17.351   8.132
  173   1H5*    G  17          1H5*        G  17  -3.691  12.101  10.724
  174   2H5*    G  17          2H5*        G  17  -3.620  10.588   9.808
  175    H4*    G  17           H4*        G  17  -4.482  12.450   8.472
  176    H3*    G  17           H3*        G  17  -1.806  11.385   7.524
  177    H2*    G  17           H2*        G  17  -2.174  12.865   5.583
  178   2HO*    G  17          2HO*        G  17  -4.569  12.521   5.708
  179    H1*    G  17           H1*        G  17  -2.612  15.026   7.077
  180    H8     G  17           H8         G  17  -0.473  13.241   9.541
  181    H1     G  17           H1         G  17   2.830  15.752   4.636
  182   1H2     G  17          1H2         G  17   1.471  16.355   3.049
  183   2H2     G  17          2H2         G  17  -0.241  15.961   3.105
  184   1H5*    C  18          1H5*        C  18  -3.531  11.133   3.973
  185   2H5*    C  18          2H5*        C  18  -3.301   9.575   3.157
  186    H4*    C  18           H4*        C  18  -2.345  11.320   1.809
  187    H3*    C  18           H3*        C  18  -0.130   9.788   3.191
  188    H2*    C  18           H2*        C  18   1.408  11.121   1.729
  189   2HO*    C  18          2HO*        C  18   0.315  11.645  -0.155
  190    H1*    C  18           H1*        C  18   0.345  13.351   2.489
  191   1H4     C  18          1H4         C  18   4.345  11.870   7.222
  192   2H4     C  18          2H4         C  18   2.997  11.289   8.165
  193    H5     C  18           H5         C  18   0.761  11.157   7.321
  194    H6     C  18           H6         C  18  -0.630  11.510   5.355
  195   1H5*    C  19          1H5*        C  19   1.377   9.852  -0.487
  196   2H5*    C  19          2H5*        C  19   1.890   8.257  -1.056
  197    H4*    C  19           H4*        C  19   3.674   9.887  -1.341
  198    H3*    C  19           H3*        C  19   4.238   7.788   0.798
  199    H2*    C  19           H2*        C  19   6.475   8.671   0.800
  200   2HO*    C  19          2HO*        C  19   6.239   9.080  -1.649
  201    H1*    C  19           H1*        C  19   5.733  11.300   0.814
  202   1H4     C  19          1H4         C  19   6.309   9.386   6.892
  203   2H4     C  19          2H4         C  19   4.634   8.885   6.916
  204    H5     C  19           H5         C  19   3.224   8.909   4.979
  205    H6     C  19           H6         C  19   3.109   9.529   2.614
  206   1H5*    U  20          1H5*        U  20   7.637   7.473  -1.438
  207   2H5*    U  20          2H5*        U  20   7.982   5.790  -1.847
  208    H4*    U  20           H4*        U  20   9.875   6.731  -0.747
  209    H3*    U  20           H3*        U  20   8.416   4.865   1.164
  210    H2*    U  20           H2*        U  20  10.504   4.951   2.377
  211   2HO*    U  20          2HO*        U  20  11.909   5.092   0.422
  212    H1*    U  20           H1*        U  20  10.603   7.679   2.151
  213    H3     U  20           H3         U  20   9.389   6.594   6.453
  214    H5     U  20           H5         U  20   5.797   6.454   4.316
  215    H6     U  20           H6         U  20   7.079   6.761   2.237
  216   1H5*    G  21          1H5*        G  21  12.154   3.130   0.484
  217   2H5*    G  21          2H5*        G  21  12.084   1.369   0.483
  218    H4*    G  21           H4*        G  21  13.743   2.193   2.041
  219    H3*    G  21           H3*        G  21  11.388   0.986   3.544
  220    H2*    G  21           H2*        G  21  12.910   1.087   5.437
  221   2HO*    G  21          2HO*        G  21  14.898   0.754   3.978
  222    H1*    G  21           H1*        G  21  13.499   3.684   4.937
  223    H8     G  21           H8         G  21   9.919   3.311   3.716
  224    H1     G  21           H1         G  21  10.455   3.357  10.133
  225   1H2     G  21          1H2         G  21  12.521   3.095  10.704
  226   2H2     G  21          2H2         G  21  13.816   3.072   9.524
  227   1H5*    G  22          1H5*        G  22  14.680  -0.980   4.798
  228   2H5*    G  22          2H5*        G  22  14.492  -2.729   4.857
  229    H4*    G  22           H4*        G  22  15.407  -1.880   6.929
  230    H3*    G  22           H3*        G  22  12.580  -2.924   7.259
  231    H2*    G  22           H2*        G  22  12.959  -2.721   9.616
  232   2HO*    G  22          2HO*        G  22  15.232  -3.389   9.585
  233    H1*    G  22           H1*        G  22  14.021  -0.219   9.405
  234    H8     G  22           H8         G  22  11.418  -0.197   6.680
  235    H1     G  22           H1         G  22   8.903   0.098  12.607
  236   1H2     G  22          1H2         G  22  10.394  -0.426  14.073
  237   2H2     G  22          2H2         G  22  12.061  -0.746  13.636
  238   1H5*    U  23          1H5*        U  23  12.290  -7.195   9.652
  239   2H5*    U  23          2H5*        U  23  11.374  -5.710   9.309
  240    H4*    U  23           H4*        U  23  13.023  -6.118  11.808
  241    H3*    U  23           H3*        U  23  10.069  -6.299  11.106
  242    H2*    U  23           H2*        U  23   9.570  -5.763  13.351
  243   2HO*    U  23          2HO*        U  23  11.538  -6.853  14.273
  244    H1*    U  23           H1*        U  23  11.195  -3.598  13.283
  245    H3     U  23           H3         U  23   6.665  -2.647  12.529
  246    H5     U  23           H5         U  23   8.448  -2.823   8.751
  247    H6     U  23           H6         U  23  10.524  -3.595   9.823
  248   1H5*    U  24          1H5*        U  24   9.844  -8.408  14.070
  249   2H5*    U  24          2H5*        U  24   9.218 -10.058  13.969
  250    H4*    U  24           H4*        U  24   7.848  -8.764  15.492
  251    H3*    U  24           H3*        U  24   6.503  -9.249  12.828
  252    H2*    U  24           H2*        U  24   4.501  -8.437  13.749
  253   2HO*    U  24          2HO*        U  24   4.786  -9.412  15.917
  254    H1*    U  24           H1*        U  24   5.756  -6.300  14.989
  255    H3     U  24           H3         U  24   3.265  -4.832  11.368
  256    H5     U  24           H5         U  24   6.861  -6.171   9.685
  257    H6     U  24           H6         U  24   7.570  -6.932  11.910
  258   1H5*    A  25          1H5*        A  25   5.186 -13.369  11.609
  259   2H5*    A  25          2H5*        A  25   6.905 -13.636  11.394
  260    H4*    A  25           H4*        A  25   5.956 -13.295   9.234
  261    H3*    A  25           H3*        A  25   8.074 -11.590   9.965
  262    H2*    A  25           H2*        A  25   6.526  -9.790  10.536
  263   2HO*    A  25          2HO*        A  25   8.073  -8.895   9.141
  264    H1*    A  25           H1*        A  25   5.263 -10.743   7.911
  265    H8     A  25           H8         A  25   3.727  -9.485  11.302
  266   1H6     A  25          1H6         A  25   0.863  -5.308   7.670
  267   2H6     A  25          2H6         A  25   0.798  -6.107   9.229
  268    H2     A  25           H2         A  25   3.876  -7.517   5.207
  269   1H5*    G  26          1H5*        G  26   8.044 -14.730   4.894
  270   2H5*    G  26          2H5*        G  26   8.021 -13.000   4.632
  271    H4*    G  26           H4*        G  26   6.005 -13.628   6.612
  272    H3*    G  26           H3*        G  26   6.286 -15.912   4.996
  273    H2*    G  26           H2*        G  26   6.087 -14.478   3.115
  274   2HO*    G  26          2HO*        G  26   3.622 -15.874   3.539
  275    H1*    G  26           H1*        G  26   3.604 -13.469   4.562
  276    H8     G  26           H8         G  26   5.589 -13.329   1.324
  277    H1     G  26           H1         G  26   1.093  -8.793   1.855
  278   1H2     G  26          1H2         G  26   0.503  -8.600   3.919
  279   2H2     G  26          2H2         G  26   1.001  -9.747   5.152
  280   1H5*    U  27          1H5*        U  27   4.985 -16.319   8.267
  281   2H5*    U  27          2H5*        U  27   4.250 -17.896   8.619
  282    H4*    U  27           H4*        U  27   4.004 -16.836  10.651
  283    H3*    U  27           H3*        U  27   1.447 -16.096   9.165
  284    H2*    U  27           H2*        U  27   0.838 -14.746  11.056
  285   2HO*    U  27          2HO*        U  27   2.013 -16.400  12.548
  286    H1*    U  27           H1*        U  27   3.194 -13.492  11.331
  287    H3     U  27           H3         U  27   0.426 -10.648   8.997
  288    H5     U  27           H5         U  27   3.035 -12.358   6.235
  289    H6     U  27           H6         U  27   3.583 -14.080   7.888
  290   1H5*    A  28          1H5*        A  28  -0.106 -16.208  12.878
  291   2H5*    A  28          2H5*        A  28  -1.367 -17.433  12.945
  292    H4*    A  28           H4*        A  28  -2.272 -15.326  13.707
  293    H3*    A  28           H3*        A  28  -3.298 -16.110  10.951
  294    H2*    A  28           H2*        A  28  -4.744 -14.172  11.113
  295   2HO*    A  28          2HO*        A  28  -5.019 -14.510  13.537
  296    H1*    A  28           H1*        A  28  -2.785 -12.512  12.009
  297    H8     A  28           H8         A  28  -0.716 -14.478   9.657
  298   1H6     A  28          1H6         A  28  -3.154 -10.929   5.160
  299   2H6     A  28          2H6         A  28  -1.883 -12.078   5.542
  300    H2     A  28           H2         A  28  -5.964 -10.936   8.586
  301   1H5*    C  29          1H5*        C  29  -6.831 -15.348  12.257
  302   2H5*    C  29          2H5*        C  29  -8.030 -16.604  11.914
  303    H4*    C  29           H4*        C  29  -8.582 -14.579  10.701
  304    H3*    C  29           H3*        C  29  -7.554 -16.768   8.878
  305    H2*    C  29           H2*        C  29  -8.153 -15.279   7.040
  306   2HO*    C  29          2HO*        C  29 -10.116 -14.434   8.219
  307    H1*    C  29           H1*        C  29  -7.000 -13.117   8.097
  308   1H4     C  29          1H4         C  29  -2.310 -15.977   4.871
  309   2H4     C  29          2H4         C  29  -1.767 -16.735   6.350
  310    H5     C  29           H5         C  29  -3.001 -16.664   8.397
  311    H6     C  29           H6         C  29  -4.999 -15.764   9.474
  312   1H5*    C  30          1H5*        C  30 -11.216 -15.983   7.095
  313   2H5*    C  30          2H5*        C  30 -12.053 -17.468   6.614
  314    H4*    C  30           H4*        C  30 -11.606 -16.014   4.689
  315    H3*    C  30           H3*        C  30  -9.918 -18.531   4.660
  316    H2*    C  30           H2*        C  30  -9.356 -17.863   2.391
  317   2HO*    C  30          2HO*        C  30 -11.614 -16.853   2.097
  318    H1*    C  30           H1*        C  30  -8.866 -15.275   3.134
  319   1H4     C  30          1H4         C  30  -3.498 -18.733   3.479
  320   2H4     C  30          2H4         C  30  -3.826 -19.120   5.153
  321    H5     C  30           H5         C  30  -5.839 -18.457   6.287
  322    H6     C  30           H6         C  30  -7.986 -17.309   6.008
  323   1H5*    U  31          1H5*        U  31 -12.063 -18.355   0.931
  324   2H5*    U  31          2H5*        U  31 -12.963 -19.845   0.640
  325    H4*    U  31           H4*        U  31 -11.910 -19.092  -1.400
  326    H3*    U  31           H3*        U  31 -10.597 -21.588  -0.308
  327    H2*    U  31           H2*        U  31  -9.407 -21.686  -2.385
  328   2HO*    U  31          2HO*        U  31 -11.322 -20.865  -3.654
  329    H1*    U  31           H1*        U  31  -8.782 -19.021  -2.402
  330    H3     U  31           H3         U  31  -4.903 -21.277  -1.308
  331    H5     U  31           H5         U  31  -6.848 -20.570   2.339
  332    H6     U  31           H6         U  31  -8.849 -19.899   1.091
  333   1H5*    C  32          1H5*        C  32 -11.750 -23.073  -3.795
  334   2H5*    C  32          2H5*        C  32 -12.453 -24.691  -3.717
  335    H4*    C  32           H4*        C  32 -10.418 -24.729  -5.039
  336    H3*    C  32           H3*        C  32  -9.991 -26.053  -2.339
  337    H2*    C  32           H2*        C  32  -7.800 -26.637  -3.164
  338   2HO*    C  32          2HO*        C  32  -8.765 -26.936  -5.456
  339    H1*    C  32           H1*        C  32  -7.320 -24.174  -4.304
  340   1H4     C  32          1H4         C  32  -4.806 -24.362   1.559
  341   2H4     C  32          2H4         C  32  -6.355 -23.990   2.280
  342    H5     C  32           H5         C  32  -8.368 -23.716   1.003
  343    H6     C  32           H6         C  32  -9.316 -23.816  -1.253
  344   1H5*    U  33          1H5*        U  33  -8.096 -28.699  -4.347
  345   2H5*    U  33          2H5*        U  33  -8.762 -30.327  -4.204
  346    H4*    U  33           H4*        U  33  -6.425 -30.433  -3.590
  347    H3*    U  33           H3*        U  33  -8.238 -30.501  -1.158
  348    H2*    U  33           H2*        U  33  -6.413 -30.804   0.165
  349   2HO*    U  33          2HO*        U  33  -4.464 -31.351  -1.871
  350    H1*    U  33           H1*        U  33  -4.657 -29.240  -1.409
  351    H3     U  33           H3         U  33  -4.617 -27.453   2.799
  352    H5     U  33           H5         U  33  -8.567 -26.863   1.556
  353    H6     U  33           H6         U  33  -8.025 -28.001  -0.551
  354   1H5*    U  34          1H5*        U  34  -8.256 -36.098  -0.298
  355   2H5*    U  34          2H5*        U  34  -7.531 -35.091   0.960
  356    H4*    U  34           H4*        U  34  -6.344 -37.210   0.711
  357    H3*    U  34           H3*        U  34  -4.993 -34.837   0.973
  358    H2*    U  34           H2*        U  34  -4.730 -34.509  -1.390
  359   2HO*    U  34          2HO*        U  34  -2.438 -35.890  -0.382
  360    H1*    U  34           H1*        U  34  -3.962 -37.450  -1.557
  361    H3     U  34           H3         U  34  -3.033 -37.061  -5.960
  362    H5     U  34           H5         U  34  -6.437 -34.661  -5.561
  363    H6     U  34           H6         U  34  -6.445 -35.165  -3.157
  364   1H5*    C  35          1H5*        C  35  -1.519 -34.948   1.652
  365   2H5*    C  35          2H5*        C  35  -1.127 -35.784   3.154
  366    H4*    C  35           H4*        C  35  -0.153 -33.559   3.079
  367    H3*    C  35           H3*        C  35  -1.314 -34.555   5.343
  368    H2*    C  35           H2*        C  35  -3.471 -33.630   4.861
  369   2HO*    C  35          2HO*        C  35  -2.016 -31.837   6.529
  370    H1*    C  35           H1*        C  35  -2.169 -30.983   4.139
  371   1H4     C  35          1H4         C  35  -8.386 -30.238   2.881
  372   2H4     C  35          2H4         C  35  -8.355 -31.579   1.748
  373    H5     C  35           H5         C  35  -6.443 -32.971   1.455
  374    H6     C  35           H6         C  35  -4.070 -33.224   1.961
  375   1H5*    G  36          1H5*        G  36   3.116 -31.226   5.174
  376   2H5*    G  36          2H5*        G  36   1.555 -31.331   4.341
  377    H4*    G  36           H4*        G  36   4.113 -32.710   3.440
  378    H3*    G  36           H3*        G  36   2.575 -30.309   2.376
  379    H2*    G  36           H2*        G  36   3.364 -30.912   0.225
  380   2HO*    G  36          2HO*        G  36   5.612 -31.362   1.291
  381    H1*    G  36           H1*        G  36   3.446 -33.694   0.806
  382    H8     G  36           H8         G  36   2.119 -34.234  -1.399
  383    H1     G  36           H1         G  36  -2.552 -30.038   0.039
  384   1H2     G  36          1H2         G  36  -2.107 -28.998   1.850
  385   2H2     G  36          2H2         G  36  -0.623 -29.255   2.741
  386   1H5*    G  37          1H5*        G  37   5.094 -29.314   0.314
  387   2H5*    G  37          2H5*        G  37   5.533 -27.609   0.211
  388    H4*    G  37           H4*        G  37   4.211 -28.616  -1.739
  389    H3*    G  37           H3*        G  37   3.081 -26.164  -0.340
  390    H2*    G  37           H2*        G  37   1.524 -26.161  -2.253
  391   2HO*    G  37          2HO*        G  37   3.287 -27.158  -3.735
  392    H1*    G  37           H1*        G  37   0.920 -28.765  -1.966
  393    H8     G  37           H8         G  37   1.704 -27.371   1.524
  394    H1     G  37           H1         G  37  -3.924 -25.399  -0.866
  395   1H2     G  37          1H2         G  37  -4.101 -26.009  -2.927
  396   2H2     G  37          2H2         G  37  -2.939 -27.077  -3.687
  397   1H5*    U  38          1H5*        U  38   2.527 -25.301  -4.204
  398   2H5*    U  38          2H5*        U  38   3.190 -23.773  -4.762
  399    H4*    U  38           H4*        U  38   0.867 -24.015  -5.413
  400    H3*    U  38           H3*        U  38   1.245 -21.890  -3.325
  401    H2*    U  38           H2*        U  38  -0.987 -21.173  -3.865
  402   2HO*    U  38          2HO*        U  38  -0.960 -21.614  -6.165
  403    H1*    U  38           H1*        U  38  -1.977 -23.703  -3.666
  404    H3     U  38           H3         U  38  -3.085 -21.789   0.360
  405    H5     U  38           H5         U  38   0.829 -23.152   0.895
  406    H6     U  38           H6         U  38   0.929 -23.649  -1.500
  407   1H5*    G  39          1H5*        G  39   0.185 -19.708  -6.666
  408   2H5*    G  39          2H5*        G  39   1.019 -18.159  -6.711
  409    H4*    G  39           H4*        G  39  -1.349 -17.851  -6.816
  410    H3*    G  39           H3*        G  39  -0.380 -16.977  -4.091
  411    H2*    G  39           H2*        G  39  -2.656 -16.097  -3.857
  412   2HO*    G  39          2HO*        G  39  -2.837 -15.632  -6.279
  413    H1*    G  39           H1*        G  39  -3.747 -18.446  -4.593
  414    H8     G  39           H8         G  39  -0.382 -19.262  -2.947
  415    H1     G  39           H1         G  39  -5.023 -17.716   1.218
  416   1H2     G  39          1H2         G  39  -6.679 -16.815   0.165
  417   2H2     G  39          2H2         G  39  -6.763 -16.781  -1.583
  418   1H5*    G  40          1H5*        G  40  -2.515 -13.821  -5.610
  419   2H5*    G  40          2H5*        G  40  -1.797 -12.246  -5.240
  420    H4*    G  40           H4*        G  40  -4.164 -12.317  -4.639
  421    H3*    G  40           H3*        G  40  -2.186 -12.003  -2.358
  422    H2*    G  40           H2*        G  40  -4.129 -11.706  -0.925
  423   2HO*    G  40          2HO*        G  40  -5.337 -10.548  -2.774
  424    H1*    G  40           H1*        G  40  -5.500 -13.797  -1.921
  425    H8     G  40           H8         G  40  -1.959 -15.047  -2.128
  426    H1     G  40           H1         G  40  -4.132 -14.695   3.909
  427   1H2     G  40          1H2         G  40  -5.950 -13.537   3.983
  428   2H2     G  40          2H2         G  40  -6.684 -12.865   2.541
  429   1H5*    G  41          1H5*        G  41  -4.532  -9.499  -0.838
  430   2H5*    G  41          2H5*        G  41  -3.780  -7.941  -0.490
  431    H4*    G  41           H4*        G  41  -4.463  -8.886   1.603
  432    H3*    G  41           H3*        G  41  -1.473  -9.191   1.207
  433    H2*    G  41           H2*        G  41  -1.427  -9.852   3.556
  434   2HO*    G  41          2HO*        G  41  -3.204  -8.553   4.347
  435    H1*    G  41           H1*        G  41  -3.341 -11.703   3.177
  436    H8     G  41           H8         G  41  -1.703 -11.466  -0.232
  437    H1     G  41           H1         G  41   1.606 -15.020   3.969
  438   1H2     G  41          1H2         G  41   0.848 -14.756   5.953
  439   2H2     G  41          2H2         G  41  -0.497 -13.696   6.329
  440   1H5*    A  42          1H5*        A  42  -0.335  -5.087   4.540
  441   2H5*    A  42          2H5*        A  42  -0.086  -6.390   5.713
  442    H4*    A  42           H4*        A  42  -2.746  -5.554   4.486
  443    H3*    A  42           H3*        A  42  -1.612  -5.556   7.293
  444    H2*    A  42           H2*        A  42  -3.850  -5.938   8.115
  445   2HO*    A  42          2HO*        A  42  -4.838  -4.619   6.263
  446    H1*    A  42           H1*        A  42  -4.328  -8.000   6.482
  447    H8     A  42           H8         A  42  -0.785  -8.738   6.597
  448   1H6     A  42          1H6         A  42  -1.417 -10.516  12.527
  449   2H6     A  42          2H6         A  42  -0.435 -10.677  11.089
  450    H2     A  42           H2         A  42  -5.037  -8.217  11.404
  451   1H5*    A  43          1H5*        A  43  -4.425  -3.083   7.608
  452   2H5*    A  43          2H5*        A  43  -4.464  -1.477   8.290
  453    H4*    A  43           H4*        A  43  -5.804  -2.930   9.662
  454    H3*    A  43           H3*        A  43  -3.162  -2.314  11.037
  455    H2*    A  43           H2*        A  43  -3.872  -3.719  12.862
  456   2HO*    A  43          2HO*        A  43  -6.221  -2.915  12.501
  457    H1*    A  43           H1*        A  43  -4.879  -5.731  11.283
  458    H8     A  43           H8         A  43  -1.897  -4.877   9.290
  459   1H6     A  43          1H6         A  43   1.421  -8.254  13.296
  460   2H6     A  43          2H6         A  43   1.367  -7.621  11.663
  461    H2     A  43           H2         A  43  -2.435  -7.236  15.240
  462   1H5*    U  44          1H5*        U  44  -5.291  -1.747  14.167
  463   2H5*    U  44          2H5*        U  44  -4.965  -0.212  14.987
  464    H4*    U  44           H4*        U  44  -4.272  -2.036  16.416
  465    H3*    U  44           H3*        U  44  -1.924  -0.579  15.169
  466    H2*    U  44           H2*        U  44  -0.529  -1.896  16.615
  467   2HO*    U  44          2HO*        U  44  -2.231  -1.810  18.408
  468    H1*    U  44           H1*        U  44  -1.839  -4.243  16.131
  469    H3     U  44           H3         U  44   2.030  -4.711  13.718
  470    H5     U  44           H5         U  44  -0.433  -2.378  11.266
  471    H6     U  44           H6         U  44  -1.982  -2.133  13.147
  472   1H5*    A  45          1H5*        A  45  -1.106  -0.334  19.234
  473   2H5*    A  45          2H5*        A  45  -0.383   1.223  19.659
  474    H4*    A  45           H4*        A  45   1.118  -0.633  20.185
  475    H3*    A  45           H3*        A  45   2.122   1.057  17.866
  476    H2*    A  45           H2*        A  45   4.170  -0.205  18.105
  477   2HO*    A  45          2HO*        A  45   3.843  -0.402  20.559
  478    H1*    A  45           H1*        A  45   2.885  -2.599  18.168
  479    H8     A  45           H8         A  45   0.822  -0.244  15.963
  480   1H6     A  45          1H6         A  45   4.654  -1.864  11.335
  481   2H6     A  45          2H6         A  45   3.136  -1.086  11.734
  482    H2     A  45           H2         A  45   6.332  -3.437  15.120
  483   1H5*    C  46          1H5*        C  46   5.140   1.040  20.644
  484   2H5*    C  46          2H5*        C  46   5.863   2.633  20.867
  485    H4*    C  46           H4*        C  46   7.554   0.982  20.318
  486    H3*    C  46           H3*        C  46   7.081   2.952  18.047
  487    H2*    C  46           H2*        C  46   9.135   2.054  17.159
  488   2HO*    C  46          2HO*        C  46  10.083   1.732  19.411
  489    H1*    C  46           H1*        C  46   8.371  -0.541  17.631
  490   1H4     C  46          1H4         C  46   6.475   0.916  11.717
  491   2H4     C  46          2H4         C  46   4.942   1.498  12.328
  492    H5     C  46           H5         C  46   4.443   1.687  14.669
  493    H6     C  46           H6         C  46   5.328   1.334  16.928
  494   1H5*    C  47          1H5*        C  47  11.054   3.425  19.098
  495   2H5*    C  47          2H5*        C  47  11.528   5.125  19.116
  496    H4*    C  47           H4*        C  47  12.974   3.830  17.654
  497    H3*    C  47           H3*        C  47  11.135   5.690  16.114
  498    H2*    C  47           H2*        C  47  12.617   5.214  14.253
  499   2HO*    C  47          2HO*        C  47  14.608   5.093  15.601
  500    H1*    C  47           H1*        C  47  12.618   2.517  14.789
  501   1H4     C  47          1H4         C  47   7.933   3.615  10.596
  502   2H4     C  47          2H4         C  47   6.821   3.987  11.893
  503    H5     C  47           H5         C  47   7.472   4.085  14.204
  504    H6     C  47           H6         C  47   9.357   3.841  15.754
  505   1H5*    A  48          1H5*        A  48  15.152   6.967  15.363
  506   2H5*    A  48          2H5*        A  48  15.257   8.727  15.283
  507    H4*    A  48           H4*        A  48  16.227   7.688  13.302
  508    H3*    A  48           H3*        A  48  13.641   9.147  12.697
  509    H2*    A  48           H2*        A  48  14.293   8.837  10.363
  510   2HO*    A  48          2HO*        A  48  16.693   8.989  10.902
  511    H1*    A  48           H1*        A  48  14.779   6.197  10.731
  512    H8     A  48           H8         A  48  12.004   6.995  13.195
  513   1H6     A  48          1H6         A  48   8.075   6.584   8.386
  514   2H6     A  48          2H6         A  48   8.206   6.707  10.128
  515    H2     A  48           H2         A  48  12.215   6.588   6.779
  516   1H5*    G  49          1H5*        G  49  16.519  10.815  10.184
  517   2H5*    G  49          2H5*        G  49  16.407  12.570  10.076
  518    H4*    G  49           H4*        G  49  16.440  11.541   7.872
  519    H3*    G  49           H3*        G  49  13.741  12.774   8.532
  520    H2*    G  49           H2*        G  49  13.263  12.384   6.163
  521   2HO*    G  49          2HO*        G  49  15.682  12.720   5.597
  522    H1*    G  49           H1*        G  49  14.116   9.823   6.266
  523    H8     G  49           H8         G  49  12.741  10.303   9.739
  524    H1     G  49           H1         G  49   8.158   9.961   5.244
  525   1H2     G  49          1H2         G  49   9.006  10.357   3.299
  526   2H2     G  49          2H2         G  49  10.737  10.456   3.045
  527   1H5*    G  50          1H5*        G  50  14.617  14.246   4.850
  528   2H5*    G  50          2H5*        G  50  14.472  15.995   4.723
  529    H4*    G  50           H4*        G  50  13.262  14.854   2.926
  530    H3*    G  50           H3*        G  50  11.454  16.282   4.908
  531    H2*    G  50           H2*        G  50   9.663  15.780   3.319
  532   2HO*    G  50          2HO*        G  50  11.313  15.978   1.435
  533    H1*    G  50           H1*        G  50  10.421  13.184   2.992
  534    H8     G  50           H8         G  50  11.230  13.584   6.612
  535    H1     G  50           H1         G  50   4.915  13.115   5.443
  536   1H2     G  50          1H2         G  50   4.533  13.370   3.347
  537   2H2     G  50          2H2         G  50   5.787  13.845   2.220
  538   1H5*    U  51          1H5*        U  51  10.210  17.573   1.322
  539   2H5*    U  51          2H5*        U  51  10.335  19.305   1.025
  540    H4*    U  51           H4*        U  51   8.126  18.491   0.407
  541    H3*    U  51           H3*        U  51   8.586  20.676   2.114
  542    H2*    U  51           H2*        U  51   7.901  19.686   4.033
  543   2HO*    U  51          2HO*        U  51   5.211  20.044   3.161
  544    H1*    U  51           H1*        U  51   5.805  18.022   2.636
  545    H3     U  51           H3         U  51   4.659  16.272   6.582
  546    H5     U  51           H5         U  51   8.767  16.925   7.075
  547    H6     U  51           H6         U  51   8.885  17.622   4.722
  548   1H5*    G  52          1H5*        G  52   7.562  22.669  -2.028
  549   2H5*    G  52          2H5*        G  52   5.942  22.867  -2.680
  550    H4*    G  52           H4*        G  52   7.219  20.175  -2.043
  551    H3*    G  52           H3*        G  52   6.712  21.712  -4.613
  552    H2*    G  52           H2*        G  52   6.599  19.577  -5.722
  553   2HO*    G  52          2HO*        G  52   7.086  18.209  -3.257
  554    H1*    G  52           H1*        G  52   4.959  18.509  -3.806
  555    H8     G  52           H8         G  52   3.849  22.111  -4.053
  556    H1     G  52           H1         G  52   1.421  18.226  -8.568
  557   1H2     G  52          1H2         G  52   2.672  16.483  -8.798
  558   2H2     G  52          2H2         G  52   4.043  16.174  -7.752
  559   1H5*    C  53          1H5*        C  53   9.567  18.970  -5.955
  560   2H5*    C  53          2H5*        C  53  10.750  19.740  -7.024
  561    H4*    C  53           H4*        C  53   9.670  17.882  -8.154
  562    H3*    C  53           H3*        C  53   8.728  20.539  -9.281
  563    H2*    C  53           H2*        C  53   7.715  19.191 -11.023
  564   2HO*    C  53          2HO*        C  53   9.546  17.542 -10.925
  565    H1*    C  53           H1*        C  53   6.629  17.420  -9.251
  566   1H4     C  53          1H4         C  53   2.154  21.871  -9.857
  567   2H4     C  53          2H4         C  53   2.881  22.806  -8.569
  568    H5     C  53           H5         C  53   5.059  22.342  -7.675
  569    H6     C  53           H6         C  53   6.861  20.686  -7.629
  570   1H5*    C  54          1H5*        C  54  10.082  18.480 -12.675
  571   2H5*    C  54          2H5*        C  54  10.972  19.554 -13.757
  572    H4*    C  54           H4*        C  54   9.137  18.456 -14.923
  573    H3*    C  54           H3*        C  54   8.632  21.428 -14.539
  574    H2*    C  54           H2*        C  54   6.826  21.091 -16.117
  575   2HO*    C  54          2HO*        C  54   8.120  19.365 -17.327
  576    H1*    C  54           H1*        C  54   5.926  18.847 -14.841
  577   1H4     C  54          1H4         C  54   2.823  23.728 -12.184
  578   2H4     C  54          2H4         C  54   4.100  23.924 -11.005
  579    H5     C  54           H5         C  54   6.164  22.711 -11.085
  580    H6     C  54           H6         C  54   7.409  20.986 -12.296
  581   1H5*    C  55          1H5*        C  55   8.216  20.928 -18.632
  582   2H5*    C  55          2H5*        C  55   9.093  22.173 -19.524
  583    H4*    C  55           H4*        C  55   6.768  22.107 -20.231
  584    H3*    C  55           H3*        C  55   7.438  24.588 -18.609
  585    H2*    C  55           H2*        C  55   5.290  25.401 -19.240
  586   2HO*    C  55          2HO*        C  55   5.478  24.495 -21.482
  587    H1*    C  55           H1*        C  55   4.010  22.976 -18.864
  588   1H4     C  55          1H4         C  55   3.306  26.525 -13.600
  589   2H4     C  55          2H4         C  55   4.873  26.018 -13.012
  590    H5     C  55           H5         C  55   6.345  24.583 -14.247
  591    H6     C  55           H6         C  55   6.637  23.377 -16.360
  592   1H    MET 104          1H        MET 104  10.409 -16.596   2.469
  593    HA   MET 104           HA       MET 104  11.368 -13.854   1.847
  594   1HB   MET 104          1HB       MET 104  13.250 -15.085   2.984
  595   2HB   MET 104          2HB       MET 104  13.196 -16.305   1.717
  596   1HG   MET 104          1HG       MET 104  14.532 -15.068   0.438
  597   2HG   MET 104          2HG       MET 104  13.376 -13.743   0.415
  598   1HE   MET 104          1HE       MET 104  14.525 -11.421   3.305
  599   2HE   MET 104          2HE       MET 104  13.727 -11.430   1.721
  600   3HE   MET 104          3HE       MET 104  13.116 -12.472   3.030
  601    H    TYR 105           H        TYR 105  10.845 -13.360  -0.186
  602    HA   TYR 105           HA       TYR 105  10.136 -15.580  -2.079
  603   1HB   TYR 105          1HB       TYR 105   9.062 -12.767  -1.695
  604   2HB   TYR 105          2HB       TYR 105   8.776 -13.672  -3.180
  605    HD1  TYR 105           HD1      TYR 105   8.325 -14.086   0.652
  606    HD2  TYR 105           HD2      TYR 105   7.155 -15.329  -3.351
  607    HE1  TYR 105           HE1      TYR 105   6.697 -15.664   1.599
  608    HE2  TYR 105           HE2      TYR 105   5.396 -16.770  -2.351
  609    HH   TYR 105           HH       TYR 105   4.886 -16.973   1.187
  610    H    VAL 106           H        VAL 106  11.382 -15.896  -3.805
  611    HA   VAL 106           HA       VAL 106  13.515 -13.861  -4.334
  612    HB   VAL 106           HB       VAL 106  13.440 -16.854  -4.861
  613   1HG1  VAL 106          1HG1      VAL 106  15.793 -14.921  -5.042
  614   2HG1  VAL 106          2HG1      VAL 106  15.902 -16.688  -5.147
  615   3HG1  VAL 106          3HG1      VAL 106  15.040 -15.802  -6.392
  616   1HG2  VAL 106          1HG2      VAL 106  15.031 -17.037  -3.030
  617   2HG2  VAL 106          2HG2      VAL 106  14.866 -15.279  -2.702
  618   3HG2  VAL 106          3HG2      VAL 106  13.484 -16.390  -2.463
  619    H    CYS 107           H        CYS 107  13.967 -13.082  -6.328
  620    HA   CYS 107           HA       CYS 107  12.137 -13.617  -8.559
  621   1HB   CYS 107          1HB       CYS 107  13.039 -11.329  -8.096
  622   2HB   CYS 107          2HB       CYS 107  14.672 -11.939  -8.370
  623    H    HIS 108           H        HIS 108  12.485 -15.001 -10.190
  624    HA   HIS 108           HA       HIS 108  15.101 -16.447 -10.236
  625   1HB   HIS 108          1HB       HIS 108  12.329 -17.399 -11.091
  626   2HB   HIS 108          2HB       HIS 108  13.817 -18.354 -11.184
  627    HD2  HIS 108           HD2      HIS 108  10.960 -18.360  -9.095
  628    HE1  HIS 108           HE1      HIS 108  14.023 -18.612  -6.126
  629    HE2  HIS 108           HE2      HIS 108  11.530 -18.908  -6.582
  630    H    PHE 109           H        PHE 109  14.280 -13.873 -11.657
  631    HA   PHE 109           HA       PHE 109  14.186 -14.415 -14.495
  632   1HB   PHE 109          1HB       PHE 109  13.869 -12.151 -13.140
  633   2HB   PHE 109          2HB       PHE 109  15.610 -12.010 -13.294
  634    HD1  PHE 109           HD1      PHE 109  12.379 -11.809 -14.912
  635    HD2  PHE 109           HD2      PHE 109  16.640 -11.659 -15.500
  636    HE1  PHE 109           HE1      PHE 109  11.995 -10.910 -17.206
  637    HE2  PHE 109           HE2      PHE 109  16.270 -10.742 -17.817
  638    HZ   PHE 109           HZ       PHE 109  13.940 -10.369 -18.655
  639    H    GLU 110           H        GLU 110  15.978 -14.261 -16.016
  640    HA   GLU 110           HA       GLU 110  17.987 -16.107 -15.436
  641   1HB   GLU 110          1HB       GLU 110  17.226 -15.432 -17.717
  642   2HB   GLU 110          2HB       GLU 110  18.071 -13.898 -17.544
  643   1HG   GLU 110          1HG       GLU 110  19.412 -15.373 -18.886
  644   2HG   GLU 110          2HG       GLU 110  20.243 -15.137 -17.359
  645    H    ASN 111           H        ASN 111  19.558 -15.977 -13.944
  646    HA   ASN 111           HA       ASN 111  21.577 -15.350 -13.004
  647   1HB   ASN 111          1HB       ASN 111  22.082 -14.597 -15.449
  648   2HB   ASN 111          2HB       ASN 111  21.750 -12.957 -14.887
  649   1HD2  ASN 111          1HD2      ASN 111  23.848 -12.143 -15.092
  650   2HD2  ASN 111          2HD2      ASN 111  25.185 -12.764 -14.137
  651    H    CYS 112           H        CYS 112  18.780 -13.987 -12.430
  652    HA   CYS 112           HA       CYS 112  19.578 -11.417 -11.244
  653   1HB   CYS 112          1HB       CYS 112  17.408 -11.649 -12.313
  654   2HB   CYS 112          2HB       CYS 112  16.916 -12.916 -11.163
  655    H    GLY 113           H        GLY 113  17.611 -14.046  -9.739
  656   1HA   GLY 113          1HA       GLY 113  17.815 -15.167  -7.730
  657   2HA   GLY 113          2HA       GLY 113  19.530 -14.716  -7.730
  658    H    LYS 114           H        LYS 114  17.410 -11.953  -7.880
  659    HA   LYS 114           HA       LYS 114  18.240 -11.020  -5.259
  660   1HB   LYS 114          1HB       LYS 114  17.530  -9.721  -7.402
  661   2HB   LYS 114          2HB       LYS 114  15.881  -9.888  -6.781
  662   1HG   LYS 114          1HG       LYS 114  16.460  -8.605  -4.796
  663   2HG   LYS 114          2HG       LYS 114  18.202  -8.730  -5.149
  664   1HD   LYS 114          1HD       LYS 114  17.922  -7.398  -7.200
  665   2HD   LYS 114          2HD       LYS 114  16.185  -7.364  -6.928
  666   1HE   LYS 114          1HE       LYS 114  17.051  -5.256  -6.395
  667   2HE   LYS 114          2HE       LYS 114  16.449  -6.025  -4.914
  668   1HZ   LYS 114          1HZ       LYS 114  18.623  -4.959  -4.568
  669   2HZ   LYS 114          2HZ       LYS 114  18.763  -6.566  -4.338
  670   3HZ   LYS 114          3HZ       LYS 114  19.316  -5.884  -5.719
  671    H    ALA 115           H        ALA 115  17.098 -10.843  -3.322
  672    HA   ALA 115           HA       ALA 115  14.614 -12.516  -3.154
  673   1HB   ALA 115          1HB       ALA 115  16.864 -12.271  -1.108
  674   2HB   ALA 115          2HB       ALA 115  15.415 -13.300  -1.000
  675   3HB   ALA 115          3HB       ALA 115  16.629 -13.627  -2.243
  676    H    PHE 116           H        PHE 116  12.903 -11.775  -1.984
  677    HA   PHE 116           HA       PHE 116  13.183  -9.078  -0.710
  678   1HB   PHE 116          1HB       PHE 116  10.733 -10.121  -2.192
  679   2HB   PHE 116          2HB       PHE 116  11.042  -8.514  -1.596
  680    HD1  PHE 116           HD1      PHE 116  12.318  -6.894  -2.864
  681    HD2  PHE 116           HD2      PHE 116  12.061 -10.994  -4.175
  682    HE1  PHE 116           HE1      PHE 116  13.676  -6.362  -4.896
  683    HE2  PHE 116           HE2      PHE 116  13.395 -10.467  -6.166
  684    HZ   PHE 116           HZ       PHE 116  14.235  -8.202  -6.510
  685    H    LYS 117           H        LYS 117  11.710  -8.548   0.957
  686    HA   LYS 117           HA       LYS 117  11.156 -10.628   2.840
  687   1HB   LYS 117          1HB       LYS 117  11.532  -8.200   3.341
  688   2HB   LYS 117          2HB       LYS 117   9.949  -7.819   2.661
  689   1HG   LYS 117          1HG       LYS 117   8.851  -9.192   4.406
  690   2HG   LYS 117          2HG       LYS 117  10.480  -9.599   5.032
  691   1HD   LYS 117          1HD       LYS 117  10.807  -7.037   5.263
  692   2HD   LYS 117          2HD       LYS 117   9.038  -6.916   5.038
  693   1HE   LYS 117          1HE       LYS 117   8.698  -8.466   6.945
  694   2HE   LYS 117          2HE       LYS 117  10.435  -8.711   7.076
  695   1HZ   LYS 117          1HZ       LYS 117  10.651  -6.317   7.535
  696   2HZ   LYS 117          2HZ       LYS 117   9.013  -6.169   7.609
  697   3HZ   LYS 117          3HZ       LYS 117   9.784  -7.168   8.683
  698    H    LYS 118           H        LYS 118   9.071  -8.888   0.471
  699    HA   LYS 118           HA       LYS 118   6.898 -10.894   1.025
  700   1HB   LYS 118          1HB       LYS 118   6.544  -7.911   0.509
  701   2HB   LYS 118          2HB       LYS 118   5.257  -9.036   0.839
  702   1HG   LYS 118          1HG       LYS 118   7.492  -8.401   2.828
  703   2HG   LYS 118          2HG       LYS 118   5.996  -7.499   2.749
  704   1HD   LYS 118          1HD       LYS 118   4.670  -9.236   3.496
  705   2HD   LYS 118          2HD       LYS 118   5.826 -10.465   2.990
  706   1HE   LYS 118          1HE       LYS 118   5.361 -10.180   5.479
  707   2HE   LYS 118          2HE       LYS 118   7.015 -10.467   4.900
  708   1HZ   LYS 118          1HZ       LYS 118   5.809  -8.003   5.943
  709   2HZ   LYS 118          2HZ       LYS 118   7.043  -8.833   6.543
  710   3HZ   LYS 118          3HZ       LYS 118   7.249  -7.956   5.133
  711    H    HIS 119           H        HIS 119   5.576 -11.504  -0.718
  712    HA   HIS 119           HA       HIS 119   6.910 -11.647  -3.235
  713   1HB   HIS 119          1HB       HIS 119   4.822 -12.654  -4.082
  714   2HB   HIS 119          2HB       HIS 119   5.407 -13.358  -2.604
  715    HD1  HIS 119           HD1      HIS 119   2.557 -10.727  -3.370
  716    HD2  HIS 119           HD2      HIS 119   3.625 -14.170  -1.162
  717    HE1  HIS 119           HE1      HIS 119   0.455 -11.446  -2.026
  718    HE2  HIS 119           HE2      HIS 119   1.130 -13.515  -0.725
  719    H    ASN 120           H        ASN 120   4.552  -9.303  -2.003
  720    HA   ASN 120           HA       ASN 120   3.813  -8.167  -4.542
  721   1HB   ASN 120          1HB       ASN 120   3.701  -7.274  -1.650
  722   2HB   ASN 120          2HB       ASN 120   3.544  -6.044  -2.905
  723   1HD2  ASN 120          1HD2      ASN 120   1.655  -8.222  -1.089
  724   2HD2  ASN 120          2HD2      ASN 120   0.327  -8.327  -2.249
  725    H    GLN 121           H        GLN 121   6.670  -7.761  -2.439
  726    HA   GLN 121           HA       GLN 121   7.760  -5.481  -3.946
  727   1HB   GLN 121          1HB       GLN 121   9.312  -7.404  -2.221
  728   2HB   GLN 121          2HB       GLN 121   9.699  -5.735  -2.683
  729   1HG   GLN 121          1HG       GLN 121   7.965  -4.886  -1.214
  730   2HG   GLN 121          2HG       GLN 121   7.544  -6.551  -0.744
  731   1HE2  GLN 121          1HE2      GLN 121   9.240  -3.935   0.417
  732   2HE2  GLN 121          2HE2      GLN 121  10.431  -4.824   1.353
  733    H    LEU 122           H        LEU 122   8.135  -9.065  -3.888
  734    HA   LEU 122           HA       LEU 122  10.170  -9.280  -5.839
  735   1HB   LEU 122          1HB       LEU 122   9.492 -11.181  -4.517
  736   2HB   LEU 122          2HB       LEU 122   7.844 -11.094  -5.089
  737    HG   LEU 122           HG       LEU 122   8.440 -11.862  -7.291
  738   1HD1  LEU 122          1HD1      LEU 122  11.236 -12.114  -6.158
  739   2HD1  LEU 122          2HD1      LEU 122  10.643 -12.585  -7.781
  740   3HD1  LEU 122          3HD1      LEU 122  10.751 -10.885  -7.357
  741   1HD2  LEU 122          1HD2      LEU 122   9.699 -13.636  -5.123
  742   2HD2  LEU 122          2HD2      LEU 122   7.969 -13.572  -5.526
  743   3HD2  LEU 122          3HD2      LEU 122   9.149 -14.143  -6.723
  744    H    LYS 123           H        LYS 123   6.576  -9.361  -6.288
  745    HA   LYS 123           HA       LYS 123   6.521  -9.321  -9.106
  746   1HB   LYS 123          1HB       LYS 123   4.634  -8.223  -6.984
  747   2HB   LYS 123          2HB       LYS 123   4.310  -7.978  -8.706
  748   1HG   LYS 123          1HG       LYS 123   4.426 -10.399  -9.117
  749   2HG   LYS 123          2HG       LYS 123   4.703 -10.703  -7.393
  750   1HD   LYS 123          1HD       LYS 123   2.486  -9.979  -6.809
  751   2HD   LYS 123          2HD       LYS 123   2.270  -9.160  -8.360
  752   1HE   LYS 123          1HE       LYS 123   0.943 -11.120  -8.489
  753   2HE   LYS 123          2HE       LYS 123   2.341 -11.350  -9.539
  754   1HZ   LYS 123          1HZ       LYS 123   1.824 -12.612  -6.902
  755   2HZ   LYS 123          2HZ       LYS 123   2.052 -13.336  -8.325
  756   3HZ   LYS 123          3HZ       LYS 123   3.329 -12.632  -7.590
  757    H    VAL 124           H        VAL 124   6.774  -6.557  -6.812
  758    HA   VAL 124           HA       VAL 124   6.737  -4.445  -8.736
  759    HB   VAL 124           HB       VAL 124   7.923  -4.773  -5.981
  760   1HG1  VAL 124          1HG1      VAL 124   8.195  -2.250  -7.646
  761   2HG1  VAL 124          2HG1      VAL 124   8.377  -2.338  -5.882
  762   3HG1  VAL 124          3HG1      VAL 124   9.515  -3.196  -6.919
  763   1HG2  VAL 124          1HG2      VAL 124   5.986  -2.742  -6.941
  764   2HG2  VAL 124          2HG2      VAL 124   5.427  -4.411  -6.699
  765   3HG2  VAL 124          3HG2      VAL 124   6.090  -3.549  -5.332
  766    H    HIS 125           H        HIS 125   9.474  -6.436  -7.488
  767    HA   HIS 125           HA       HIS 125  11.512  -4.990  -8.838
  768   1HB   HIS 125          1HB       HIS 125  12.048  -6.417  -7.008
  769   2HB   HIS 125          2HB       HIS 125  11.336  -7.833  -7.778
  770    HD1  HIS 125           HD1      HIS 125  14.404  -5.529  -8.223
  771    HD2  HIS 125           HD2      HIS 125  12.785  -9.247  -9.377
  772    HE1  HIS 125           HE1      HIS 125  16.273  -6.781  -9.409
  773    H    GLN 126           H        GLN 126   9.673  -7.953  -9.779
  774    HA   GLN 126           HA       GLN 126  11.112  -8.446 -12.193
  775   1HB   GLN 126          1HB       GLN 126   8.312  -9.232 -11.280
  776   2HB   GLN 126          2HB       GLN 126   9.013  -9.722 -12.858
  777   1HG   GLN 126          1HG       GLN 126  11.048 -10.554 -11.661
  778   2HG   GLN 126          2HG       GLN 126  10.327 -10.175 -10.107
  779   1HE2  GLN 126          1HE2      GLN 126  11.362 -12.589 -10.592
  780   2HE2  GLN 126          2HE2      GLN 126  10.057 -13.799 -10.705
  781    H    PHE 127           H        PHE 127   8.388  -6.279 -11.489
  782    HA   PHE 127           HA       PHE 127   7.571  -5.652 -14.122
  783   1HB   PHE 127          1HB       PHE 127   6.254  -4.326 -13.058
  784   2HB   PHE 127          2HB       PHE 127   7.005  -4.768 -11.578
  785    HD1  PHE 127           HD1      PHE 127   6.992  -3.026 -10.183
  786    HD2  PHE 127           HD2      PHE 127   7.849  -2.144 -14.300
  787    HE1  PHE 127           HE1      PHE 127   7.572  -0.814  -9.501
  788    HE2  PHE 127           HE2      PHE 127   8.390   0.159 -13.699
  789    HZ   PHE 127           HZ       PHE 127   8.395   0.864 -11.276
  790    H    SER 128           H        SER 128  10.522  -4.762 -12.374
  791    HA   SER 128           HA       SER 128  11.353  -2.626 -14.161
  792   1HB   SER 128          1HB       SER 128  12.210  -3.065 -11.821
  793   2HB   SER 128          2HB       SER 128  13.139  -4.434 -12.477
  794    HG   SER 128           HG       SER 128  14.352  -2.464 -12.402
  795    H    HIS 129           H        HIS 129  12.137  -6.171 -13.969
  796    HA   HIS 129           HA       HIS 129  13.910  -6.212 -16.239
  797   1HB   HIS 129          1HB       HIS 129  12.143  -8.401 -15.066
  798   2HB   HIS 129          2HB       HIS 129  13.349  -8.621 -16.309
  799    HD1  HIS 129           HD1      HIS 129  16.004  -8.233 -15.487
  800    HD2  HIS 129           HD2      HIS 129  12.930  -9.188 -12.812
  801    HE1  HIS 129           HE1      HIS 129  17.102  -9.366 -13.461
  802    H    THR 130           H        THR 130  10.376  -6.589 -15.912
  803    HA   THR 130           HA       THR 130   9.982  -7.231 -18.749
  804    HB   THR 130           HB       THR 130   7.575  -7.000 -18.196
  805    HG1  THR 130           HG1      THR 130   8.579  -6.050 -15.775
  806   1HG2  THR 130          1HG2      THR 130   8.829  -8.512 -15.836
  807   2HG2  THR 130          2HG2      THR 130   7.323  -8.834 -16.688
  808   3HG2  THR 130          3HG2      THR 130   8.885  -9.157 -17.488
  809    H    GLN 131           H        GLN 131  10.334  -4.354 -16.869
  810    HA   GLN 131           HA       GLN 131  10.055  -2.125 -17.255
  811   1HB   GLN 131          1HB       GLN 131  11.433  -2.988 -19.407
  812   2HB   GLN 131          2HB       GLN 131   9.969  -2.479 -20.248
  813   1HG   GLN 131          1HG       GLN 131  10.952  -0.409 -20.178
  814   2HG   GLN 131          2HG       GLN 131  10.327  -0.330 -18.530
  815   1HE2  GLN 131          1HE2      GLN 131  12.200  -1.942 -17.028
  816   2HE2  GLN 131          2HE2      GLN 131  13.759  -1.184 -17.240
  817    H    GLN 132           H        GLN 132   7.634  -3.782 -16.959
  818    HA   GLN 132           HA       GLN 132   5.763  -1.705 -18.028
  819   1HB   GLN 132          1HB       GLN 132   4.003  -3.341 -18.349
  820   2HB   GLN 132          2HB       GLN 132   5.375  -3.618 -19.411
  821   1HG   GLN 132          1HG       GLN 132   4.543  -5.742 -18.796
  822   2HG   GLN 132          2HG       GLN 132   6.069  -5.508 -17.970
  823   1HE2  GLN 132          1HE2      GLN 132   6.071  -5.939 -15.811
  824   2HE2  GLN 132          2HE2      GLN 132   4.630  -6.006 -14.783
  825    H    LEU 133           H        LEU 133   3.847  -1.412 -16.664
  826    HA   LEU 133           HA       LEU 133   4.726  -1.614 -13.866
  827   1HB   LEU 133          1HB       LEU 133   2.761   0.132 -15.347
  828   2HB   LEU 133          2HB       LEU 133   2.764   0.116 -13.573
  829    HG   LEU 133           HG       LEU 133   5.358   0.543 -15.186
  830   1HD1  LEU 133          1HD1      LEU 133   5.074   2.944 -14.809
  831   2HD1  LEU 133          2HD1      LEU 133   3.738   2.324 -15.792
  832   3HD1  LEU 133          3HD1      LEU 133   3.483   2.670 -14.065
  833   1HD2  LEU 133          1HD2      LEU 133   5.583  -0.122 -12.801
  834   2HD2  LEU 133          2HD2      LEU 133   6.207   1.490 -13.169
  835   3HD2  LEU 133          3HD2      LEU 133   4.641   1.320 -12.366
  836    HA   PRO 134           HA       PRO 134   1.889  -4.861 -13.104
  837   1HB   PRO 134          1HB       PRO 134   2.153  -4.802 -10.281
  838   2HB   PRO 134          2HB       PRO 134   3.182  -5.701 -11.432
  839   1HG   PRO 134          1HG       PRO 134   3.824  -3.324  -9.844
  840   2HG   PRO 134          2HG       PRO 134   4.898  -4.368 -10.783
  841   1HD   PRO 134          1HD       PRO 134   3.928  -1.734 -11.436
  842   2HD   PRO 134          2HD       PRO 134   4.953  -2.821 -12.380
  843    H    TYR 135           H        TYR 135   1.506  -1.895 -11.141
  844    HA   TYR 135           HA       TYR 135  -1.210  -2.751 -10.323
  845   1HB   TYR 135          1HB       TYR 135   0.476  -0.380  -9.375
  846   2HB   TYR 135          2HB       TYR 135  -1.014  -0.946  -8.661
  847    HD1  TYR 135           HD1      TYR 135   2.607  -1.483  -8.838
  848    HD2  TYR 135           HD2      TYR 135  -1.162  -3.154  -7.555
  849    HE1  TYR 135           HE1      TYR 135   3.837  -3.160  -7.482
  850    HE2  TYR 135           HE2      TYR 135   0.095  -4.912  -6.252
  851    HH   TYR 135           HH       TYR 135   3.656  -5.104  -6.228
  852    H    GLU 136           H        GLU 136  -2.506  -2.359 -12.121
  853    HA   GLU 136           HA       GLU 136  -2.401   0.371 -13.315
  854   1HB   GLU 136          1HB       GLU 136  -3.676  -0.553 -15.146
  855   2HB   GLU 136          2HB       GLU 136  -2.220  -1.505 -14.861
  856   1HG   GLU 136          1HG       GLU 136  -3.634  -3.230 -13.702
  857   2HG   GLU 136          2HG       GLU 136  -5.069  -2.301 -14.167
  858    H    CYS 137           H        CYS 137  -4.176   1.718 -13.353
  859    HA   CYS 137           HA       CYS 137  -6.155   1.368 -11.263
  860   1HB   CYS 137          1HB       CYS 137  -5.313   3.565 -11.739
  861   2HB   CYS 137          2HB       CYS 137  -5.733   3.440 -13.435
  862    HA   PRO 138           HA       PRO 138  -8.839  -0.846 -14.058
  863   1HB   PRO 138          1HB       PRO 138 -10.411  -2.097 -12.245
  864   2HB   PRO 138          2HB       PRO 138  -8.646  -2.388 -12.269
  865   1HG   PRO 138          1HG       PRO 138 -10.179  -0.432 -10.500
  866   2HG   PRO 138          2HG       PRO 138  -9.000  -1.680  -9.989
  867   1HD   PRO 138          1HD       PRO 138  -8.307   0.963 -10.435
  868   2HD   PRO 138          2HD       PRO 138  -7.190  -0.406 -10.708
  869    H    HIS 139           H        HIS 139  -9.623   2.067 -12.681
  870    HA   HIS 139           HA       HIS 139 -12.535   1.922 -12.601
  871   1HB   HIS 139          1HB       HIS 139 -10.538   4.220 -12.539
  872   2HB   HIS 139          2HB       HIS 139 -12.279   4.477 -12.520
  873    HD2  HIS 139           HD2      HIS 139  -9.557   2.788 -10.315
  874    HE1  HIS 139           HE1      HIS 139 -13.021   3.230  -7.881
  875    HE2  HIS 139           HE2      HIS 139 -10.591   2.444  -7.917
  876    H    GLU 140           H        GLU 140 -14.027   2.927 -14.026
  877    HA   GLU 140           HA       GLU 140 -13.484   2.480 -16.798
  878   1HB   GLU 140          1HB       GLU 140 -15.707   3.492 -17.168
  879   2HB   GLU 140          2HB       GLU 140 -15.718   2.269 -15.910
  880   1HG   GLU 140          1HG       GLU 140 -15.732   4.090 -14.175
  881   2HG   GLU 140          2HG       GLU 140 -15.847   5.281 -15.475
  882    H    GLY 141           H        GLY 141 -12.786   3.773 -18.425
  883   1HA   GLY 141          1HA       GLY 141 -12.305   5.744 -19.592
  884   2HA   GLY 141          2HA       GLY 141 -12.940   6.694 -18.237
  885    H    CYS 142           H        CYS 142 -10.733   4.498 -16.948
  886    HA   CYS 142           HA       CYS 142  -8.476   6.451 -17.165
  887   1HB   CYS 142          1HB       CYS 142  -9.779   6.161 -14.944
  888   2HB   CYS 142          2HB       CYS 142  -9.000   4.595 -14.810
  889    H    ASP 143           H        ASP 143  -6.332   5.591 -17.155
  890    HA   ASP 143           HA       ASP 143  -5.985   2.663 -17.489
  891   1HB   ASP 143          1HB       ASP 143  -6.565   3.747 -19.755
  892   2HB   ASP 143          2HB       ASP 143  -5.028   4.599 -19.643
  893    H    LYS 144           H        LYS 144  -5.069   5.101 -15.713
  894    HA   LYS 144           HA       LYS 144  -2.206   5.378 -16.088
  895   1HB   LYS 144          1HB       LYS 144  -3.916   5.701 -13.569
  896   2HB   LYS 144          2HB       LYS 144  -2.225   6.153 -13.740
  897   1HG   LYS 144          1HG       LYS 144  -3.310   7.557 -15.834
  898   2HG   LYS 144          2HG       LYS 144  -4.655   7.576 -14.669
  899   1HD   LYS 144          1HD       LYS 144  -3.161   8.532 -12.940
  900   2HD   LYS 144          2HD       LYS 144  -1.801   8.434 -14.065
  901   1HE   LYS 144          1HE       LYS 144  -2.447  10.662 -14.204
  902   2HE   LYS 144          2HE       LYS 144  -3.129   9.923 -15.656
  903   1HZ   LYS 144          1HZ       LYS 144  -4.796  11.300 -14.659
  904   2HZ   LYS 144          2HZ       LYS 144  -5.266   9.765 -14.338
  905   3HZ   LYS 144          3HZ       LYS 144  -4.551  10.694 -13.167
  906    H    ARG 145           H        ARG 145  -0.480   4.370 -14.963
  907    HA   ARG 145           HA       ARG 145  -1.141   1.924 -13.369
  908   1HB   ARG 145          1HB       ARG 145   1.063   1.933 -15.486
  909   2HB   ARG 145          2HB       ARG 145   0.444   0.591 -14.472
  910   1HG   ARG 145          1HG       ARG 145  -1.787   0.885 -15.585
  911   2HG   ARG 145          2HG       ARG 145  -1.012   1.958 -16.749
  912   1HD   ARG 145          1HD       ARG 145   0.320   0.168 -17.647
  913   2HD   ARG 145          2HD       ARG 145  -0.034  -0.878 -16.265
  914    HE   ARG 145           HE       ARG 145  -2.048  -1.513 -17.208
  915   1HH1  ARG 145          1HH1      ARG 145  -1.114   1.378 -18.994
  916   2HH1  ARG 145          2HH1      ARG 145  -2.676   1.449 -19.780
  917   1HH2  ARG 145          1HH2      ARG 145  -3.855  -1.376 -18.199
  918   2HH2  ARG 145          2HH2      ARG 145  -4.229  -0.019 -19.283
  919    H    PHE 146           H        PHE 146   0.428   1.302 -11.875
  920    HA   PHE 146           HA       PHE 146   2.367   3.469 -11.181
  921   1HB   PHE 146          1HB       PHE 146   0.453   2.036  -9.283
  922   2HB   PHE 146          2HB       PHE 146   1.561   3.327  -8.860
  923    HD1  PHE 146           HD1      PHE 146  -1.631   2.511 -10.523
  924    HD2  PHE 146           HD2      PHE 146   1.201   5.659  -9.664
  925    HE1  PHE 146           HE1      PHE 146  -3.265   4.166 -11.261
  926    HE2  PHE 146           HE2      PHE 146  -0.428   7.333 -10.519
  927    HZ   PHE 146           HZ       PHE 146  -2.625   6.590 -11.380
  928    H    SER 147           H        SER 147   3.982   2.863  -9.613
  929    HA   SER 147           HA       SER 147   5.049   0.221 -10.313
  930   1HB   SER 147          1HB       SER 147   7.048   1.190  -8.930
  931   2HB   SER 147          2HB       SER 147   6.601   1.988 -10.451
  932    HG   SER 147           HG       SER 147   6.545   3.699  -9.267
  933    H    LEU 148           H        LEU 148   3.293   1.591  -7.634
  934    HA   LEU 148           HA       LEU 148   3.726  -0.936  -6.130
  935   1HB   LEU 148          1HB       LEU 148   4.245   1.867  -5.114
  936   2HB   LEU 148          2HB       LEU 148   3.660   0.654  -3.998
  937    HG   LEU 148           HG       LEU 148   6.226   0.385  -5.612
  938   1HD1  LEU 148          1HD1      LEU 148   5.792   0.941  -2.646
  939   2HD1  LEU 148          2HD1      LEU 148   7.355   0.716  -3.459
  940   3HD1  LEU 148          3HD1      LEU 148   6.344   2.120  -3.841
  941   1HD2  LEU 148          1HD2      LEU 148   5.226  -1.302  -3.263
  942   2HD2  LEU 148          2HD2      LEU 148   5.101  -1.791  -4.961
  943   3HD2  LEU 148          3HD2      LEU 148   6.697  -1.563  -4.211
  944    HA   PRO 149           HA       PRO 149  -0.627  -0.870  -5.619
  945   1HB   PRO 149          1HB       PRO 149  -0.920  -2.017  -3.084
  946   2HB   PRO 149          2HB       PRO 149  -0.554  -2.899  -4.581
  947   1HG   PRO 149          1HG       PRO 149   1.348  -2.045  -2.404
  948   2HG   PRO 149          2HG       PRO 149   1.301  -3.580  -3.357
  949   1HD   PRO 149          1HD       PRO 149   3.084  -1.608  -3.975
  950   2HD   PRO 149          2HD       PRO 149   2.324  -2.609  -5.161
  951    H    SER 150           H        SER 150   1.308   0.490  -2.946
  952    HA   SER 150           HA       SER 150  -0.790   1.965  -1.647
  953   1HB   SER 150          1HB       SER 150   1.151   3.380  -0.814
  954   2HB   SER 150          2HB       SER 150   1.287   1.640  -0.495
  955    HG   SER 150           HG       SER 150   3.222   2.648  -1.364
  956    H    ARG 151           H        ARG 151   1.366   2.688  -4.407
  957    HA   ARG 151           HA       ARG 151   0.581   5.477  -4.654
  958   1HB   ARG 151          1HB       ARG 151   1.923   3.547  -6.608
  959   2HB   ARG 151          2HB       ARG 151   1.707   5.284  -6.907
  960   1HG   ARG 151          1HG       ARG 151   3.006   5.839  -4.912
  961   2HG   ARG 151          2HG       ARG 151   3.135   4.137  -4.468
  962   1HD   ARG 151          1HD       ARG 151   4.439   3.715  -6.564
  963   2HD   ARG 151          2HD       ARG 151   4.452   5.472  -6.849
  964    HE   ARG 151           HE       ARG 151   5.241   5.205  -4.203
  965   1HH1  ARG 151          1HH1      ARG 151   6.676   3.705  -7.062
  966   2HH1  ARG 151          2HH1      ARG 151   8.234   3.646  -6.277
  967   1HH2  ARG 151          1HH2      ARG 151   7.007   4.971  -3.323
  968   2HH2  ARG 151          2HH2      ARG 151   8.445   4.341  -4.136
  969    H    LEU 152           H        LEU 152  -0.490   2.404  -6.147
  970    HA   LEU 152           HA       LEU 152  -2.410   3.558  -7.971
  971   1HB   LEU 152          1HB       LEU 152  -1.674   1.273  -8.228
  972   2HB   LEU 152          2HB       LEU 152  -2.175   0.865  -6.583
  973    HG   LEU 152           HG       LEU 152  -4.514   1.022  -7.149
  974   1HD1  LEU 152          1HD1      LEU 152  -4.419   2.864  -8.892
  975   2HD1  LEU 152          2HD1      LEU 152  -3.681   1.693 -10.003
  976   3HD1  LEU 152          3HD1      LEU 152  -5.328   1.444  -9.373
  977   1HD2  LEU 152          1HD2      LEU 152  -3.103  -0.546  -9.333
  978   2HD2  LEU 152          2HD2      LEU 152  -3.194  -1.093  -7.652
  979   3HD2  LEU 152          3HD2      LEU 152  -4.682  -0.886  -8.609
  980    H    LYS 153           H        LYS 153  -2.663   2.265  -4.594
  981    HA   LYS 153           HA       LYS 153  -5.448   2.740  -4.246
  982   1HB   LYS 153          1HB       LYS 153  -3.103   2.533  -2.334
  983   2HB   LYS 153          2HB       LYS 153  -4.706   2.927  -1.722
  984   1HG   LYS 153          1HG       LYS 153  -4.250   0.514  -3.510
  985   2HG   LYS 153          2HG       LYS 153  -4.033   0.435  -1.760
  986   1HD   LYS 153          1HD       LYS 153  -6.314   0.997  -1.320
  987   2HD   LYS 153          2HD       LYS 153  -6.642   1.436  -2.992
  988   1HE   LYS 153          1HE       LYS 153  -5.907  -1.382  -2.084
  989   2HE   LYS 153          2HE       LYS 153  -7.559  -0.788  -2.272
  990   1HZ   LYS 153          1HZ       LYS 153  -5.564  -1.005  -4.453
  991   2HZ   LYS 153          2HZ       LYS 153  -6.923  -1.896  -4.282
  992   3HZ   LYS 153          3HZ       LYS 153  -7.029  -0.295  -4.628
  993    H    ARG 154           H        ARG 154  -2.644   4.927  -3.744
  994    HA   ARG 154           HA       ARG 154  -4.215   7.129  -2.699
  995   1HB   ARG 154          1HB       ARG 154  -1.763   6.924  -2.399
  996   2HB   ARG 154          2HB       ARG 154  -1.508   7.175  -4.136
  997   1HG   ARG 154          1HG       ARG 154  -2.328   9.406  -4.030
  998   2HG   ARG 154          2HG       ARG 154  -3.053   9.177  -2.436
  999   1HD   ARG 154          1HD       ARG 154  -1.057  10.593  -2.261
 1000   2HD   ARG 154          2HD       ARG 154  -0.881   9.120  -1.364
 1001    HE   ARG 154           HE       ARG 154   0.706   8.286  -2.904
 1002   1HH1  ARG 154          1HH1      ARG 154  -0.376  11.389  -4.138
 1003   2HH1  ARG 154          2HH1      ARG 154   1.294  11.941  -4.271
 1004   1HH2  ARG 154          1HH2      ARG 154   2.728   8.917  -3.694
 1005   2HH2  ARG 154          2HH2      ARG 154   2.872  10.480  -4.452
 1006    H    HIS 155           H        HIS 155  -3.303   6.062  -5.990
 1007    HA   HIS 155           HA       HIS 155  -4.346   8.390  -7.353
 1008   1HB   HIS 155          1HB       HIS 155  -2.812   6.940  -8.507
 1009   2HB   HIS 155          2HB       HIS 155  -3.848   5.527  -8.287
 1010    HD1  HIS 155           HD1      HIS 155  -3.975   8.927 -10.116
 1011    HD2  HIS 155           HD2      HIS 155  -5.834   5.149  -9.972
 1012    HE1  HIS 155           HE1      HIS 155  -5.855   9.010 -11.826
 1013    H    GLU 156           H        GLU 156  -5.783   5.233  -6.376
 1014    HA   GLU 156           HA       GLU 156  -8.280   5.487  -7.672
 1015   1HB   GLU 156          1HB       GLU 156  -7.471   4.113  -5.065
 1016   2HB   GLU 156          2HB       GLU 156  -9.127   4.117  -5.662
 1017   1HG   GLU 156          1HG       GLU 156  -8.195   3.236  -7.892
 1018   2HG   GLU 156          2HG       GLU 156  -6.704   2.896  -7.020
 1019    H    LYS 157           H        LYS 157  -7.068   7.100  -4.753
 1020    HA   LYS 157           HA       LYS 157  -9.561   7.983  -3.643
 1021   1HB   LYS 157          1HB       LYS 157  -7.332   8.083  -2.496
 1022   2HB   LYS 157          2HB       LYS 157  -6.844   9.356  -3.612
 1023   1HG   LYS 157          1HG       LYS 157  -7.421  10.260  -1.456
 1024   2HG   LYS 157          2HG       LYS 157  -8.461  10.896  -2.729
 1025   1HD   LYS 157          1HD       LYS 157 -10.310   9.452  -1.999
 1026   2HD   LYS 157          2HD       LYS 157  -9.250   8.627  -0.847
 1027   1HE   LYS 157          1HE       LYS 157 -10.644  10.223   0.333
 1028   2HE   LYS 157          2HE       LYS 157  -8.954  10.734   0.409
 1029   1HZ   LYS 157          1HZ       LYS 157  -9.428  12.319  -1.387
 1030   2HZ   LYS 157          2HZ       LYS 157 -10.986  11.835  -1.474
 1031   3HZ   LYS 157          3HZ       LYS 157 -10.431  12.585  -0.122
 1032    H    VAL 158           H        VAL 158  -7.688   9.061  -6.459
 1033    HA   VAL 158           HA       VAL 158  -8.841  11.663  -6.796
 1034    HB   VAL 158           HB       VAL 158  -7.907   9.701  -8.954
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.150  12.721  -9.017
 1036   2HG1  VAL 158          2HG1      VAL 158  -7.497  11.691 -10.313
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.217  11.589  -9.901
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.503  12.074  -7.719
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.064  10.392  -7.316
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.818  11.010  -8.974
 1041    H    HIS 159           H        HIS 159  -9.896   8.404  -7.864
 1042    HA   HIS 159           HA       HIS 159 -12.245   9.396  -9.277
 1043   1HB   HIS 159          1HB       HIS 159 -11.389   6.611  -8.359
 1044   2HB   HIS 159          2HB       HIS 159 -12.859   6.938  -9.295
 1045    HD1  HIS 159           HD1      HIS 159 -12.110   8.634 -11.638
 1046    HD2  HIS 159           HD2      HIS 159  -9.368   5.984  -9.851
 1047    HE1  HIS 159           HE1      HIS 159 -10.219   8.297 -13.320
 1048    H    ALA 160           H        ALA 160 -11.530   8.316  -5.970
 1049    HA   ALA 160           HA       ALA 160 -14.290   8.020  -5.134
 1050   1HB   ALA 160          1HB       ALA 160 -13.346   8.001  -2.863
 1051   2HB   ALA 160          2HB       ALA 160 -12.367   6.980  -3.936
 1052   3HB   ALA 160          3HB       ALA 160 -11.794   8.601  -3.479
 1053    H    GLY 161           H        GLY 161 -12.061  10.754  -5.481
 1054   1HA   GLY 161          1HA       GLY 161 -12.787  12.993  -5.733
 1055   2HA   GLY 161          2HA       GLY 161 -14.313  12.593  -4.949
 1056    H    TYR 162           H        TYR 162 -13.164  14.908  -4.233
 1057    HA   TYR 162           HA       TYR 162 -11.991  14.333  -1.534
 1058   1HB   TYR 162          1HB       TYR 162 -11.381  16.696  -3.359
 1059   2HB   TYR 162          2HB       TYR 162 -10.705  16.431  -1.744
 1060    HD1  TYR 162           HD1      TYR 162  -8.744  14.936  -1.496
 1061    HD2  TYR 162           HD2      TYR 162 -10.924  15.107  -5.214
 1062    HE1  TYR 162           HE1      TYR 162  -7.038  13.471  -2.591
 1063    HE2  TYR 162           HE2      TYR 162  -9.397  13.477  -6.203
 1064    HH   TYR 162           HH       TYR 162  -6.335  12.523  -4.648
 1065    HA   PRO 163           HA       PRO 163 -15.954  16.434  -1.018
 1066   1HB   PRO 163          1HB       PRO 163 -16.751  15.254   1.319
 1067   2HB   PRO 163          2HB       PRO 163 -16.742  14.373  -0.236
 1068   1HG   PRO 163          1HG       PRO 163 -14.626  14.308   1.931
 1069   2HG   PRO 163          2HG       PRO 163 -15.391  12.928   1.081
 1070   1HD   PRO 163          1HD       PRO 163 -12.975  13.983   0.335
 1071   2HD   PRO 163          2HD       PRO 163 -14.130  13.304  -0.862
 1072    H    CYS 164           H        CYS 164 -16.632  18.224   0.112
 1073    HA   CYS 164           HA       CYS 164 -14.666  19.636   1.703
 1074   1HB   CYS 164          1HB       CYS 164 -16.508  20.580   0.120
 1075   2HB   CYS 164          2HB       CYS 164 -17.602  20.369   1.509
 1076    H    LYS 165           H        LYS 165 -14.514  19.953   3.841
 1077    HA   LYS 165           HA       LYS 165 -16.694  18.994   5.626
 1078   1HB   LYS 165          1HB       LYS 165 -13.737  18.307   5.957
 1079   2HB   LYS 165          2HB       LYS 165 -14.969  18.001   7.175
 1080   1HG   LYS 165          1HG       LYS 165 -14.951  16.719   4.411
 1081   2HG   LYS 165          2HG       LYS 165 -14.300  15.998   5.878
 1082   1HD   LYS 165          1HD       LYS 165 -16.509  16.006   6.941
 1083   2HD   LYS 165          2HD       LYS 165 -17.223  16.802   5.524
 1084   1HE   LYS 165          1HE       LYS 165 -16.554  14.886   4.103
 1085   2HE   LYS 165          2HE       LYS 165 -15.859  14.078   5.515
 1086   1HZ   LYS 165          1HZ       LYS 165 -18.112  13.286   5.065
 1087   2HZ   LYS 165          2HZ       LYS 165 -18.086  14.044   6.509
 1088   3HZ   LYS 165          3HZ       LYS 165 -18.727  14.791   5.206
 1089    H    LYS 166           H        LYS 166 -15.197  21.580   4.535
 1090    HA   LYS 166           HA       LYS 166 -14.099  22.855   6.913
 1091   1HB   LYS 166          1HB       LYS 166 -15.237  23.986   4.339
 1092   2HB   LYS 166          2HB       LYS 166 -14.429  24.959   5.556
 1093   1HG   LYS 166          1HG       LYS 166 -13.187  22.745   3.877
 1094   2HG   LYS 166          2HG       LYS 166 -12.935  24.485   3.719
 1095   1HD   LYS 166          1HD       LYS 166 -12.011  22.749   6.041
 1096   2HD   LYS 166          2HD       LYS 166 -11.014  23.421   4.749
 1097   1HE   LYS 166          1HE       LYS 166 -11.597  25.725   5.474
 1098   2HE   LYS 166          2HE       LYS 166 -12.580  25.064   6.789
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.363  25.654   7.568
 1100   2HZ   LYS 166          2HZ       LYS 166 -10.558  24.040   7.696
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.651  24.659   6.485
 1102    H    ASP 167           H        ASP 167 -17.354  22.295   5.729
 1103    HA   ASP 167           HA       ASP 167 -18.424  23.499   8.201
 1104   1HB   ASP 167          1HB       ASP 167 -18.378  25.337   6.393
 1105   2HB   ASP 167          2HB       ASP 167 -19.579  24.386   5.523
 1106    H    ASP 168           H        ASP 168 -20.381  22.578   8.845
 1107    HA   ASP 168           HA       ASP 168 -20.950  19.959   7.868
 1108   1HB   ASP 168          1HB       ASP 168 -21.364  20.771  10.188
 1109   2HB   ASP 168          2HB       ASP 168 -22.675  21.789   9.591
 1110    H    SER 169           H        SER 169 -22.271  23.130   6.980
 1111    HA   SER 169           HA       SER 169 -24.573  21.912   5.549
 1112   1HB   SER 169          1HB       SER 169 -25.335  24.184   5.237
 1113   2HB   SER 169          2HB       SER 169 -24.860  23.975   6.921
 1114    HG   SER 169           HG       SER 169 -22.843  25.011   6.391
 1115    H    CYS 170           H        CYS 170 -21.561  21.734   4.732
 1116    HA   CYS 170           HA       CYS 170 -21.918  22.704   1.928
 1117   1HB   CYS 170          1HB       CYS 170 -20.026  23.708   3.339
 1118   2HB   CYS 170          2HB       CYS 170 -19.297  22.113   3.333
 1119    H    SER 171           H        SER 171 -21.789  21.178   0.317
 1120    HA   SER 171           HA       SER 171 -21.089  18.366   1.104
 1121   1HB   SER 171          1HB       SER 171 -23.492  19.265  -0.548
 1122   2HB   SER 171          2HB       SER 171 -23.058  17.589  -0.166
 1123    HG   SER 171           HG       SER 171 -24.677  18.416   1.241
 1124    H    PHE 172           H        PHE 172 -19.849  20.688  -0.634
 1125    HA   PHE 172           HA       PHE 172 -19.808  19.799  -3.362
 1126   1HB   PHE 172          1HB       PHE 172 -19.025  21.999  -2.887
 1127   2HB   PHE 172          2HB       PHE 172 -17.940  21.436  -1.626
 1128    HD1  PHE 172           HD1      PHE 172 -15.806  20.321  -2.125
 1129    HD2  PHE 172           HD2      PHE 172 -18.329  21.783  -5.289
 1130    HE1  PHE 172           HE1      PHE 172 -13.965  19.982  -3.740
 1131    HE2  PHE 172           HE2      PHE 172 -16.407  21.644  -6.874
 1132    HZ   PHE 172           HZ       PHE 172 -14.208  20.781  -6.084
 1133    H    VAL 173           H        VAL 173 -18.547  18.327  -4.448
 1134    HA   VAL 173           HA       VAL 173 -16.318  17.021  -2.954
 1135    HB   VAL 173           HB       VAL 173 -18.254  15.598  -4.820
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.010  13.544  -4.119
 1137   2HG1  VAL 173          2HG1      VAL 173 -15.917  14.654  -4.940
 1138   3HG1  VAL 173          3HG1      VAL 173 -15.889  14.539  -3.170
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.744  14.264  -2.669
 1140   2HG2  VAL 173          2HG2      VAL 173 -17.932  15.593  -1.793
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.390  15.902  -2.739
 1142    H    GLY 174           H        GLY 174 -14.437  17.353  -3.940
 1143   1HA   GLY 174          1HA       GLY 174 -14.440  18.379  -6.717
 1144   2HA   GLY 174          2HA       GLY 174 -13.049  18.271  -5.623
 1145    H    LYS 175           H        LYS 175 -13.755  17.343  -8.538
 1146    HA   LYS 175           HA       LYS 175 -13.424  14.489  -8.549
 1147   1HB   LYS 175          1HB       LYS 175 -12.725  16.569 -10.682
 1148   2HB   LYS 175          2HB       LYS 175 -12.757  14.827 -10.932
 1149   1HG   LYS 175          1HG       LYS 175 -15.164  14.759 -10.330
 1150   2HG   LYS 175          2HG       LYS 175 -15.156  16.521 -10.120
 1151   1HD   LYS 175          1HD       LYS 175 -14.523  16.818 -12.500
 1152   2HD   LYS 175          2HD       LYS 175 -14.443  15.064 -12.700
 1153   1HE   LYS 175          1HE       LYS 175 -16.523  15.778 -13.621
 1154   2HE   LYS 175          2HE       LYS 175 -16.867  14.888 -12.135
 1155   1HZ   LYS 175          1HZ       LYS 175 -17.189  17.028 -11.011
 1156   2HZ   LYS 175          2HZ       LYS 175 -16.824  17.855 -12.379
 1157   3HZ   LYS 175          3HZ       LYS 175 -18.171  16.939 -12.307
 1158    H    THR 176           H        THR 176 -11.178  17.058  -7.904
 1159    HA   THR 176           HA       THR 176  -9.029  15.069  -7.549
 1160    HB   THR 176           HB       THR 176  -7.487  17.024  -8.614
 1161    HG1  THR 176           HG1      THR 176  -8.691  18.292  -9.705
 1162   1HG2  THR 176          1HG2      THR 176  -8.719  14.717 -10.145
 1163   2HG2  THR 176          2HG2      THR 176  -7.288  15.617 -10.630
 1164   3HG2  THR 176          3HG2      THR 176  -7.253  14.662  -9.130
 1165    H    TRP 177           H        TRP 177  -7.223  15.918  -6.289
 1166    HA   TRP 177           HA       TRP 177  -8.119  17.192  -3.978
 1167   1HB   TRP 177          1HB       TRP 177  -6.153  15.813  -3.998
 1168   2HB   TRP 177          2HB       TRP 177  -5.350  16.849  -5.147
 1169    HD1  TRP 177           HD1      TRP 177  -3.430  17.829  -4.091
 1170    HE1  TRP 177           HE1      TRP 177  -2.806  19.037  -1.903
 1171    HE3  TRP 177           HE3      TRP 177  -7.770  17.054  -1.559
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.775  18.847   0.800
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.815  17.385   0.900
 1174    HH2  TRP 177           HH2      TRP 177  -5.807  18.210   2.097
 1175    H    THR 178           H        THR 178  -6.407  18.667  -6.787
 1176    HA   THR 178           HA       THR 178  -6.033  21.273  -5.736
 1177    HB   THR 178           HB       THR 178  -6.354  21.996  -8.189
 1178    HG1  THR 178           HG1      THR 178  -6.001  19.420  -9.034
 1179   1HG2  THR 178          1HG2      THR 178  -4.241  21.120  -8.972
 1180   2HG2  THR 178          2HG2      THR 178  -4.133  21.674  -7.293
 1181   3HG2  THR 178          3HG2      THR 178  -4.205  19.942  -7.648
 1182    H    LEU 179           H        LEU 179  -8.861  19.932  -7.525
 1183    HA   LEU 179           HA       LEU 179 -10.335  22.328  -7.628
 1184   1HB   LEU 179          1HB       LEU 179 -11.358  19.452  -7.475
 1185   2HB   LEU 179          2HB       LEU 179 -12.327  20.849  -7.929
 1186    HG   LEU 179           HG       LEU 179  -9.937  19.758  -9.444
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.608  19.201 -11.157
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.972  18.415  -9.619
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.905  19.845 -10.123
 1190   1HD2  LEU 179          1HD2      LEU 179 -11.738  22.135 -10.099
 1191   2HD2  LEU 179          2HD2      LEU 179  -9.984  22.178  -9.796
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.600  21.378 -11.238
 1193    H    TYR 180           H        TYR 180 -10.115  19.912  -5.004
 1194    HA   TYR 180           HA       TYR 180 -12.259  21.066  -3.413
 1195   1HB   TYR 180          1HB       TYR 180 -11.748  18.860  -2.866
 1196   2HB   TYR 180          2HB       TYR 180 -10.007  19.112  -2.917
 1197    HD1  TYR 180           HD1      TYR 180 -13.028  20.307  -0.976
 1198    HD2  TYR 180           HD2      TYR 180  -8.823  19.354  -0.918
 1199    HE1  TYR 180           HE1      TYR 180 -12.919  20.856   1.450
 1200    HE2  TYR 180           HE2      TYR 180  -8.753  19.782   1.531
 1201    HH   TYR 180           HH       TYR 180  -9.938  20.423   3.383
 1202    H    LEU 181           H        LEU 181  -8.662  21.257  -3.273
 1203    HA   LEU 181           HA       LEU 181  -8.516  23.141  -1.179
 1204   1HB   LEU 181          1HB       LEU 181  -6.725  22.619  -3.582
 1205   2HB   LEU 181          2HB       LEU 181  -6.324  23.796  -2.365
 1206    HG   LEU 181           HG       LEU 181  -6.734  20.783  -1.913
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.674  21.031  -3.040
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.271  22.539  -2.164
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.237  20.982  -1.331
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.733  21.187   0.372
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.954  22.940   0.070
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.349  21.847   0.150
 1213    H    LYS 182           H        LYS 182  -8.831  23.710  -4.713
 1214    HA   LYS 182           HA       LYS 182  -8.757  26.586  -4.628
 1215   1HB   LYS 182          1HB       LYS 182  -8.475  25.253  -6.690
 1216   2HB   LYS 182          2HB       LYS 182 -10.156  24.709  -6.595
 1217   1HG   LYS 182          1HG       LYS 182 -10.961  26.997  -6.946
 1218   2HG   LYS 182          2HG       LYS 182  -9.300  27.626  -6.864
 1219   1HD   LYS 182          1HD       LYS 182  -8.710  26.442  -8.933
 1220   2HD   LYS 182          2HD       LYS 182 -10.269  25.612  -8.937
 1221   1HE   LYS 182          1HE       LYS 182 -10.385  27.366 -10.563
 1222   2HE   LYS 182          2HE       LYS 182 -11.440  27.787  -9.211
 1223   1HZ   LYS 182          1HZ       LYS 182  -9.632  29.268  -8.410
 1224   2HZ   LYS 182          2HZ       LYS 182  -8.724  28.911  -9.731
 1225   3HZ   LYS 182          3HZ       LYS 182 -10.140  29.692  -9.900
 1226    H    HIS 183           H        HIS 183 -11.467  24.228  -4.402
 1227    HA   HIS 183           HA       HIS 183 -13.592  26.129  -4.285
 1228   1HB   HIS 183          1HB       HIS 183 -14.170  23.860  -4.652
 1229   2HB   HIS 183          2HB       HIS 183 -13.254  23.270  -3.288
 1230    HD1  HIS 183           HD1      HIS 183 -16.651  24.922  -3.972
 1231    HD2  HIS 183           HD2      HIS 183 -14.310  23.378  -0.835
 1232    HE1  HIS 183           HE1      HIS 183 -18.174  24.800  -1.927
 1233    H    VAL 184           H        VAL 184 -11.530  24.680  -1.719
 1234    HA   VAL 184           HA       VAL 184 -12.885  25.832   0.513
 1235    HB   VAL 184           HB       VAL 184 -10.066  24.812   0.065
 1236   1HG1  VAL 184          1HG1      VAL 184 -11.134  25.955   2.675
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.639  25.003   2.476
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.764  26.600   1.724
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.565  23.915   1.542
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.688  23.109   0.219
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.950  23.168   1.803
 1242    H    ALA 185           H        ALA 185 -10.116  27.008  -1.428
 1243    HA   ALA 185           HA       ALA 185  -9.592  29.284   0.160
 1244   1HB   ALA 185          1HB       ALA 185  -9.146  28.879  -2.838
 1245   2HB   ALA 185          2HB       ALA 185  -8.360  30.104  -1.819
 1246   3HB   ALA 185          3HB       ALA 185  -8.033  28.384  -1.541
 1247    H    GLU 186           H        GLU 186 -11.958  28.735  -2.440
 1248    HA   GLU 186           HA       GLU 186 -12.597  31.601  -2.681
 1249   1HB   GLU 186          1HB       GLU 186 -12.495  30.001  -4.617
 1250   2HB   GLU 186          2HB       GLU 186 -13.926  29.181  -3.987
 1251   1HG   GLU 186          1HG       GLU 186 -15.269  31.208  -4.306
 1252   2HG   GLU 186          2HG       GLU 186 -13.831  32.139  -4.728
 1253    H    CYS 187           H        CYS 187 -14.031  28.675  -1.195
 1254    HA   CYS 187           HA       CYS 187 -16.563  30.166  -0.670
 1255   1HB   CYS 187          1HB       CYS 187 -15.908  27.186  -0.524
 1256   2HB   CYS 187          2HB       CYS 187 -17.503  27.901  -0.247
 1257    HG   CYS 187           HG       CYS 187 -15.597  27.968  -2.940
 1258    H    HIS 188           H        HIS 188 -13.765  28.953   1.083
 1259    HA   HIS 188           HA       HIS 188 -15.216  29.465   3.669
 1260   1HB   HIS 188          1HB       HIS 188 -13.189  27.260   3.107
 1261   2HB   HIS 188          2HB       HIS 188 -13.914  27.611   4.679
 1262    HD1  HIS 188           HD1      HIS 188 -16.752  27.295   4.710
 1263    HD2  HIS 188           HD2      HIS 188 -14.481  25.615   1.596
 1264    HE1  HIS 188           HE1      HIS 188 -18.226  25.503   3.629
 1265    H    GLN 189           H        GLN 189 -12.891  30.688   1.700
 1266    HA   GLN 189           HA       GLN 189 -11.450  31.905   4.018
 1267   1HB   GLN 189          1HB       GLN 189 -10.125  30.759   1.539
 1268   2HB   GLN 189          2HB       GLN 189  -9.296  31.774   2.696
 1269   1HG   GLN 189          1HG       GLN 189 -10.506  29.077   3.435
 1270   2HG   GLN 189          2HG       GLN 189  -8.858  29.306   2.886
 1271   1HE2  GLN 189          1HE2      GLN 189 -11.092  30.049   5.577
 1272   2HE2  GLN 189          2HE2      GLN 189  -9.795  30.447   6.712
 1273    H    ASP 190           H        ASP 190 -13.513  32.510   1.635
 1274    HA   ASP 190           HA       ASP 190 -12.641  35.293   1.321
 1275   1HB   ASP 190          1HB       ASP 190 -11.470  34.113  -0.563
 1276   2HB   ASP 190          2HB       ASP 190 -13.031  33.553  -1.159
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  -7.473  30.617 -13.371
    2   2H5*    G   1          2H5*        G   1  -8.258  29.070 -13.002
    3    H4*    G   1           H4*        G   1  -7.650  29.198 -15.357
    4    H3*    G   1           H3*        G   1  -5.997  27.213 -13.777
    5    H2*    G   1           H2*        G   1  -5.159  26.474 -15.940
    6   2HO*    G   1          2HO*        G   1  -7.336  27.025 -17.017
    7    H1*    G   1           H1*        G   1  -4.575  28.974 -16.759
    8    H8     G   1           H8         G   1  -4.048  29.372 -13.067
    9    H1     G   1           H1         G   1   0.750  26.292 -16.037
   10   1H2     G   1          1H2         G   1   0.090  25.540 -17.958
   11   2H2     G   1          2H2         G   1  -1.472  25.974 -18.627
   12   1H5*    G   2          1H5*        G   2  -7.471  25.035 -16.953
   13   2H5*    G   2          2H5*        G   2  -8.110  23.464 -16.473
   14    H4*    G   2           H4*        G   2  -6.464  23.237 -18.254
   15    H3*    G   2           H3*        G   2  -5.521  22.149 -15.590
   16    H2*    G   2           H2*        G   2  -3.657  21.215 -16.842
   17   2HO*    G   2          2HO*        G   2  -5.116  20.891 -18.835
   18    H1*    G   2           H1*        G   2  -3.142  23.537 -18.147
   19    H8     G   2           H8         G   2  -4.397  24.761 -14.804
   20    H1     G   2           H1         G   2   1.600  22.450 -14.593
   21   1H2     G   2          1H2         G   2   1.966  21.180 -16.300
   22   2H2     G   2          2H2         G   2   0.821  21.045 -17.620
   23   1H5*    G   3          1H5*        G   3  -4.932  18.952 -18.252
   24   2H5*    G   3          2H5*        G   3  -5.584  17.446 -17.596
   25    H4*    G   3           H4*        G   3  -3.231  17.171 -18.243
   26    H3*    G   3           H3*        G   3  -3.785  17.110 -15.254
   27    H2*    G   3           H2*        G   3  -1.490  16.403 -15.016
   28   2HO*    G   3          2HO*        G   3  -1.683  15.106 -17.130
   29    H1*    G   3           H1*        G   3  -0.502  18.200 -16.841
   30    H8     G   3           H8         G   3  -3.207  20.057 -14.924
   31    H1     G   3           H1         G   3   2.411  19.606 -11.809
   32   1H2     G   3          1H2         G   3   3.579  17.992 -12.626
   33   2H2     G   3          2H2         G   3   3.100  17.145 -14.083
   34   1H5*    C   4          1H5*        C   4  -1.724  13.554 -15.672
   35   2H5*    C   4          2H5*        C   4  -2.525  12.250 -14.789
   36    H4*    C   4           H4*        C   4  -0.249  12.481 -14.002
   37    H3*    C   4           H3*        C   4  -2.274  13.506 -11.983
   38    H2*    C   4           H2*        C   4  -0.433  13.720 -10.482
   39   2HO*    C   4          2HO*        C   4   0.525  11.606 -11.318
   40    H1*    C   4           H1*        C   4   1.357  14.630 -12.416
   41   1H4     C   4          1H4         C   4  -0.868  19.493  -8.938
   42   2H4     C   4          2H4         C   4  -2.340  19.540  -9.877
   43    H5     C   4           H5         C   4  -2.800  18.021 -11.675
   44    H6     C   4           H6         C   4  -1.989  16.037 -12.857
   45   1H5*    C   5          1H5*        C   5  -1.160  12.093  -9.112
   46   2H5*    C   5          2H5*        C   5  -2.229  10.912  -8.375
   47    H4*    C   5           H4*        C   5  -1.655  12.846  -6.953
   48    H3*    C   5           H3*        C   5  -4.103  11.562  -6.938
   49    H2*    C   5           H2*        C   5  -5.137  13.164  -8.436
   50   2HO*    C   5          2HO*        C   5  -5.478  13.911  -5.725
   51    H1*    C   5           H1*        C   5  -3.884  15.377  -6.873
   52   1H4     C   5          1H4         C   5  -5.857  18.856 -11.763
   53   2H4     C   5          2H4         C   5  -5.578  17.564 -12.898
   54    H5     C   5           H5         C   5  -4.785  15.403 -12.244
   55    H6     C   5           H6         C   5  -4.191  13.993 -10.338
   56   1H5*    A   6          1H5*        A   6  -2.150  14.789  -4.529
   57   2H5*    A   6          2H5*        A   6  -0.803  13.659  -4.481
   58    H4*    A   6           H4*        A   6  -0.168  15.551  -3.391
   59    H3*    A   6           H3*        A   6  -0.613  13.345  -1.451
   60    H2*    A   6           H2*        A   6  -0.191  14.829   0.409
   61   2HO*    A   6          2HO*        A   6   1.546  16.069  -0.147
   62    H1*    A   6           H1*        A   6  -1.433  17.048  -0.524
   63    H8     A   6           H8         A   6  -4.033  14.937  -1.807
   64   1H6     A   6          1H6         A   6  -5.965  13.922   4.008
   65   2H6     A   6          2H6         A   6  -6.304  13.638   2.318
   66    H2     A   6           H2         A   6  -2.061  16.021   4.233
   67   1H5*    U   7          1H5*        U   7   3.103  12.728   1.023
   68   2H5*    U   7          2H5*        U   7   2.126  14.057   0.415
   69    H4*    U   7           H4*        U   7   3.959  14.887   1.744
   70    H3*    U   7           H3*        U   7   3.310  16.002  -0.718
   71    H2*    U   7           H2*        U   7   4.992  14.798  -1.884
   72   2HO*    U   7          2HO*        U   7   5.924  17.338  -1.060
   73    H1*    U   7           H1*        U   7   6.903  15.376   0.407
   74    H3     U   7           H3         U   7  10.318  13.381  -1.701
   75    H5     U   7           H5         U   7   7.350  10.439  -1.590
   76    H6     U   7           H6         U   7   5.744  12.153  -0.897
   77   1H5*    A   8          1H5*        A   8   4.276  19.687  -0.865
   78   2H5*    A   8          2H5*        A   8   3.578  20.561   0.506
   79    H4*    A   8           H4*        A   8   2.858  21.671  -1.425
   80    H3*    A   8           H3*        A   8   1.002  20.788   0.367
   81    H2*    A   8           H2*        A   8   0.535  18.800  -0.942
   82   2HO*    A   8          2HO*        A   8  -1.508  19.789  -0.437
   83    H1*    A   8           H1*        A   8   0.369  20.720  -3.264
   84    H8     A   8           H8         A   8   2.455  17.502  -3.141
   85   1H6     A   8          1H6         A   8  -1.269  15.620  -7.727
   86   2H6     A   8          2H6         A   8   0.277  15.381  -6.950
   87    H2     A   8           H2         A   8  -3.087  19.238  -5.889
   88   1H5*    C   9          1H5*        C   9  -2.206  22.200  -0.523
   89   2H5*    C   9          2H5*        C   9  -2.506  23.740   0.291
   90    H4*    C   9           H4*        C   9  -4.103  22.169   1.042
   91    H3*    C   9           H3*        C   9  -2.097  22.839   3.164
   92    H2*    C   9           H2*        C   9  -3.299  21.347   4.639
   93   2HO*    C   9          2HO*        C   9  -5.418  22.039   3.396
   94    H1*    C   9           H1*        C   9  -3.632  19.312   2.889
   95   1H4     C   9          1H4         C   9   2.067  18.242   5.623
   96   2H4     C   9          2H4         C   9   2.810  18.700   4.100
   97    H5     C   9           H5         C   9   1.606  19.825   2.371
   98    H6     C   9           H6         C   9  -0.591  20.555   1.630
   99   1H5*    C  10          1H5*        C  10  -5.585  22.949   5.165
  100   2H5*    C  10          2H5*        C  10  -5.823  24.363   6.190
  101    H4*    C  10           H4*        C  10  -5.892  22.278   7.498
  102    H3*    C  10           H3*        C  10  -3.469  24.020   8.053
  103    H2*    C  10           H2*        C  10  -3.036  22.538   9.894
  104   2HO*    C  10          2HO*        C  10  -5.380  22.221  10.401
  105    H1*    C  10           H1*        C  10  -3.453  20.256   8.393
  106   1H4     C  10          1H4         C  10   2.745  21.089   7.670
  107   2H4     C  10          2H4         C  10   2.448  21.878   6.136
  108    H5     C  10           H5         C  10   0.264  22.549   5.401
  109    H6     C  10           H6         C  10  -2.116  22.531   5.977
  110   1H5*    U  11          1H5*        U  11  -4.778  24.284  11.963
  111   2H5*    U  11          2H5*        U  11  -4.412  25.909  12.558
  112    H4*    U  11           H4*        U  11  -3.094  24.012  13.581
  113    H3*    U  11           H3*        U  11  -1.596  26.216  12.175
  114    H2*    U  11           H2*        U  11   0.372  25.311  13.210
  115   2HO*    U  11          2HO*        U  11  -0.884  24.774  15.265
  116    H1*    U  11           H1*        U  11  -0.334  22.707  12.684
  117    H3     U  11           H3         U  11   3.196  23.676   9.926
  118    H5     U  11           H5         U  11  -0.091  25.418   8.002
  119    H6     U  11           H6         U  11  -1.456  24.890   9.973
  120   1H5*    C  12          1H5*        C  12   0.133  27.095  16.362
  121   2H5*    C  12          2H5*        C  12   1.070  28.501  15.855
  122    H4*    C  12           H4*        C  12   1.703  25.556  15.705
  123    H3*    C  12           H3*        C  12   2.702  27.618  17.198
  124    H2*    C  12           H2*        C  12   3.335  28.928  15.302
  125   2HO*    C  12          2HO*        C  12   5.313  27.982  16.773
  126    H1*    C  12           H1*        C  12   4.606  26.431  14.132
  127   1H4     C  12          1H4         C  12   5.531  30.672   9.469
  128   2H4     C  12          2H4         C  12   3.846  31.128   9.470
  129    H5     C  12           H5         C  12   2.240  30.210  11.001
  130    H6     C  12           H6         C  12   1.926  28.643  12.861
  131   1H5*    U  13          1H5*        U  13   3.964  23.121  17.991
  132   2H5*    U  13          2H5*        U  13   4.751  23.090  19.571
  133    H4*    U  13           H4*        U  13   5.911  21.376  18.599
  134    H3*    U  13           H3*        U  13   7.555  23.644  18.607
  135    H2*    U  13           H2*        U  13   6.933  24.222  16.358
  136   2HO*    U  13          2HO*        U  13   9.329  22.686  16.360
  137    H1*    U  13           H1*        U  13   7.298  21.260  15.710
  138    H3     U  13           H3         U  13   6.968  22.236  11.290
  139    H5     U  13           H5         U  13   3.875  24.499  12.960
  140    H6     U  13           H6         U  13   4.586  23.739  15.185
  141   1H5*    U  14          1H5*        U  14  10.564  18.997  19.067
  142   2H5*    U  14          2H5*        U  14  11.979  19.906  18.533
  143    H4*    U  14           H4*        U  14   9.340  19.567  17.068
  144    H3*    U  14           H3*        U  14  11.842  18.133  16.980
  145    H2*    U  14           H2*        U  14  12.893  19.831  15.776
  146   2HO*    U  14          2HO*        U  14  11.554  18.127  13.942
  147    H1*    U  14           H1*        U  14  10.213  20.379  14.417
  148    H3     U  14           H3         U  14  12.424  23.136  11.524
  149    H5     U  14           H5         U  14  13.799  24.393  15.270
  150    H6     U  14           H6         U  14  12.529  22.556  16.297
  151   1H5*    G  15          1H5*        G  15   7.141  15.421  15.404
  152   2H5*    G  15          2H5*        G  15   7.586  16.939  14.609
  153    H4*    G  15           H4*        G  15   5.652  16.951  16.939
  154    H3*    G  15           H3*        G  15   5.082  16.242  14.052
  155    H2*    G  15           H2*        G  15   2.871  17.179  14.426
  156   2HO*    G  15          2HO*        G  15   2.832  16.478  16.775
  157    H1*    G  15           H1*        G  15   3.878  19.452  15.472
  158    H8     G  15           H8         G  15   6.672  18.697  13.132
  159    H1     G  15           H1         G  15   1.328  20.525  10.062
  160   1H2     G  15          1H2         G  15  -0.387  20.275  11.350
  161   2H2     G  15          2H2         G  15  -0.221  19.906  13.056
  162   1H5*    G  16          1H5*        G  16   1.543  14.986  15.853
  163   2H5*    G  16          2H5*        G  16   1.129  13.343  15.343
  164    H4*    G  16           H4*        G  16  -0.732  14.867  14.968
  165    H3*    G  16           H3*        G  16   0.562  13.894  12.404
  166    H2*    G  16           H2*        G  16  -1.332  14.931  11.291
  167   2HO*    G  16          2HO*        G  16  -2.854  14.366  13.125
  168    H1*    G  16           H1*        G  16  -1.119  17.251  12.669
  169    H8     G  16           H8         G  16   2.491  16.278  12.448
  170    H1     G  16           H1         G  16   0.079  17.778   6.706
  171   1H2     G  16          1H2         G  16  -2.066  18.107   6.834
  172   2H2     G  16          2H2         G  16  -2.954  17.756   8.305
  173   1H5*    G  17          1H5*        G  17  -3.305  12.920  11.457
  174   2H5*    G  17          2H5*        G  17  -3.394  11.326  10.697
  175    H4*    G  17           H4*        G  17  -4.226  13.122   9.234
  176    H3*    G  17           H3*        G  17  -1.713  11.756   8.238
  177    H2*    G  17           H2*        G  17  -2.060  13.069   6.197
  178   2HO*    G  17          2HO*        G  17  -4.478  12.960   6.431
  179    H1*    G  17           H1*        G  17  -2.298  15.381   7.469
  180    H8     G  17           H8         G  17  -0.080  13.713   9.945
  181    H1     G  17           H1         G  17   2.962  15.618   4.617
  182   1H2     G  17          1H2         G  17   1.523  16.065   3.051
  183   2H2     G  17          2H2         G  17  -0.195  15.772   3.262
  184   1H5*    C  18          1H5*        C  18  -3.660  11.366   4.843
  185   2H5*    C  18          2H5*        C  18  -3.553   9.745   4.138
  186    H4*    C  18           H4*        C  18  -2.556  11.360   2.660
  187    H3*    C  18           H3*        C  18  -0.426   9.678   3.974
  188    H2*    C  18           H2*        C  18   1.159  10.758   2.399
  189   2HO*    C  18          2HO*        C  18   0.104  11.226   0.509
  190    H1*    C  18           H1*        C  18   0.342  13.160   3.061
  191   1H4     C  18          1H4         C  18   4.480  11.696   7.647
  192   2H4     C  18          2H4         C  18   3.146  11.325   8.710
  193    H5     C  18           H5         C  18   0.855  11.318   7.996
  194    H6     C  18           H6         C  18  -0.609  11.563   6.067
  195   1H5*    C  19          1H5*        C  19   0.711   9.422   0.172
  196   2H5*    C  19          2H5*        C  19   1.069   7.774  -0.342
  197    H4*    C  19           H4*        C  19   2.925   9.240  -0.828
  198    H3*    C  19           H3*        C  19   3.514   7.298   1.415
  199    H2*    C  19           H2*        C  19   5.822   7.950   1.124
  200   2HO*    C  19          2HO*        C  19   6.205   8.262  -1.001
  201    H1*    C  19           H1*        C  19   5.259  10.621   1.079
  202   1H4     C  19          1H4         C  19   6.155   9.012   7.196
  203   2H4     C  19          2H4         C  19   4.455   8.640   7.367
  204    H5     C  19           H5         C  19   2.914   8.634   5.532
  205    H6     C  19           H6         C  19   2.673   9.110   3.143
  206   1H5*    U  20          1H5*        U  20   6.523   6.320  -1.286
  207   2H5*    U  20          2H5*        U  20   6.635   4.569  -1.478
  208    H4*    U  20           H4*        U  20   8.786   5.519  -0.858
  209    H3*    U  20           H3*        U  20   7.582   3.894   1.397
  210    H2*    U  20           H2*        U  20   9.814   4.036   2.359
  211   2HO*    U  20          2HO*        U  20  10.913   4.012   0.179
  212    H1*    U  20           H1*        U  20   9.942   6.715   1.952
  213    H3     U  20           H3         U  20   9.008   5.962   6.399
  214    H5     U  20           H5         U  20   5.264   5.926   4.535
  215    H6     U  20           H6         U  20   6.404   5.996   2.361
  216   1H5*    G  21          1H5*        G  21  11.260   2.115   0.455
  217   2H5*    G  21          2H5*        G  21  11.221   0.357   0.548
  218    H4*    G  21           H4*        G  21  13.057   1.283   1.853
  219    H3*    G  21           H3*        G  21  10.896   0.070   3.601
  220    H2*    G  21           H2*        G  21  12.528   0.341   5.403
  221   2HO*    G  21          2HO*        G  21  14.418   0.005   3.798
  222    H1*    G  21           H1*        G  21  13.010   2.923   4.749
  223    H8     G  21           H8         G  21   9.380   2.429   3.757
  224    H1     G  21           H1         G  21  10.257   2.838  10.117
  225   1H2     G  21          1H2         G  21  12.338   2.526  10.598
  226   2H2     G  21          2H2         G  21  13.572   2.421   9.358
  227   1H5*    G  22          1H5*        G  22  14.389  -1.674   4.802
  228   2H5*    G  22          2H5*        G  22  14.306  -3.427   4.937
  229    H4*    G  22           H4*        G  22  15.254  -2.435   6.944
  230    H3*    G  22           H3*        G  22  12.526  -3.695   7.373
  231    H2*    G  22           H2*        G  22  12.826  -3.258   9.701
  232   2HO*    G  22          2HO*        G  22  15.139  -3.820   9.724
  233    H1*    G  22           H1*        G  22  13.846  -0.735   9.378
  234    H8     G  22           H8         G  22  11.174  -0.949   6.728
  235    H1     G  22           H1         G  22   8.806  -0.299  12.676
  236   1H2     G  22          1H2         G  22  10.318  -0.783  14.135
  237   2H2     G  22          2H2         G  22  11.976  -1.129  13.680
  238   1H5*    U  23          1H5*        U  23  12.434  -7.728  10.055
  239   2H5*    U  23          2H5*        U  23  11.417  -6.403   9.444
  240    H4*    U  23           H4*        U  23  12.859  -6.384  12.110
  241    H3*    U  23           H3*        U  23   9.964  -6.724  11.251
  242    H2*    U  23           H2*        U  23   9.372  -6.022  13.442
  243   2HO*    U  23          2HO*        U  23  11.305  -7.019  14.513
  244    H1*    U  23           H1*        U  23  11.032  -3.854  13.262
  245    H3     U  23           H3         U  23   6.499  -2.896  12.528
  246    H5     U  23           H5         U  23   8.195  -3.391   8.740
  247    H6     U  23           H6         U  23  10.274  -4.137   9.819
  248   1H5*    U  24          1H5*        U  24   9.555  -8.588  14.313
  249   2H5*    U  24          2H5*        U  24   8.930 -10.239  14.296
  250    H4*    U  24           H4*        U  24   7.491  -8.875  15.640
  251    H3*    U  24           H3*        U  24   6.246  -9.400  12.947
  252    H2*    U  24           H2*        U  24   4.210  -8.628  13.845
  253   2HO*    U  24          2HO*        U  24   4.477  -9.570  16.024
  254    H1*    U  24           H1*        U  24   5.455  -6.468  15.060
  255    H3     U  24           H3         U  24   2.945  -5.084  11.414
  256    H5     U  24           H5         U  24   6.599  -6.324   9.776
  257    H6     U  24           H6         U  24   7.299  -7.062  12.012
  258   1H5*    A  25          1H5*        A  25   4.950 -13.486  11.589
  259   2H5*    A  25          2H5*        A  25   6.676 -13.730  11.374
  260    H4*    A  25           H4*        A  25   5.744 -13.330   9.220
  261    H3*    A  25           H3*        A  25   7.818 -11.636  10.016
  262    H2*    A  25           H2*        A  25   6.219  -9.880  10.634
  263   2HO*    A  25          2HO*        A  25   7.786  -8.942   9.268
  264    H1*    A  25           H1*        A  25   5.000 -10.759   7.966
  265    H8     A  25           H8         A  25   3.428  -9.627  11.384
  266   1H6     A  25          1H6         A  25   0.505  -5.392   7.862
  267   2H6     A  25          2H6         A  25   0.464  -6.219   9.407
  268    H2     A  25           H2         A  25   3.523  -7.497   5.341
  269   1H5*    G  26          1H5*        G  26   7.903 -14.567   4.863
  270   2H5*    G  26          2H5*        G  26   7.846 -12.828   4.659
  271    H4*    G  26           H4*        G  26   5.847 -13.564   6.622
  272    H3*    G  26           H3*        G  26   6.161 -15.800   4.963
  273    H2*    G  26           H2*        G  26   5.953 -14.343   3.099
  274   2HO*    G  26          2HO*        G  26   3.515 -15.776   3.516
  275    H1*    G  26           H1*        G  26   3.451 -13.379   4.536
  276    H8     G  26           H8         G  26   5.499 -13.141   1.345
  277    H1     G  26           H1         G  26   0.911  -8.697   1.880
  278   1H2     G  26          1H2         G  26   0.255  -8.579   3.929
  279   2H2     G  26          2H2         G  26   0.739  -9.752   5.143
  280   1H5*    U  27          1H5*        U  27   4.820 -16.323   8.188
  281   2H5*    U  27          2H5*        U  27   4.102 -17.915   8.500
  282    H4*    U  27           H4*        U  27   3.816 -16.897  10.552
  283    H3*    U  27           H3*        U  27   1.267 -16.175   9.044
  284    H2*    U  27           H2*        U  27   0.606 -14.872  10.952
  285   2HO*    U  27          2HO*        U  27   1.797 -16.531  12.431
  286    H1*    U  27           H1*        U  27   2.940 -13.582  11.283
  287    H3     U  27           H3         U  27   0.129 -10.748   8.975
  288    H5     U  27           H5         U  27   2.769 -12.377   6.196
  289    H6     U  27           H6         U  27   3.368 -14.093   7.834
  290   1H5*    A  28          1H5*        A  28  -0.335 -16.350  12.725
  291   2H5*    A  28          2H5*        A  28  -1.584 -17.591  12.764
  292    H4*    A  28           H4*        A  28  -2.521 -15.495  13.527
  293    H3*    A  28           H3*        A  28  -3.504 -16.271  10.752
  294    H2*    A  28           H2*        A  28  -4.970 -14.346  10.911
  295   2HO*    A  28          2HO*        A  28  -5.268 -14.704  13.330
  296    H1*    A  28           H1*        A  28  -3.038 -12.678  11.845
  297    H8     A  28           H8         A  28  -0.926 -14.600   9.495
  298   1H6     A  28          1H6         A  28  -3.354 -11.030   5.006
  299   2H6     A  28          2H6         A  28  -2.070 -12.163   5.391
  300    H2     A  28           H2         A  28  -6.195 -11.092   8.407
  301   1H5*    C  29          1H5*        C  29  -7.059 -15.550  12.053
  302   2H5*    C  29          2H5*        C  29  -8.247 -16.809  11.692
  303    H4*    C  29           H4*        C  29  -8.810 -14.774  10.497
  304    H3*    C  29           H3*        C  29  -7.764 -16.940   8.662
  305    H2*    C  29           H2*        C  29  -8.349 -15.439   6.831
  306   2HO*    C  29          2HO*        C  29 -10.325 -14.613   8.005
  307    H1*    C  29           H1*        C  29  -7.219 -13.277   7.915
  308   1H4     C  29          1H4         C  29  -2.457 -16.037   4.720
  309   2H4     C  29          2H4         C  29  -1.926 -16.811   6.194
  310    H5     C  29           H5         C  29  -3.190 -16.785   8.222
  311    H6     C  29           H6         C  29  -5.215 -15.925   9.282
  312   1H5*    C  30          1H5*        C  30 -11.418 -16.128   6.869
  313   2H5*    C  30          2H5*        C  30 -12.246 -17.605   6.356
  314    H4*    C  30           H4*        C  30 -11.781 -16.121   4.459
  315    H3*    C  30           H3*        C  30 -10.093 -18.637   4.412
  316    H2*    C  30           H2*        C  30  -9.485 -17.934   2.167
  317   2HO*    C  30          2HO*        C  30 -11.746 -16.923   1.854
  318    H1*    C  30           H1*        C  30  -9.022 -15.351   2.953
  319   1H4     C  30          1H4         C  30  -3.640 -18.780   3.326
  320   2H4     C  30          2H4         C  30  -4.008 -19.231   4.976
  321    H5     C  30           H5         C  30  -6.048 -18.611   6.085
  322    H6     C  30           H6         C  30  -8.195 -17.468   5.792
  323   1H5*    U  31          1H5*        U  31 -12.196 -18.398   0.659
  324   2H5*    U  31          2H5*        U  31 -13.095 -19.880   0.336
  325    H4*    U  31           H4*        U  31 -12.023 -19.098  -1.681
  326    H3*    U  31           H3*        U  31 -10.722 -21.611  -0.614
  327    H2*    U  31           H2*        U  31  -9.505 -21.676  -2.676
  328   2HO*    U  31          2HO*        U  31 -11.408 -20.835  -3.954
  329    H1*    U  31           H1*        U  31  -8.882 -19.010  -2.649
  330    H3     U  31           H3         U  31  -5.010 -21.265  -1.538
  331    H5     U  31           H5         U  31  -6.998 -20.605   2.095
  332    H6     U  31           H6         U  31  -8.988 -19.932   0.831
  333   1H5*    C  32          1H5*        C  32 -11.833 -23.043  -4.136
  334   2H5*    C  32          2H5*        C  32 -12.537 -24.664  -4.088
  335    H4*    C  32           H4*        C  32 -10.481 -24.686  -5.382
  336    H3*    C  32           H3*        C  32 -10.100 -26.041  -2.692
  337    H2*    C  32           H2*        C  32  -7.895 -26.619  -3.487
  338   2HO*    C  32          2HO*        C  32  -8.826 -26.891  -5.799
  339    H1*    C  32           H1*        C  32  -7.397 -24.147  -4.596
  340   1H4     C  32          1H4         C  32  -4.964 -24.382   1.299
  341   2H4     C  32          2H4         C  32  -6.523 -24.011   2.002
  342    H5     C  32           H5         C  32  -8.517 -23.721   0.699
  343    H6     C  32           H6         C  32  -9.435 -23.809  -1.571
  344   1H5*    U  33          1H5*        U  33  -8.180 -28.672  -4.696
  345   2H5*    U  33          2H5*        U  33  -8.851 -30.300  -4.577
  346    H4*    U  33           H4*        U  33  -6.525 -30.414  -3.928
  347    H3*    U  33           H3*        U  33  -8.373 -30.498  -1.522
  348    H2*    U  33           H2*        U  33  -6.566 -30.816  -0.176
  349   2HO*    U  33          2HO*        U  33  -4.591 -31.350  -2.191
  350    H1*    U  33           H1*        U  33  -4.787 -29.244  -1.715
  351    H3     U  33           H3         U  33  -4.797 -27.493   2.508
  352    H5     U  33           H5         U  33  -8.726 -26.871   1.215
  353    H6     U  33           H6         U  33  -8.160 -27.999  -0.893
  354   1H5*    U  34          1H5*        U  34  -8.417 -36.100  -0.709
  355   2H5*    U  34          2H5*        U  34  -7.707 -35.107   0.568
  356    H4*    U  34           H4*        U  34  -6.520 -37.224   0.315
  357    H3*    U  34           H3*        U  34  -5.170 -34.856   0.620
  358    H2*    U  34           H2*        U  34  -4.875 -34.506  -1.737
  359   2HO*    U  34          2HO*        U  34  -2.597 -35.896  -0.715
  360    H1*    U  34           H1*        U  34  -4.105 -37.446  -1.922
  361    H3     U  34           H3         U  34  -3.117 -37.019  -6.308
  362    H5     U  34           H5         U  34  -6.525 -34.622  -5.934
  363    H6     U  34           H6         U  34  -6.568 -35.147  -3.536
  364   1H5*    C  35          1H5*        C  35  -1.704 -34.982   1.343
  365   2H5*    C  35          2H5*        C  35  -1.334 -35.835   2.842
  366    H4*    C  35           H4*        C  35  -0.353 -33.612   2.800
  367    H3*    C  35           H3*        C  35  -1.546 -34.626   5.039
  368    H2*    C  35           H2*        C  35  -3.694 -33.691   4.539
  369   2HO*    C  35          2HO*        C  35  -2.256 -31.918   6.244
  370    H1*    C  35           H1*        C  35  -2.377 -31.040   3.860
  371   1H4     C  35          1H4         C  35  -8.573 -30.268   2.519
  372   2H4     C  35          2H4         C  35  -8.530 -31.600   1.377
  373    H5     C  35           H5         C  35  -6.617 -32.993   1.096
  374    H6     C  35           H6         C  35  -4.252 -33.256   1.633
  375   1H5*    G  36          1H5*        G  36   2.895 -31.307   4.959
  376   2H5*    G  36          2H5*        G  36   1.346 -31.400   4.103
  377    H4*    G  36           H4*        G  36   3.911 -32.777   3.225
  378    H3*    G  36           H3*        G  36   2.392 -30.364   2.163
  379    H2*    G  36           H2*        G  36   3.210 -30.946   0.015
  380   2HO*    G  36          2HO*        G  36   5.443 -31.408   1.103
  381    H1*    G  36           H1*        G  36   3.279 -33.733   0.570
  382    H8     G  36           H8         G  36   1.984 -34.248  -1.658
  383    H1     G  36           H1         G  36  -2.704 -30.064  -0.242
  384   1H2     G  36          1H2         G  36  -2.281 -29.040   1.584
  385   2H2     G  36          2H2         G  36  -0.810 -29.305   2.492
  386   1H5*    G  37          1H5*        G  37   4.943 -29.352   0.146
  387   2H5*    G  37          2H5*        G  37   5.382 -27.646   0.065
  388    H4*    G  37           H4*        G  37   4.085 -28.640  -1.911
  389    H3*    G  37           H3*        G  37   2.941 -26.193  -0.512
  390    H2*    G  37           H2*        G  37   1.408 -26.179  -2.443
  391   2HO*    G  37          2HO*        G  37   3.192 -27.169  -3.904
  392    H1*    G  37           H1*        G  37   0.798 -28.785  -2.179
  393    H8     G  37           H8         G  37   1.536 -27.415   1.328
  394    H1     G  37           H1         G  37  -4.055 -25.416  -1.124
  395   1H2     G  37          1H2         G  37  -4.205 -26.009  -3.193
  396   2H2     G  37          2H2         G  37  -3.034 -27.073  -3.944
  397   1H5*    U  38          1H5*        U  38   2.435 -25.305  -4.378
  398   2H5*    U  38          2H5*        U  38   3.105 -23.777  -4.921
  399    H4*    U  38           H4*        U  38   0.789 -24.010  -5.598
  400    H3*    U  38           H3*        U  38   1.148 -21.898  -3.494
  401    H2*    U  38           H2*        U  38  -1.080 -21.177  -4.046
  402   2HO*    U  38          2HO*        U  38  -1.025 -21.608  -6.353
  403    H1*    U  38           H1*        U  38  -2.073 -23.707  -3.877
  404    H3     U  38           H3         U  38  -3.220 -21.818   0.149
  405    H5     U  38           H5         U  38   0.684 -23.200   0.717
  406    H6     U  38           H6         U  38   0.810 -23.675  -1.681
  407   1H5*    G  39          1H5*        G  39   0.096 -19.701  -6.822
  408   2H5*    G  39          2H5*        G  39   0.924 -18.148  -6.853
  409    H4*    G  39           H4*        G  39  -1.453 -17.855  -6.957
  410    H3*    G  39           H3*        G  39  -0.453 -16.971  -4.244
  411    H2*    G  39           H2*        G  39  -2.728 -16.100  -3.982
  412   2HO*    G  39          2HO*        G  39  -2.929 -15.629  -6.403
  413    H1*    G  39           H1*        G  39  -3.835 -18.442  -4.730
  414    H8     G  39           H8         G  39  -0.476 -19.278  -3.081
  415    H1     G  39           H1         G  39  -5.122 -17.733   1.078
  416   1H2     G  39          1H2         G  39  -6.769 -16.816   0.025
  417   2H2     G  39          2H2         G  39  -6.846 -16.771  -1.723
  418   1H5*    G  40          1H5*        G  40  -2.598 -13.797  -5.759
  419   2H5*    G  40          2H5*        G  40  -1.877 -12.219  -5.397
  420    H4*    G  40           H4*        G  40  -4.224 -12.295  -4.757
  421    H3*    G  40           H3*        G  40  -2.215 -11.990  -2.499
  422    H2*    G  40           H2*        G  40  -4.160 -11.705  -1.055
  423   2HO*    G  40          2HO*        G  40  -5.365 -10.532  -2.900
  424    H1*    G  40           H1*        G  40  -5.549 -13.780  -2.068
  425    H8     G  40           H8         G  40  -2.003 -15.032  -2.258
  426    H1     G  40           H1         G  40  -4.245 -14.757   3.758
  427   1H2     G  40          1H2         G  40  -6.061 -13.593   3.827
  428   2H2     G  40          2H2         G  40  -6.768 -12.890   2.387
  429   1H5*    G  41          1H5*        G  41  -4.620  -9.496  -0.998
  430   2H5*    G  41          2H5*        G  41  -3.884  -7.937  -0.626
  431    H4*    G  41           H4*        G  41  -4.623  -8.906   1.446
  432    H3*    G  41           H3*        G  41  -1.618  -9.150   1.134
  433    H2*    G  41           H2*        G  41  -1.624  -9.892   3.461
  434   2HO*    G  41          2HO*        G  41  -3.437  -8.633   4.249
  435    H1*    G  41           H1*        G  41  -3.498 -11.753   2.993
  436    H8     G  41           H8         G  41  -1.803 -11.438  -0.381
  437    H1     G  41           H1         G  41   1.490 -15.006   3.821
  438   1H2     G  41          1H2         G  41   0.690 -14.794   5.794
  439   2H2     G  41          2H2         G  41  -0.676 -13.757   6.165
  440   1H5*    A  42          1H5*        A  42  -0.685  -5.124   4.633
  441   2H5*    A  42          2H5*        A  42  -0.428  -6.451   5.774
  442    H4*    A  42           H4*        A  42  -3.083  -5.629   4.529
  443    H3*    A  42           H3*        A  42  -1.970  -5.697   7.347
  444    H2*    A  42           H2*        A  42  -4.215  -6.100   8.147
  445   2HO*    A  42          2HO*        A  42  -5.202  -4.750   6.320
  446    H1*    A  42           H1*        A  42  -4.656  -8.134   6.463
  447    H8     A  42           H8         A  42  -1.110  -8.844   6.578
  448   1H6     A  42          1H6         A  42  -1.729 -10.699  12.488
  449   2H6     A  42          2H6         A  42  -0.735 -10.818  11.054
  450    H2     A  42           H2         A  42  -5.393  -8.466  11.375
  451   1H5*    A  43          1H5*        A  43  -4.777  -3.244   7.700
  452   2H5*    A  43          2H5*        A  43  -4.822  -1.645   8.402
  453    H4*    A  43           H4*        A  43  -6.156  -3.121   9.765
  454    H3*    A  43           H3*        A  43  -3.498  -2.521  11.127
  455    H2*    A  43           H2*        A  43  -4.223  -3.925  12.948
  456   2HO*    A  43          2HO*        A  43  -6.557  -3.103  12.615
  457    H1*    A  43           H1*        A  43  -5.249  -5.922  11.340
  458    H8     A  43           H8         A  43  -2.240  -5.072   9.390
  459   1H6     A  43          1H6         A  43   1.031  -8.487  13.400
  460   2H6     A  43          2H6         A  43   0.998  -7.831  11.775
  461    H2     A  43           H2         A  43  -2.852  -7.492  15.309
  462   1H5*    U  44          1H5*        U  44  -5.582  -1.917  14.289
  463   2H5*    U  44          2H5*        U  44  -5.225  -0.379  15.091
  464    H4*    U  44           H4*        U  44  -4.520  -2.197  16.524
  465    H3*    U  44           H3*        U  44  -2.176  -0.793  15.206
  466    H2*    U  44           H2*        U  44  -0.775  -2.107  16.647
  467   2HO*    U  44          2HO*        U  44  -2.449  -1.973  18.469
  468    H1*    U  44           H1*        U  44  -2.135  -4.436  16.213
  469    H3     U  44           H3         U  44   1.717  -4.944  13.768
  470    H5     U  44           H5         U  44  -0.753  -2.617  11.319
  471    H6     U  44           H6         U  44  -2.290  -2.357  13.208
  472   1H5*    A  45          1H5*        A  45  -1.248  -0.524  19.236
  473   2H5*    A  45          2H5*        A  45  -0.497   1.024  19.643
  474    H4*    A  45           H4*        A  45   0.979  -0.850  20.165
  475    H3*    A  45           H3*        A  45   1.989   0.803  17.821
  476    H2*    A  45           H2*        A  45   4.021  -0.490  18.065
  477   2HO*    A  45          2HO*        A  45   3.724  -0.647  20.517
  478    H1*    A  45           H1*        A  45   2.697  -2.862  18.168
  479    H8     A  45           H8         A  45   0.652  -0.522  15.936
  480   1H6     A  45          1H6         A  45   4.456  -2.240  11.320
  481   2H6     A  45          2H6         A  45   2.942  -1.450  11.712
  482    H2     A  45           H2         A  45   6.123  -3.790  15.118
  483   1H5*    C  46          1H5*        C  46   5.026   0.795  20.640
  484   2H5*    C  46          2H5*        C  46   5.767   2.384  20.834
  485    H4*    C  46           H4*        C  46   7.442   0.695  20.336
  486    H3*    C  46           H3*        C  46   7.018   2.630  18.027
  487    H2*    C  46           H2*        C  46   9.054   1.664  17.156
  488   2HO*    C  46          2HO*        C  46   9.970   1.355  19.432
  489    H1*    C  46           H1*        C  46   8.233  -0.900  17.663
  490   1H4     C  46          1H4         C  46   6.329   0.493  11.739
  491   2H4     C  46          2H4         C  46   4.801   1.089  12.350
  492    H5     C  46           H5         C  46   4.317   1.318  14.690
  493    H6     C  46           H6         C  46   5.216   0.999  16.948
  494   1H5*    C  47          1H5*        C  47  11.023   2.969  19.023
  495   2H5*    C  47          2H5*        C  47  11.578   4.645  19.010
  496    H4*    C  47           H4*        C  47  12.954   3.252  17.565
  497    H3*    C  47           H3*        C  47  11.213   5.177  15.999
  498    H2*    C  47           H2*        C  47  12.656   4.580  14.132
  499   2HO*    C  47          2HO*        C  47  14.619   4.326  15.578
  500    H1*    C  47           H1*        C  47  12.467   1.907  14.687
  501   1H4     C  47          1H4         C  47   7.715   3.212  10.648
  502   2H4     C  47          2H4         C  47   6.661   3.627  11.980
  503    H5     C  47           H5         C  47   7.397   3.722  14.264
  504    H6     C  47           H6         C  47   9.324   3.414  15.748
  505   1H5*    A  48          1H5*        A  48  15.223   6.120  15.006
  506   2H5*    A  48          2H5*        A  48  15.466   7.864  14.891
  507    H4*    A  48           H4*        A  48  16.252   6.728  12.889
  508    H3*    A  48           H3*        A  48  13.764   8.379  12.379
  509    H2*    A  48           H2*        A  48  14.273   7.990  10.025
  510   2HO*    A  48          2HO*        A  48  16.707   7.950  10.457
  511    H1*    A  48           H1*        A  48  14.560   5.324  10.399
  512    H8     A  48           H8         A  48  12.005   6.327  13.006
  513   1H6     A  48          1H6         A  48   7.777   6.133   8.452
  514   2H6     A  48          2H6         A  48   8.021   6.243  10.181
  515    H2     A  48           H2         A  48  11.802   5.938   6.585
  516   1H5*    G  49          1H5*        G  49  16.634   9.758   9.726
  517   2H5*    G  49          2H5*        G  49  16.657  11.509   9.548
  518    H4*    G  49           H4*        G  49  16.474  10.394   7.389
  519    H3*    G  49           H3*        G  49  13.938  11.883   8.152
  520    H2*    G  49           H2*        G  49  13.271  11.428   5.840
  521   2HO*    G  49          2HO*        G  49  15.673  11.521   5.112
  522    H1*    G  49           H1*        G  49  13.903   8.808   6.012
  523    H8     G  49           H8         G  49  12.819   9.606   9.541
  524    H1     G  49           H1         G  49   7.920   9.361   5.385
  525   1H2     G  49          1H2         G  49   8.657   9.565   3.366
  526   2H2     G  49          2H2         G  49  10.368   9.502   2.992
  527   1H5*    G  50          1H5*        G  50  14.712  13.102   4.363
  528   2H5*    G  50          2H5*        G  50  14.690  14.849   4.148
  529    H4*    G  50           H4*        G  50  13.273  13.716   2.499
  530    H3*    G  50           H3*        G  50  11.730  15.380   4.519
  531    H2*    G  50           H2*        G  50   9.790  14.944   3.095
  532   2HO*    G  50          2HO*        G  50  11.281  14.933   1.085
  533    H1*    G  50           H1*        G  50  10.332  12.285   2.853
  534    H8     G  50           H8         G  50  11.417  12.840   6.389
  535    H1     G  50           H1         G  50   5.019  12.782   5.658
  536   1H2     G  50          1H2         G  50   4.521  12.883   3.577
  537   2H2     G  50          2H2         G  50   5.725  13.190   2.344
  538   1H5*    U  51          1H5*        U  51  10.299  16.608   0.898
  539   2H5*    U  51          2H5*        U  51  10.623  18.304   0.541
  540    H4*    U  51           H4*        U  51   8.311  17.762   0.030
  541    H3*    U  51           H3*        U  51   9.104  19.926   1.578
  542    H2*    U  51           H2*        U  51   8.527  19.016   3.604
  543   2HO*    U  51          2HO*        U  51   6.584  20.697   2.738
  544    H1*    U  51           H1*        U  51   6.034  17.744   2.459
  545    H3     U  51           H3         U  51   4.939  16.078   6.448
  546    H5     U  51           H5         U  51   9.108  16.333   6.721
  547    H6     U  51           H6         U  51   9.176  16.930   4.341
  548   1H5*    G  52          1H5*        G  52   7.819  22.269  -2.225
  549   2H5*    G  52          2H5*        G  52   6.175  22.477  -2.806
  550    H4*    G  52           H4*        G  52   7.575  19.791  -2.472
  551    H3*    G  52           H3*        G  52   6.757  21.490  -4.860
  552    H2*    G  52           H2*        G  52   6.693  19.427  -6.113
  553   2HO*    G  52          2HO*        G  52   8.594  18.514  -4.844
  554    H1*    G  52           H1*        G  52   5.322  18.114  -4.133
  555    H8     G  52           H8         G  52   4.008  21.688  -4.178
  556    H1     G  52           H1         G  52   1.461  17.856  -8.671
  557   1H2     G  52          1H2         G  52   2.764  16.173  -9.031
  558   2H2     G  52          2H2         G  52   4.171  15.855  -8.035
  559   1H5*    C  53          1H5*        C  53   9.609  19.028  -6.652
  560   2H5*    C  53          2H5*        C  53  10.620  19.938  -7.776
  561    H4*    C  53           H4*        C  53   9.557  18.054  -8.878
  562    H3*    C  53           H3*        C  53   8.386  20.689  -9.828
  563    H2*    C  53           H2*        C  53   7.361  19.333 -11.557
  564   2HO*    C  53          2HO*        C  53   9.300  17.809 -11.621
  565    H1*    C  53           H1*        C  53   6.508  17.437  -9.784
  566   1H4     C  53          1H4         C  53   1.749  21.634 -10.045
  567   2H4     C  53          2H4         C  53   2.479  22.573  -8.762
  568    H5     C  53           H5         C  53   4.703  22.183  -7.949
  569    H6     C  53           H6         C  53   6.606  20.644  -8.046
  570   1H5*    C  54          1H5*        C  54   9.649  18.818 -13.338
  571   2H5*    C  54          2H5*        C  54  10.425  19.955 -14.444
  572    H4*    C  54           H4*        C  54   8.595  18.784 -15.534
  573    H3*    C  54           H3*        C  54   7.954  21.718 -15.063
  574    H2*    C  54           H2*        C  54   6.089  21.309 -16.557
  575   2HO*    C  54          2HO*        C  54   7.406  19.676 -17.862
  576    H1*    C  54           H1*        C  54   5.372  19.003 -15.277
  577   1H4     C  54          1H4         C  54   2.165  23.653 -12.348
  578   2H4     C  54          2H4         C  54   3.483  23.881 -11.224
  579    H5     C  54           H5         C  54   5.603  22.779 -11.437
  580    H6     C  54           H6         C  54   6.872  21.152 -12.755
  581   1H5*    C  55          1H5*        C  55   7.427  21.225 -19.182
  582   2H5*    C  55          2H5*        C  55   8.161  22.561 -20.075
  583    H4*    C  55           H4*        C  55   5.818  22.301 -20.688
  584    H3*    C  55           H3*        C  55   6.393  24.813 -19.090
  585    H2*    C  55           H2*        C  55   4.158  25.480 -19.605
  586   2HO*    C  55          2HO*        C  55   4.275  24.605 -21.867
  587    H1*    C  55           H1*        C  55   3.068  22.968 -19.191
  588   1H4     C  55          1H4         C  55   2.370  26.438 -13.874
  589   2H4     C  55          2H4         C  55   3.986  26.021 -13.352
  590    H5     C  55           H5         C  55   5.500  24.712 -14.673
  591    H6     C  55           H6         C  55   5.777  23.544 -16.809
  592   1H    MET 104          1H        MET 104  10.367 -16.047   2.764
  593    HA   MET 104           HA       MET 104  11.202 -13.248   2.235
  594   1HB   MET 104          1HB       MET 104  13.038 -14.473   3.534
  595   2HB   MET 104          2HB       MET 104  13.201 -15.553   2.158
  596   1HG   MET 104          1HG       MET 104  14.624 -14.115   1.252
  597   2HG   MET 104          2HG       MET 104  13.337 -12.933   1.059
  598   1HE   MET 104          1HE       MET 104  13.287 -10.601   2.465
  599   2HE   MET 104          2HE       MET 104  12.525 -11.734   3.613
  600   3HE   MET 104          3HE       MET 104  13.765 -10.598   4.170
  601    H    TYR 105           H        TYR 105  10.795 -12.765   0.172
  602    HA   TYR 105           HA       TYR 105  10.336 -15.012  -1.763
  603   1HB   TYR 105          1HB       TYR 105   9.087 -12.271  -1.409
  604   2HB   TYR 105          2HB       TYR 105   8.971 -13.124  -2.945
  605    HD1  TYR 105           HD1      TYR 105   7.434 -14.830  -3.312
  606    HD2  TYR 105           HD2      TYR 105   8.288 -13.742   0.803
  607    HE1  TYR 105           HE1      TYR 105   5.740 -16.449  -2.506
  608    HE2  TYR 105           HE2      TYR 105   6.715 -15.488   1.581
  609    HH   TYR 105           HH       TYR 105   4.809 -17.486  -0.706
  610    H    VAL 106           H        VAL 106  11.697 -15.275  -3.400
  611    HA   VAL 106           HA       VAL 106  13.773 -13.160  -3.803
  612    HB   VAL 106           HB       VAL 106  13.825 -16.143  -4.384
  613   1HG1  VAL 106          1HG1      VAL 106  16.286 -15.901  -4.533
  614   2HG1  VAL 106          2HG1      VAL 106  15.473 -14.998  -5.800
  615   3HG1  VAL 106          3HG1      VAL 106  16.126 -14.142  -4.383
  616   1HG2  VAL 106          1HG2      VAL 106  13.718 -15.725  -1.973
  617   2HG2  VAL 106          2HG2      VAL 106  15.313 -16.319  -2.463
  618   3HG2  VAL 106          3HG2      VAL 106  15.076 -14.576  -2.111
  619    H    CYS 107           H        CYS 107  14.299 -12.339  -5.759
  620    HA   CYS 107           HA       CYS 107  12.599 -12.888  -8.085
  621   1HB   CYS 107          1HB       CYS 107  13.388 -10.589  -7.566
  622   2HB   CYS 107          2HB       CYS 107  15.062 -11.134  -7.719
  623    H    HIS 108           H        HIS 108  13.053 -14.268  -9.690
  624    HA   HIS 108           HA       HIS 108  15.714 -15.625  -9.639
  625   1HB   HIS 108          1HB       HIS 108  13.013 -16.646 -10.640
  626   2HB   HIS 108          2HB       HIS 108  14.532 -17.552 -10.676
  627    HD2  HIS 108           HD2      HIS 108  11.582 -17.666  -8.722
  628    HE1  HIS 108           HE1      HIS 108  14.515 -17.883  -5.623
  629    HE2  HIS 108           HE2      HIS 108  12.054 -18.239  -6.195
  630    H    PHE 109           H        PHE 109  14.895 -13.054 -11.064
  631    HA   PHE 109           HA       PHE 109  14.941 -13.555 -13.911
  632   1HB   PHE 109          1HB       PHE 109  14.507 -11.321 -12.542
  633   2HB   PHE 109          2HB       PHE 109  16.248 -11.132 -12.615
  634    HD1  PHE 109           HD1      PHE 109  17.365 -10.713 -14.763
  635    HD2  PHE 109           HD2      PHE 109  13.088 -10.999 -14.369
  636    HE1  PHE 109           HE1      PHE 109  17.067  -9.763 -17.079
  637    HE2  PHE 109           HE2      PHE 109  12.778 -10.080 -16.666
  638    HZ   PHE 109           HZ       PHE 109  14.766  -9.448 -18.013
  639    H    GLU 110           H        GLU 110  16.783 -13.356 -15.351
  640    HA   GLU 110           HA       GLU 110  18.814 -15.152 -14.711
  641   1HB   GLU 110          1HB       GLU 110  18.820 -12.922 -16.800
  642   2HB   GLU 110          2HB       GLU 110  20.005 -14.236 -16.728
  643   1HG   GLU 110          1HG       GLU 110  18.148 -15.896 -16.953
  644   2HG   GLU 110          2HG       GLU 110  16.999 -14.566 -17.125
  645    H    ASN 111           H        ASN 111  20.308 -15.014 -13.140
  646    HA   ASN 111           HA       ASN 111  22.271 -14.362 -12.106
  647   1HB   ASN 111          1HB       ASN 111  22.866 -13.558 -14.516
  648   2HB   ASN 111          2HB       ASN 111  22.478 -11.933 -13.937
  649   1HD2  ASN 111          1HD2      ASN 111  24.554 -11.063 -14.014
  650   2HD2  ASN 111          2HD2      ASN 111  25.867 -11.684 -13.024
  651    H    CYS 112           H        CYS 112  19.422 -13.060 -11.645
  652    HA   CYS 112           HA       CYS 112  20.120 -10.503 -10.374
  653   1HB   CYS 112          1HB       CYS 112  18.006 -10.770 -11.558
  654   2HB   CYS 112          2HB       CYS 112  17.479 -12.044 -10.429
  655    H    GLY 113           H        GLY 113  18.116 -13.176  -9.001
  656   1HA   GLY 113          1HA       GLY 113  18.254 -14.343  -7.011
  657   2HA   GLY 113          2HA       GLY 113  19.960 -13.869  -6.923
  658    H    LYS 114           H        LYS 114  17.799 -11.144  -7.119
  659    HA   LYS 114           HA       LYS 114  18.494 -10.251  -4.437
  660   1HB   LYS 114          1HB       LYS 114  17.900  -8.913  -6.592
  661   2HB   LYS 114          2HB       LYS 114  16.219  -9.101  -6.076
  662   1HG   LYS 114          1HG       LYS 114  16.662  -7.843  -4.040
  663   2HG   LYS 114          2HG       LYS 114  18.423  -7.952  -4.282
  664   1HD   LYS 114          1HD       LYS 114  18.270  -6.595  -6.326
  665   2HD   LYS 114          2HD       LYS 114  16.519  -6.573  -6.175
  666   1HE   LYS 114          1HE       LYS 114  17.322  -4.468  -5.546
  667   2HE   LYS 114          2HE       LYS 114  16.645  -5.266  -4.116
  668   1HZ   LYS 114          1HZ       LYS 114  18.781  -4.187  -3.623
  669   2HZ   LYS 114          2HZ       LYS 114  18.929  -5.797  -3.417
  670   3HZ   LYS 114          3HZ       LYS 114  19.550  -5.078  -4.750
  671    H    ALA 115           H        ALA 115  17.240 -10.114  -2.564
  672    HA   ALA 115           HA       ALA 115  14.778 -11.825  -2.559
  673   1HB   ALA 115          1HB       ALA 115  16.739 -12.900  -1.516
  674   2HB   ALA 115          2HB       ALA 115  16.895 -11.533  -0.383
  675   3HB   ALA 115          3HB       ALA 115  15.455 -12.581  -0.342
  676    H    PHE 116           H        PHE 116  12.968 -11.119  -1.536
  677    HA   PHE 116           HA       PHE 116  13.106  -8.441  -0.199
  678   1HB   PHE 116          1HB       PHE 116  10.799  -9.510  -1.876
  679   2HB   PHE 116          2HB       PHE 116  11.007  -7.906  -1.230
  680    HD1  PHE 116           HD1      PHE 116  12.466  -6.261  -2.288
  681    HD2  PHE 116           HD2      PHE 116  12.222 -10.297  -3.781
  682    HE1  PHE 116           HE1      PHE 116  13.945  -5.663  -4.212
  683    HE2  PHE 116           HE2      PHE 116  13.690  -9.709  -5.666
  684    HZ   PHE 116           HZ       PHE 116  14.554  -7.436  -5.874
  685    H    LYS 117           H        LYS 117  11.527  -7.967   1.371
  686    HA   LYS 117           HA       LYS 117  10.954 -10.050   3.202
  687   1HB   LYS 117          1HB       LYS 117  11.144  -7.576   3.666
  688   2HB   LYS 117          2HB       LYS 117   9.536  -7.345   2.967
  689   1HG   LYS 117          1HG       LYS 117   8.578  -8.843   4.686
  690   2HG   LYS 117          2HG       LYS 117  10.223  -9.189   5.265
  691   1HD   LYS 117          1HD       LYS 117  10.375  -6.605   5.692
  692   2HD   LYS 117          2HD       LYS 117   8.617  -6.612   5.477
  693   1HE   LYS 117          1HE       LYS 117   8.980  -6.917   7.824
  694   2HE   LYS 117          2HE       LYS 117   8.539  -8.516   7.178
  695   1HZ   LYS 117          1HZ       LYS 117  11.323  -7.651   7.614
  696   2HZ   LYS 117          2HZ       LYS 117  10.434  -8.580   8.689
  697   3HZ   LYS 117          3HZ       LYS 117  10.796  -9.166   7.207
  698    H    LYS 118           H        LYS 118   8.894  -8.482   0.708
  699    HA   LYS 118           HA       LYS 118   6.803 -10.592   1.193
  700   1HB   LYS 118          1HB       LYS 118   6.336  -7.624   0.685
  701   2HB   LYS 118          2HB       LYS 118   5.079  -8.808   0.948
  702   1HG   LYS 118          1HG       LYS 118   7.210  -8.102   3.034
  703   2HG   LYS 118          2HG       LYS 118   5.673  -7.277   2.917
  704   1HD   LYS 118          1HD       LYS 118   4.422  -9.067   3.638
  705   2HD   LYS 118          2HD       LYS 118   5.607 -10.247   3.092
  706   1HE   LYS 118          1HE       LYS 118   5.147 -10.086   5.569
  707   2HE   LYS 118          2HE       LYS 118   6.819 -10.259   4.999
  708   1HZ   LYS 118          1HZ       LYS 118   5.470  -7.904   6.131
  709   2HZ   LYS 118          2HZ       LYS 118   6.727  -8.693   6.729
  710   3HZ   LYS 118          3HZ       LYS 118   6.925  -7.750   5.363
  711    H    HIS 119           H        HIS 119   5.527 -11.213  -0.606
  712    HA   HIS 119           HA       HIS 119   6.957 -11.289  -3.078
  713   1HB   HIS 119          1HB       HIS 119   4.930 -12.354  -4.004
  714   2HB   HIS 119          2HB       HIS 119   5.499 -13.053  -2.517
  715    HD1  HIS 119           HD1      HIS 119   2.567 -10.494  -3.260
  716    HD2  HIS 119           HD2      HIS 119   3.707 -14.004  -1.206
  717    HE1  HIS 119           HE1      HIS 119   0.436 -11.392  -2.069
  718    HE2  HIS 119           HE2      HIS 119   1.159 -13.480  -0.826
  719    H    ASN 120           H        ASN 120   4.456  -9.057  -1.913
  720    HA   ASN 120           HA       ASN 120   3.851  -7.867  -4.473
  721   1HB   ASN 120          1HB       ASN 120   3.530  -7.026  -1.571
  722   2HB   ASN 120          2HB       ASN 120   3.326  -5.824  -2.848
  723   1HD2  ASN 120          1HD2      ASN 120   1.499  -8.063  -1.058
  724   2HD2  ASN 120          2HD2      ASN 120   0.248  -8.298  -2.284
  725    H    GLN 121           H        GLN 121   6.496  -7.418  -2.120
  726    HA   GLN 121           HA       GLN 121   7.620  -5.055  -3.457
  727   1HB   GLN 121          1HB       GLN 121   9.026  -6.976  -1.589
  728   2HB   GLN 121          2HB       GLN 121   9.478  -5.316  -2.014
  729   1HG   GLN 121          1HG       GLN 121   6.908  -5.850  -0.504
  730   2HG   GLN 121          2HG       GLN 121   8.479  -5.824   0.293
  731   1HE2  GLN 121          1HE2      GLN 121   9.038  -3.890   1.121
  732   2HE2  GLN 121          2HE2      GLN 121   8.510  -2.331   0.488
  733    H    LEU 122           H        LEU 122   8.120  -8.625  -3.505
  734    HA   LEU 122           HA       LEU 122  10.322  -8.682  -5.291
  735   1HB   LEU 122          1HB       LEU 122   9.629 -10.667  -4.111
  736   2HB   LEU 122          2HB       LEU 122   8.020 -10.604  -4.793
  737    HG   LEU 122           HG       LEU 122   8.786 -11.251  -6.978
  738   1HD1  LEU 122          1HD1      LEU 122  11.045 -11.860  -7.377
  739   2HD1  LEU 122          2HD1      LEU 122  11.057 -10.182  -6.863
  740   3HD1  LEU 122          3HD1      LEU 122  11.526 -11.454  -5.706
  741   1HD2  LEU 122          1HD2      LEU 122   9.518 -13.531  -6.471
  742   2HD2  LEU 122          2HD2      LEU 122   9.988 -13.083  -4.827
  743   3HD2  LEU 122          3HD2      LEU 122   8.277 -13.045  -5.302
  744    H    LYS 123           H        LYS 123   6.774  -8.868  -6.014
  745    HA   LYS 123           HA       LYS 123   6.895  -8.700  -8.816
  746   1HB   LYS 123          1HB       LYS 123   4.879  -7.535  -6.848
  747   2HB   LYS 123          2HB       LYS 123   4.647  -7.490  -8.596
  748   1HG   LYS 123          1HG       LYS 123   4.677  -9.918  -8.749
  749   2HG   LYS 123          2HG       LYS 123   5.058 -10.071  -7.030
  750   1HD   LYS 123          1HD       LYS 123   2.891  -8.875  -6.500
  751   2HD   LYS 123          2HD       LYS 123   2.501  -8.918  -8.233
  752   1HE   LYS 123          1HE       LYS 123   2.683 -11.409  -8.189
  753   2HE   LYS 123          2HE       LYS 123   3.070 -11.344  -6.467
  754   1HZ   LYS 123          1HZ       LYS 123   0.767 -11.812  -6.705
  755   2HZ   LYS 123          2HZ       LYS 123   0.851 -10.282  -6.136
  756   3HZ   LYS 123          3HZ       LYS 123   0.500 -10.543  -7.717
  757    H    VAL 124           H        VAL 124   6.973  -6.015  -6.415
  758    HA   VAL 124           HA       VAL 124   7.017  -3.839  -8.243
  759    HB   VAL 124           HB       VAL 124   8.091  -4.246  -5.452
  760   1HG1  VAL 124          1HG1      VAL 124   8.491  -1.811  -5.256
  761   2HG1  VAL 124          2HG1      VAL 124   9.687  -2.609  -6.275
  762   3HG1  VAL 124          3HG1      VAL 124   8.373  -1.667  -7.022
  763   1HG2  VAL 124          1HG2      VAL 124   5.620  -3.916  -6.242
  764   2HG2  VAL 124          2HG2      VAL 124   6.218  -3.065  -4.835
  765   3HG2  VAL 124          3HG2      VAL 124   6.152  -2.230  -6.430
  766    H    HIS 125           H        HIS 125   9.738  -5.828  -6.953
  767    HA   HIS 125           HA       HIS 125  11.790  -4.311  -8.211
  768   1HB   HIS 125          1HB       HIS 125  12.288  -5.765  -6.390
  769   2HB   HIS 125          2HB       HIS 125  11.648  -7.183  -7.223
  770    HD1  HIS 125           HD1      HIS 125  14.662  -4.781  -7.476
  771    HD2  HIS 125           HD2      HIS 125  13.201  -8.497  -8.820
  772    HE1  HIS 125           HE1      HIS 125  16.619  -5.946  -8.604
  773    H    GLN 126           H        GLN 126  10.050  -7.301  -9.262
  774    HA   GLN 126           HA       GLN 126  11.604  -7.723 -11.619
  775   1HB   GLN 126          1HB       GLN 126   8.783  -8.612 -10.859
  776   2HB   GLN 126          2HB       GLN 126   9.607  -9.080 -12.380
  777   1HG   GLN 126          1HG       GLN 126  11.603  -9.786 -10.989
  778   2HG   GLN 126          2HG       GLN 126  10.676  -9.523  -9.522
  779   1HE2  GLN 126          1HE2      GLN 126  11.984 -11.863 -10.178
  780   2HE2  GLN 126          2HE2      GLN 126  10.760 -13.138 -10.431
  781    H    PHE 127           H        PHE 127   8.768  -5.671 -11.016
  782    HA   PHE 127           HA       PHE 127   8.039  -5.057 -13.673
  783   1HB   PHE 127          1HB       PHE 127   6.630  -3.784 -12.661
  784   2HB   PHE 127          2HB       PHE 127   7.329  -4.217 -11.157
  785    HD1  PHE 127           HD1      PHE 127   8.168  -1.530 -13.818
  786    HD2  PHE 127           HD2      PHE 127   7.245  -2.518  -9.742
  787    HE1  PHE 127           HE1      PHE 127   8.622   0.778 -13.162
  788    HE2  PHE 127           HE2      PHE 127   7.759  -0.314  -8.996
  789    HZ   PHE 127           HZ       PHE 127   8.558   1.434 -10.722
  790    H    SER 128           H        SER 128  10.880  -4.070 -11.809
  791    HA   SER 128           HA       SER 128  11.696  -1.880 -13.539
  792   1HB   SER 128          1HB       SER 128  12.483  -2.324 -11.171
  793   2HB   SER 128          2HB       SER 128  13.486  -3.645 -11.815
  794    HG   SER 128           HG       SER 128  14.620  -1.633 -11.670
  795    H    HIS 129           H        HIS 129  12.599  -5.398 -13.361
  796    HA   HIS 129           HA       HIS 129  14.457  -5.340 -15.566
  797   1HB   HIS 129          1HB       HIS 129  12.738  -7.612 -14.480
  798   2HB   HIS 129          2HB       HIS 129  13.996  -7.767 -15.682
  799    HD1  HIS 129           HD1      HIS 129  16.601  -7.310 -14.768
  800    HD2  HIS 129           HD2      HIS 129  13.472  -8.393 -12.209
  801    HE1  HIS 129           HE1      HIS 129  17.663  -8.439 -12.724
  802    H    THR 130           H        THR 130  10.930  -5.865 -15.367
  803    HA   THR 130           HA       THR 130  10.663  -6.494 -18.221
  804    HB   THR 130           HB       THR 130   8.231  -6.373 -17.752
  805    HG1  THR 130           HG1      THR 130   9.106  -5.400 -15.291
  806   1HG2  THR 130          1HG2      THR 130   8.004  -8.223 -16.255
  807   2HG2  THR 130          2HG2      THR 130   9.596  -8.479 -17.014
  808   3HG2  THR 130          3HG2      THR 130   9.473  -7.849 -15.359
  809    H    GLN 131           H        GLN 131  10.822  -3.622 -16.306
  810    HA   GLN 131           HA       GLN 131  10.474  -1.403 -16.688
  811   1HB   GLN 131          1HB       GLN 131  11.953  -2.199 -18.802
  812   2HB   GLN 131          2HB       GLN 131  10.500  -1.730 -19.686
  813   1HG   GLN 131          1HG       GLN 131  11.406   0.373 -19.561
  814   2HG   GLN 131          2HG       GLN 131  10.729   0.409 -17.931
  815   1HE2  GLN 131          1HE2      GLN 131  12.596  -1.123 -16.371
  816   2HE2  GLN 131          2HE2      GLN 131  14.140  -0.328 -16.535
  817    H    GLN 132           H        GLN 132   8.109  -3.166 -16.502
  818    HA   GLN 132           HA       GLN 132   6.194  -1.148 -17.610
  819   1HB   GLN 132          1HB       GLN 132   4.509  -2.851 -17.997
  820   2HB   GLN 132          2HB       GLN 132   5.925  -3.063 -19.018
  821   1HG   GLN 132          1HG       GLN 132   5.162  -5.223 -18.446
  822   2HG   GLN 132          2HG       GLN 132   6.651  -4.936 -17.569
  823   1HE2  GLN 132          1HE2      GLN 132   6.598  -5.390 -15.418
  824   2HE2  GLN 132          2HE2      GLN 132   5.127  -5.518 -14.438
  825    H    LEU 133           H        LEU 133   4.224  -0.939 -16.305
  826    HA   LEU 133           HA       LEU 133   5.024  -1.134 -13.479
  827   1HB   LEU 133          1HB       LEU 133   3.049   0.564 -15.007
  828   2HB   LEU 133          2HB       LEU 133   3.010   0.539 -13.235
  829    HG   LEU 133           HG       LEU 133   5.638   1.047 -14.776
  830   1HD1  LEU 133          1HD1      LEU 133   5.270   3.438 -14.409
  831   2HD1  LEU 133          2HD1      LEU 133   3.985   2.777 -15.433
  832   3HD1  LEU 133          3HD1      LEU 133   3.665   3.115 -13.715
  833   1HD2  LEU 133          1HD2      LEU 133   5.805   0.385 -12.387
  834   2HD2  LEU 133          2HD2      LEU 133   6.403   2.010 -12.744
  835   3HD2  LEU 133          3HD2      LEU 133   4.819   1.809 -11.985
  836    HA   PRO 134           HA       PRO 134   2.245  -4.464 -12.835
  837   1HB   PRO 134          1HB       PRO 134   2.433  -4.437 -10.009
  838   2HB   PRO 134          2HB       PRO 134   3.522  -5.288 -11.141
  839   1HG   PRO 134          1HG       PRO 134   4.048  -2.917  -9.501
  840   2HG   PRO 134          2HG       PRO 134   5.178  -3.920 -10.420
  841   1HD   PRO 134          1HD       PRO 134   4.161  -1.307 -11.084
  842   2HD   PRO 134          2HD       PRO 134   5.240  -2.360 -12.003
  843    H    TYR 135           H        TYR 135   1.743  -1.530 -10.847
  844    HA   TYR 135           HA       TYR 135  -0.964  -2.467 -10.098
  845   1HB   TYR 135          1HB       TYR 135   0.633  -0.055  -9.105
  846   2HB   TYR 135          2HB       TYR 135  -0.857  -0.658  -8.426
  847    HD1  TYR 135           HD1      TYR 135  -0.983  -2.864  -7.331
  848    HD2  TYR 135           HD2      TYR 135   2.774  -1.098  -8.514
  849    HE1  TYR 135           HE1      TYR 135   0.281  -4.589  -5.989
  850    HE2  TYR 135           HE2      TYR 135   4.011  -2.720  -7.082
  851    HH   TYR 135           HH       TYR 135   3.838  -4.685  -5.833
  852    H    GLU 136           H        GLU 136  -2.253  -2.096 -11.897
  853    HA   GLU 136           HA       GLU 136  -2.215   0.646 -13.076
  854   1HB   GLU 136          1HB       GLU 136  -3.415  -0.300 -14.940
  855   2HB   GLU 136          2HB       GLU 136  -1.968  -1.242 -14.621
  856   1HG   GLU 136          1HG       GLU 136  -3.398  -2.990 -13.501
  857   2HG   GLU 136          2HG       GLU 136  -4.832  -2.057 -13.958
  858    H    CYS 137           H        CYS 137  -4.035   1.937 -13.105
  859    HA   CYS 137           HA       CYS 137  -6.123   1.422 -11.133
  860   1HB   CYS 137          1HB       CYS 137  -5.355   3.677 -11.480
  861   2HB   CYS 137          2HB       CYS 137  -5.673   3.596 -13.196
  862    HA   PRO 138           HA       PRO 138  -8.462  -0.836 -14.200
  863   1HB   PRO 138          1HB       PRO 138 -10.185  -2.139 -12.563
  864   2HB   PRO 138          2HB       PRO 138  -8.419  -2.401 -12.432
  865   1HG   PRO 138          1HG       PRO 138 -10.143  -0.515 -10.772
  866   2HG   PRO 138          2HG       PRO 138  -8.981  -1.744 -10.183
  867   1HD   PRO 138          1HD       PRO 138  -8.329   0.925 -10.517
  868   2HD   PRO 138          2HD       PRO 138  -7.149  -0.410 -10.712
  869    H    HIS 139           H        HIS 139  -9.470   2.015 -12.825
  870    HA   HIS 139           HA       HIS 139 -12.335   1.881 -12.974
  871   1HB   HIS 139          1HB       HIS 139 -10.937   3.617 -11.757
  872   2HB   HIS 139          2HB       HIS 139 -10.595   4.355 -13.327
  873    HD2  HIS 139           HD2      HIS 139 -12.370   6.082 -14.172
  874    HE1  HIS 139           HE1      HIS 139 -15.643   5.075 -11.628
  875    HE2  HIS 139           HE2      HIS 139 -14.828   6.683 -13.431
  876    H    GLU 140           H        GLU 140 -13.791   2.769 -14.530
  877    HA   GLU 140           HA       GLU 140 -13.159   2.133 -17.259
  878   1HB   GLU 140          1HB       GLU 140 -15.441   2.030 -16.253
  879   2HB   GLU 140          2HB       GLU 140 -15.461   3.785 -16.122
  880   1HG   GLU 140          1HG       GLU 140 -16.749   3.114 -18.050
  881   2HG   GLU 140          2HG       GLU 140 -15.317   3.965 -18.607
  882    H    GLY 141           H        GLY 141 -12.278   3.325 -18.866
  883   1HA   GLY 141          1HA       GLY 141 -11.725   5.216 -20.122
  884   2HA   GLY 141          2HA       GLY 141 -12.546   6.237 -18.928
  885    H    CYS 142           H        CYS 142 -10.385   4.221 -17.282
  886    HA   CYS 142           HA       CYS 142  -8.247   6.317 -17.314
  887   1HB   CYS 142          1HB       CYS 142  -9.694   5.876 -15.202
  888   2HB   CYS 142          2HB       CYS 142  -8.813   4.364 -15.063
  889    H    ASP 143           H        ASP 143  -6.045   5.605 -17.120
  890    HA   ASP 143           HA       ASP 143  -5.450   2.728 -17.393
  891   1HB   ASP 143          1HB       ASP 143  -5.927   3.589 -19.735
  892   2HB   ASP 143          2HB       ASP 143  -4.571   4.699 -19.550
  893    H    LYS 144           H        LYS 144  -4.898   5.235 -15.618
  894    HA   LYS 144           HA       LYS 144  -2.048   5.745 -15.720
  895   1HB   LYS 144          1HB       LYS 144  -4.239   6.087 -13.649
  896   2HB   LYS 144          2HB       LYS 144  -2.560   6.176 -13.167
  897   1HG   LYS 144          1HG       LYS 144  -3.365   8.384 -13.473
  898   2HG   LYS 144          2HG       LYS 144  -2.106   8.033 -14.656
  899   1HD   LYS 144          1HD       LYS 144  -3.784   7.752 -16.415
  900   2HD   LYS 144          2HD       LYS 144  -5.098   7.986 -15.257
  901   1HE   LYS 144          1HE       LYS 144  -2.950  10.089 -15.772
  902   2HE   LYS 144          2HE       LYS 144  -4.423   9.975 -16.734
  903   1HZ   LYS 144          1HZ       LYS 144  -5.697  10.253 -14.648
  904   2HZ   LYS 144          2HZ       LYS 144  -4.317  10.576 -13.818
  905   3HZ   LYS 144          3HZ       LYS 144  -4.796  11.556 -15.046
  906    H    ARG 145           H        ARG 145  -0.342   4.750 -14.641
  907    HA   ARG 145           HA       ARG 145  -0.940   2.237 -13.117
  908   1HB   ARG 145          1HB       ARG 145   1.367   2.384 -15.097
  909   2HB   ARG 145          2HB       ARG 145   0.621   0.979 -14.265
  910   1HG   ARG 145          1HG       ARG 145  -1.445   1.324 -15.566
  911   2HG   ARG 145          2HG       ARG 145  -0.651   2.618 -16.480
  912   1HD   ARG 145          1HD       ARG 145   0.843   1.135 -17.549
  913   2HD   ARG 145          2HD       ARG 145   0.466  -0.185 -16.430
  914    HE   ARG 145           HE       ARG 145  -1.514   0.995 -18.379
  915   1HH1  ARG 145          1HH1      ARG 145  -0.310  -1.920 -16.858
  916   2HH1  ARG 145          2HH1      ARG 145  -1.858  -2.726 -16.983
  917   1HH2  ARG 145          1HH2      ARG 145  -3.398  -0.067 -18.573
  918   2HH2  ARG 145          2HH2      ARG 145  -3.579  -1.659 -17.849
  919    H    PHE 146           H        PHE 146   0.590   1.635 -11.594
  920    HA   PHE 146           HA       PHE 146   2.446   3.838 -10.785
  921   1HB   PHE 146          1HB       PHE 146   0.518   2.278  -9.001
  922   2HB   PHE 146          2HB       PHE 146   1.594   3.562  -8.483
  923    HD1  PHE 146           HD1      PHE 146   1.234   5.916  -9.235
  924    HD2  PHE 146           HD2      PHE 146  -1.540   2.768 -10.275
  925    HE1  PHE 146           HE1      PHE 146  -0.391   7.599 -10.082
  926    HE2  PHE 146           HE2      PHE 146  -3.171   4.421 -11.008
  927    HZ   PHE 146           HZ       PHE 146  -2.543   6.862 -11.029
  928    H    SER 147           H        SER 147   4.071   3.257  -9.255
  929    HA   SER 147           HA       SER 147   5.235   0.660  -9.943
  930   1HB   SER 147          1HB       SER 147   7.158   1.614  -8.516
  931   2HB   SER 147          2HB       SER 147   6.696   2.568  -9.945
  932    HG   SER 147           HG       SER 147   6.952   3.863  -8.063
  933    H    LEU 148           H        LEU 148   3.351   1.960  -7.313
  934    HA   LEU 148           HA       LEU 148   3.813  -0.548  -5.786
  935   1HB   LEU 148          1HB       LEU 148   4.187   2.289  -4.803
  936   2HB   LEU 148          2HB       LEU 148   3.645   1.059  -3.677
  937    HG   LEU 148           HG       LEU 148   6.214   0.814  -5.292
  938   1HD1  LEU 148          1HD1      LEU 148   5.789   1.649  -2.396
  939   2HD1  LEU 148          2HD1      LEU 148   7.355   1.317  -3.165
  940   3HD1  LEU 148          3HD1      LEU 148   6.368   2.685  -3.718
  941   1HD2  LEU 148          1HD2      LEU 148   5.152  -1.331  -4.499
  942   2HD2  LEU 148          2HD2      LEU 148   6.735  -1.025  -3.750
  943   3HD2  LEU 148          3HD2      LEU 148   5.254  -0.731  -2.832
  944    HA   PRO 149           HA       PRO 149  -0.567  -0.591  -5.367
  945   1HB   PRO 149          1HB       PRO 149  -0.885  -1.762  -2.857
  946   2HB   PRO 149          2HB       PRO 149  -0.440  -2.630  -4.340
  947   1HG   PRO 149          1HG       PRO 149   1.361  -1.716  -2.106
  948   2HG   PRO 149          2HG       PRO 149   1.397  -3.247  -3.060
  949   1HD   PRO 149          1HD       PRO 149   3.118  -1.188  -3.604
  950   2HD   PRO 149          2HD       PRO 149   2.478  -2.246  -4.811
  951    H    SER 150           H        SER 150   1.326   0.821  -2.710
  952    HA   SER 150           HA       SER 150  -0.820   2.255  -1.428
  953   1HB   SER 150          1HB       SER 150   1.222   3.738  -0.690
  954   2HB   SER 150          2HB       SER 150   1.104   2.063  -0.126
  955    HG   SER 150           HG       SER 150   3.053   3.187  -1.571
  956    H    ARG 151           H        ARG 151   1.393   3.019  -4.140
  957    HA   ARG 151           HA       ARG 151   0.556   5.790  -4.400
  958   1HB   ARG 151          1HB       ARG 151   2.125   3.838  -6.110
  959   2HB   ARG 151          2HB       ARG 151   1.587   5.366  -6.810
  960   1HG   ARG 151          1HG       ARG 151   3.077   5.277  -4.159
  961   2HG   ARG 151          2HG       ARG 151   3.933   5.325  -5.710
  962   1HD   ARG 151          1HD       ARG 151   3.127   7.448  -6.276
  963   2HD   ARG 151          2HD       ARG 151   1.745   7.341  -5.188
  964    HE   ARG 151           HE       ARG 151   4.166   7.339  -3.643
  965   1HH1  ARG 151          1HH1      ARG 151   2.023   9.510  -5.430
  966   2HH1  ARG 151          2HH1      ARG 151   2.435  10.850  -4.355
  967   1HH2  ARG 151          1HH2      ARG 151   4.603   9.271  -2.384
  968   2HH2  ARG 151          2HH2      ARG 151   3.755  10.729  -2.889
  969    H    LEU 152           H        LEU 152  -0.468   2.692  -5.876
  970    HA   LEU 152           HA       LEU 152  -2.439   3.817  -7.677
  971   1HB   LEU 152          1HB       LEU 152  -1.622   1.539  -7.918
  972   2HB   LEU 152          2HB       LEU 152  -2.166   1.132  -6.287
  973    HG   LEU 152           HG       LEU 152  -4.481   1.207  -6.925
  974   1HD1  LEU 152          1HD1      LEU 152  -5.237   1.626  -9.203
  975   2HD1  LEU 152          2HD1      LEU 152  -4.445   3.076  -8.613
  976   3HD1  LEU 152          3HD1      LEU 152  -3.586   1.999  -9.731
  977   1HD2  LEU 152          1HD2      LEU 152  -4.528  -0.679  -8.442
  978   2HD2  LEU 152          2HD2      LEU 152  -2.943  -0.255  -9.108
  979   3HD2  LEU 152          3HD2      LEU 152  -3.064  -0.849  -7.443
  980    H    LYS 153           H        LYS 153  -2.563   2.565  -4.281
  981    HA   LYS 153           HA       LYS 153  -5.331   2.915  -3.800
  982   1HB   LYS 153          1HB       LYS 153  -3.703   1.767  -2.283
  983   2HB   LYS 153          2HB       LYS 153  -3.038   3.328  -1.826
  984   1HG   LYS 153          1HG       LYS 153  -4.484   2.505  -0.111
  985   2HG   LYS 153          2HG       LYS 153  -5.188   3.967  -0.784
  986   1HD   LYS 153          1HD       LYS 153  -6.103   1.386  -2.022
  987   2HD   LYS 153          2HD       LYS 153  -6.524   1.605  -0.323
  988   1HE   LYS 153          1HE       LYS 153  -7.681   3.672  -0.754
  989   2HE   LYS 153          2HE       LYS 153  -7.123   3.707  -2.434
  990   1HZ   LYS 153          1HZ       LYS 153  -9.413   2.856  -2.208
  991   2HZ   LYS 153          2HZ       LYS 153  -8.402   1.787  -2.927
  992   3HZ   LYS 153          3HZ       LYS 153  -8.869   1.566  -1.360
  993    H    ARG 154           H        ARG 154  -2.650   5.301  -3.513
  994    HA   ARG 154           HA       ARG 154  -4.300   7.496  -2.601
  995   1HB   ARG 154          1HB       ARG 154  -1.571   7.229  -3.879
  996   2HB   ARG 154          2HB       ARG 154  -2.313   8.813  -3.828
  997   1HG   ARG 154          1HG       ARG 154  -2.484   7.418  -1.224
  998   2HG   ARG 154          2HG       ARG 154  -0.833   7.602  -1.795
  999   1HD   ARG 154          1HD       ARG 154  -1.538   9.459  -0.327
 1000   2HD   ARG 154          2HD       ARG 154  -1.037  10.005  -1.926
 1001    HE   ARG 154           HE       ARG 154  -3.544  10.065  -2.472
 1002   1HH1  ARG 154          1HH1      ARG 154  -2.149  11.293   0.523
 1003   2HH1  ARG 154          2HH1      ARG 154  -3.477  12.427   0.654
 1004   1HH2  ARG 154          1HH2      ARG 154  -4.917  11.576  -2.235
 1005   2HH2  ARG 154          2HH2      ARG 154  -4.990  12.570  -0.790
 1006    H    HIS 155           H        HIS 155  -3.308   6.373  -5.874
 1007    HA   HIS 155           HA       HIS 155  -4.534   8.486  -7.339
 1008   1HB   HIS 155          1HB       HIS 155  -2.978   6.961  -8.376
 1009   2HB   HIS 155          2HB       HIS 155  -4.053   5.577  -8.124
 1010    HD1  HIS 155           HD1      HIS 155  -4.008   8.872 -10.152
 1011    HD2  HIS 155           HD2      HIS 155  -6.033   5.198  -9.815
 1012    HE1  HIS 155           HE1      HIS 155  -5.870   8.953 -11.867
 1013    H    GLU 156           H        GLU 156  -5.900   5.372  -6.130
 1014    HA   GLU 156           HA       GLU 156  -8.391   5.491  -7.408
 1015   1HB   GLU 156          1HB       GLU 156  -7.577   4.374  -4.685
 1016   2HB   GLU 156          2HB       GLU 156  -9.223   4.258  -5.300
 1017   1HG   GLU 156          1HG       GLU 156  -8.315   3.186  -7.399
 1018   2HG   GLU 156          2HG       GLU 156  -6.750   3.069  -6.602
 1019    H    LYS 157           H        LYS 157  -7.228   7.386  -4.621
 1020    HA   LYS 157           HA       LYS 157  -9.766   8.300  -3.618
 1021   1HB   LYS 157          1HB       LYS 157  -7.104   9.785  -3.647
 1022   2HB   LYS 157          2HB       LYS 157  -8.477  10.157  -2.646
 1023   1HG   LYS 157          1HG       LYS 157  -6.780   7.638  -2.476
 1024   2HG   LYS 157          2HG       LYS 157  -6.749   8.999  -1.367
 1025   1HD   LYS 157          1HD       LYS 157  -9.078   7.067  -1.773
 1026   2HD   LYS 157          2HD       LYS 157  -7.955   7.101  -0.412
 1027   1HE   LYS 157          1HE       LYS 157  -8.719   9.415   0.156
 1028   2HE   LYS 157          2HE       LYS 157  -9.895   9.337  -1.161
 1029   1HZ   LYS 157          1HZ       LYS 157 -10.940   7.445  -0.022
 1030   2HZ   LYS 157          2HZ       LYS 157  -9.854   7.526   1.197
 1031   3HZ   LYS 157          3HZ       LYS 157 -10.908   8.745   0.962
 1032    H    VAL 158           H        VAL 158  -7.870   9.187  -6.481
 1033    HA   VAL 158           HA       VAL 158  -9.084  11.721  -7.058
 1034    HB   VAL 158           HB       VAL 158  -8.102   9.632  -9.079
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.244  12.653  -9.203
 1036   2HG1  VAL 158          2HG1      VAL 158  -7.624  11.591 -10.482
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.354  11.557 -10.082
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.709  11.961  -7.750
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.249  10.275  -7.464
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.980  11.016  -9.068
 1041    H    HIS 159           H        HIS 159 -10.053   8.358  -7.883
 1042    HA   HIS 159           HA       HIS 159 -12.413   9.233  -9.369
 1043   1HB   HIS 159          1HB       HIS 159 -11.461   6.513  -8.360
 1044   2HB   HIS 159          2HB       HIS 159 -12.948   6.752  -9.298
 1045    HD1  HIS 159           HD1      HIS 159 -12.272   8.441 -11.672
 1046    HD2  HIS 159           HD2      HIS 159  -9.419   5.923  -9.875
 1047    HE1  HIS 159           HE1      HIS 159 -10.379   8.164 -13.365
 1048    H    ALA 160           H        ALA 160 -11.671   8.243  -6.030
 1049    HA   ALA 160           HA       ALA 160 -14.432   7.977  -5.170
 1050   1HB   ALA 160          1HB       ALA 160 -13.495   7.973  -2.923
 1051   2HB   ALA 160          2HB       ALA 160 -12.456   6.987  -3.968
 1052   3HB   ALA 160          3HB       ALA 160 -11.960   8.635  -3.507
 1053    H    GLY 161           H        GLY 161 -12.159  10.688  -5.531
 1054   1HA   GLY 161          1HA       GLY 161 -12.787  12.948  -5.762
 1055   2HA   GLY 161          2HA       GLY 161 -14.369  12.581  -5.111
 1056    H    TYR 162           H        TYR 162 -13.317  14.829  -4.233
 1057    HA   TYR 162           HA       TYR 162 -12.285  14.189  -1.492
 1058   1HB   TYR 162          1HB       TYR 162 -11.618  16.548  -3.286
 1059   2HB   TYR 162          2HB       TYR 162 -11.094  16.382  -1.594
 1060    HD1  TYR 162           HD1      TYR 162  -9.311  14.806  -1.007
 1061    HD2  TYR 162           HD2      TYR 162 -10.842  15.026  -5.041
 1062    HE1  TYR 162           HE1      TYR 162  -7.461  13.331  -1.807
 1063    HE2  TYR 162           HE2      TYR 162  -9.204  13.369  -5.765
 1064    HH   TYR 162           HH       TYR 162  -6.946  12.605  -5.213
 1065    HA   PRO 163           HA       PRO 163 -16.262  16.289  -1.057
 1066   1HB   PRO 163          1HB       PRO 163 -17.148  15.010   1.197
 1067   2HB   PRO 163          2HB       PRO 163 -17.120  14.210  -0.400
 1068   1HG   PRO 163          1HG       PRO 163 -15.076  13.977   1.821
 1069   2HG   PRO 163          2HG       PRO 163 -15.835  12.664   0.866
 1070   1HD   PRO 163          1HD       PRO 163 -13.376  13.717   0.263
 1071   2HD   PRO 163          2HD       PRO 163 -14.492  13.113  -1.002
 1072    H    CYS 164           H        CYS 164 -16.844  18.091   0.076
 1073    HA   CYS 164           HA       CYS 164 -14.876  19.345   1.766
 1074   1HB   CYS 164          1HB       CYS 164 -16.684  20.394   0.181
 1075   2HB   CYS 164          2HB       CYS 164 -17.765  20.236   1.586
 1076    H    LYS 165           H        LYS 165 -14.798  19.675   3.917
 1077    HA   LYS 165           HA       LYS 165 -17.038  18.779   5.631
 1078   1HB   LYS 165          1HB       LYS 165 -15.182  16.926   5.288
 1079   2HB   LYS 165          2HB       LYS 165 -14.224  17.917   6.388
 1080   1HG   LYS 165          1HG       LYS 165 -16.047  17.682   8.109
 1081   2HG   LYS 165          2HG       LYS 165 -16.993  16.737   6.945
 1082   1HD   LYS 165          1HD       LYS 165 -15.209  15.022   6.880
 1083   2HD   LYS 165          2HD       LYS 165 -14.247  15.973   8.033
 1084   1HE   LYS 165          1HE       LYS 165 -16.082  15.796   9.702
 1085   2HE   LYS 165          2HE       LYS 165 -17.034  14.843   8.558
 1086   1HZ   LYS 165          1HZ       LYS 165 -15.845  13.419  10.126
 1087   2HZ   LYS 165          2HZ       LYS 165 -15.283  13.144   8.619
 1088   3HZ   LYS 165          3HZ       LYS 165 -14.400  14.028   9.673
 1089    H    LYS 166           H        LYS 166 -15.270  21.241   4.658
 1090    HA   LYS 166           HA       LYS 166 -14.123  22.345   7.095
 1091   1HB   LYS 166          1HB       LYS 166 -15.114  23.660   4.553
 1092   2HB   LYS 166          2HB       LYS 166 -14.215  24.499   5.809
 1093   1HG   LYS 166          1HG       LYS 166 -13.208  22.268   3.999
 1094   2HG   LYS 166          2HG       LYS 166 -12.762  23.974   3.963
 1095   1HD   LYS 166          1HD       LYS 166 -12.045  21.977   6.136
 1096   2HD   LYS 166          2HD       LYS 166 -10.976  22.663   4.908
 1097   1HE   LYS 166          1HE       LYS 166 -11.314  24.932   5.846
 1098   2HE   LYS 166          2HE       LYS 166 -12.393  24.270   7.084
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.140  24.545   7.938
 1100   2HZ   LYS 166          2HZ       LYS 166 -10.520  22.959   7.929
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.522  23.564   6.789
 1102    H    ASP 167           H        ASP 167 -17.380  22.117   5.808
 1103    HA   ASP 167           HA       ASP 167 -18.401  23.411   8.268
 1104   1HB   ASP 167          1HB       ASP 167 -18.209  25.213   6.463
 1105   2HB   ASP 167          2HB       ASP 167 -19.396  24.306   5.523
 1106    H    ASP 168           H        ASP 168 -20.400  22.612   8.919
 1107    HA   ASP 168           HA       ASP 168 -21.068  20.002   8.036
 1108   1HB   ASP 168          1HB       ASP 168 -21.485  20.941  10.314
 1109   2HB   ASP 168          2HB       ASP 168 -22.764  21.955   9.650
 1110    H    SER 169           H        SER 169 -22.294  23.175   7.018
 1111    HA   SER 169           HA       SER 169 -24.589  21.943   5.582
 1112   1HB   SER 169          1HB       SER 169 -23.754  24.859   5.924
 1113   2HB   SER 169          2HB       SER 169 -25.240  24.298   5.143
 1114    HG   SER 169           HG       SER 169 -25.556  24.878   7.352
 1115    H    CYS 170           H        CYS 170 -21.583  21.731   4.793
 1116    HA   CYS 170           HA       CYS 170 -21.787  22.829   2.015
 1117   1HB   CYS 170          1HB       CYS 170 -19.641  22.975   3.685
 1118   2HB   CYS 170          2HB       CYS 170 -19.315  21.402   2.981
 1119    H    SER 171           H        SER 171 -21.222  21.312   0.233
 1120    HA   SER 171           HA       SER 171 -21.583  18.421   0.797
 1121   1HB   SER 171          1HB       SER 171 -23.541  18.249  -0.710
 1122   2HB   SER 171          2HB       SER 171 -23.887  19.256   0.701
 1123    HG   SER 171           HG       SER 171 -24.640  20.215  -1.245
 1124    H    PHE 172           H        PHE 172 -19.913  20.748  -0.809
 1125    HA   PHE 172           HA       PHE 172 -19.824  19.836  -3.525
 1126   1HB   PHE 172          1HB       PHE 172 -18.983  22.009  -3.043
 1127   2HB   PHE 172          2HB       PHE 172 -17.965  21.422  -1.739
 1128    HD1  PHE 172           HD1      PHE 172 -15.848  20.259  -2.131
 1129    HD2  PHE 172           HD2      PHE 172 -18.196  21.752  -5.415
 1130    HE1  PHE 172           HE1      PHE 172 -13.936  19.901  -3.655
 1131    HE2  PHE 172           HE2      PHE 172 -16.203  21.581  -6.908
 1132    HZ   PHE 172           HZ       PHE 172 -14.053  20.698  -6.009
 1133    H    VAL 173           H        VAL 173 -18.565  18.321  -4.567
 1134    HA   VAL 173           HA       VAL 173 -16.429  16.953  -2.987
 1135    HB   VAL 173           HB       VAL 173 -18.295  15.596  -4.968
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.138  13.505  -4.228
 1137   2HG1  VAL 173          2HG1      VAL 173 -15.953  14.595  -4.938
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.072  14.450  -3.177
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.561  15.912  -2.972
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.954  14.256  -2.867
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.179  15.567  -1.929
 1142    H    GLY 174           H        GLY 174 -14.505  17.263  -3.878
 1143   1HA   GLY 174          1HA       GLY 174 -14.348  18.338  -6.623
 1144   2HA   GLY 174          2HA       GLY 174 -13.009  18.141  -5.476
 1145    H    LYS 175           H        LYS 175 -13.828  17.263  -8.452
 1146    HA   LYS 175           HA       LYS 175 -13.516  14.420  -8.508
 1147   1HB   LYS 175          1HB       LYS 175 -14.357  15.885 -10.377
 1148   2HB   LYS 175          2HB       LYS 175 -12.713  16.444 -10.647
 1149   1HG   LYS 175          1HG       LYS 175 -13.423  14.737 -12.271
 1150   2HG   LYS 175          2HG       LYS 175 -11.995  14.262 -11.383
 1151   1HD   LYS 175          1HD       LYS 175 -13.522  12.365 -11.699
 1152   2HD   LYS 175          2HD       LYS 175 -13.283  12.711  -9.999
 1153   1HE   LYS 175          1HE       LYS 175 -15.597  12.215 -10.304
 1154   2HE   LYS 175          2HE       LYS 175 -15.474  13.937  -9.948
 1155   1HZ   LYS 175          1HZ       LYS 175 -15.816  12.771 -12.666
 1156   2HZ   LYS 175          2HZ       LYS 175 -16.991  13.501 -11.802
 1157   3HZ   LYS 175          3HZ       LYS 175 -15.726  14.371 -12.344
 1158    H    THR 176           H        THR 176 -11.222  16.904  -7.800
 1159    HA   THR 176           HA       THR 176  -9.097  14.873  -7.573
 1160    HB   THR 176           HB       THR 176  -7.570  16.908  -8.583
 1161    HG1  THR 176           HG1      THR 176  -8.784  18.153  -9.678
 1162   1HG2  THR 176          1HG2      THR 176  -7.373  15.559 -10.642
 1163   2HG2  THR 176          2HG2      THR 176  -7.289  14.574  -9.164
 1164   3HG2  THR 176          3HG2      THR 176  -8.774  14.621 -10.159
 1165    H    TRP 177           H        TRP 177  -7.265  15.647  -6.295
 1166    HA   TRP 177           HA       TRP 177  -8.128  16.882  -3.935
 1167   1HB   TRP 177          1HB       TRP 177  -6.213  15.453  -3.954
 1168   2HB   TRP 177          2HB       TRP 177  -5.383  16.444  -5.128
 1169    HD1  TRP 177           HD1      TRP 177  -3.414  17.395  -4.138
 1170    HE1  TRP 177           HE1      TRP 177  -2.711  18.599  -1.975
 1171    HE3  TRP 177           HE3      TRP 177  -7.692  16.698  -1.479
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.589  18.395   0.767
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.654  17.018   0.983
 1174    HH2  TRP 177           HH2      TRP 177  -5.593  17.787   2.115
 1175    H    THR 178           H        THR 178  -6.408  18.357  -6.740
 1176    HA   THR 178           HA       THR 178  -5.960  20.938  -5.663
 1177    HB   THR 178           HB       THR 178  -6.306  21.707  -8.089
 1178    HG1  THR 178           HG1      THR 178  -6.063  19.141  -8.996
 1179   1HG2  THR 178          1HG2      THR 178  -4.237  19.547  -7.677
 1180   2HG2  THR 178          2HG2      THR 178  -4.252  20.786  -8.943
 1181   3HG2  THR 178          3HG2      THR 178  -4.075  21.259  -7.246
 1182    H    LEU 179           H        LEU 179  -8.848  19.707  -7.444
 1183    HA   LEU 179           HA       LEU 179 -10.254  22.144  -7.486
 1184   1HB   LEU 179          1HB       LEU 179 -11.362  19.301  -7.382
 1185   2HB   LEU 179          2HB       LEU 179 -12.289  20.738  -7.807
 1186    HG   LEU 179           HG       LEU 179  -9.950  19.599  -9.350
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.649  19.144 -11.071
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.041  18.339  -9.551
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.914  19.818 -10.017
 1190   1HD2  LEU 179          1HD2      LEU 179  -9.893  22.019  -9.660
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.556  21.276 -11.112
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.650  22.059  -9.950
 1193    H    TYR 180           H        TYR 180 -10.053  19.698  -4.905
 1194    HA   TYR 180           HA       TYR 180 -12.171  20.869  -3.277
 1195   1HB   TYR 180          1HB       TYR 180 -11.704  18.647  -2.808
 1196   2HB   TYR 180          2HB       TYR 180  -9.957  18.860  -2.814
 1197    HD1  TYR 180           HD1      TYR 180 -12.988  20.122  -0.927
 1198    HD2  TYR 180           HD2      TYR 180  -8.848  18.914  -0.754
 1199    HE1  TYR 180           HE1      TYR 180 -12.954  20.547   1.525
 1200    HE2  TYR 180           HE2      TYR 180  -8.856  19.236   1.708
 1201    HH   TYR 180           HH       TYR 180 -10.080  19.848   3.546
 1202    H    LEU 181           H        LEU 181  -8.570  20.964  -3.201
 1203    HA   LEU 181           HA       LEU 181  -8.321  22.789  -1.064
 1204   1HB   LEU 181          1HB       LEU 181  -6.604  22.298  -3.532
 1205   2HB   LEU 181          2HB       LEU 181  -6.148  23.416  -2.281
 1206    HG   LEU 181           HG       LEU 181  -6.612  20.395  -1.957
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.113  20.559  -1.338
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.549  20.633  -3.047
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.134  22.125  -2.147
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.621  20.731   0.357
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.971  22.475   0.131
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.274  21.276   0.120
 1213    H    LYS 182           H        LYS 182  -8.710  23.462  -4.579
 1214    HA   LYS 182           HA       LYS 182  -8.549  26.336  -4.400
 1215   1HB   LYS 182          1HB       LYS 182  -9.826  24.438  -6.425
 1216   2HB   LYS 182          2HB       LYS 182  -9.922  26.196  -6.579
 1217   1HG   LYS 182          1HG       LYS 182  -7.415  26.320  -6.431
 1218   2HG   LYS 182          2HG       LYS 182  -7.354  24.557  -6.505
 1219   1HD   LYS 182          1HD       LYS 182  -8.512  24.648  -8.741
 1220   2HD   LYS 182          2HD       LYS 182  -8.535  26.422  -8.609
 1221   1HE   LYS 182          1HE       LYS 182  -5.967  26.215  -8.237
 1222   2HE   LYS 182          2HE       LYS 182  -6.128  24.580  -8.890
 1223   1HZ   LYS 182          1HZ       LYS 182  -7.012  25.585 -10.960
 1224   2HZ   LYS 182          2HZ       LYS 182  -6.962  27.079 -10.272
 1225   3HZ   LYS 182          3HZ       LYS 182  -5.584  26.264 -10.589
 1226    H    HIS 183           H        HIS 183 -11.335  24.052  -4.228
 1227    HA   HIS 183           HA       HIS 183 -13.389  26.027  -3.974
 1228   1HB   HIS 183          1HB       HIS 183 -14.029  23.771  -4.443
 1229   2HB   HIS 183          2HB       HIS 183 -13.152  23.122  -3.075
 1230    HD1  HIS 183           HD1      HIS 183 -16.512  24.761  -3.851
 1231    HD2  HIS 183           HD2      HIS 183 -14.254  23.298  -0.616
 1232    HE1  HIS 183           HE1      HIS 183 -18.097  24.646  -1.851
 1233    H    VAL 184           H        VAL 184 -11.313  24.394  -1.539
 1234    HA   VAL 184           HA       VAL 184 -12.567  25.481   0.789
 1235    HB   VAL 184           HB       VAL 184  -9.825  24.348   0.190
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.262  24.421   2.571
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.337  26.048   1.886
 1238   3HG1  VAL 184          3HG1      VAL 184 -10.688  25.447   2.889
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.285  23.559   1.797
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.599  22.770   0.367
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.714  22.678   1.875
 1242    H    ALA 185           H        ALA 185  -9.820  26.639  -1.198
 1243    HA   ALA 185           HA       ALA 185  -9.144  28.809   0.477
 1244   1HB   ALA 185          1HB       ALA 185  -7.945  29.675  -1.503
 1245   2HB   ALA 185          2HB       ALA 185  -7.686  27.930  -1.317
 1246   3HB   ALA 185          3HB       ALA 185  -8.819  28.538  -2.549
 1247    H    GLU 186           H        GLU 186 -11.632  28.496  -2.046
 1248    HA   GLU 186           HA       GLU 186 -12.140  31.410  -2.123
 1249   1HB   GLU 186          1HB       GLU 186 -13.342  29.024  -3.597
 1250   2HB   GLU 186          2HB       GLU 186 -13.935  30.681  -3.775
 1251   1HG   GLU 186          1HG       GLU 186 -11.656  31.420  -4.468
 1252   2HG   GLU 186          2HG       GLU 186 -11.107  29.747  -4.425
 1253    H    CYS 187           H        CYS 187 -13.568  28.500  -0.652
 1254    HA   CYS 187           HA       CYS 187 -16.057  30.031  -0.002
 1255   1HB   CYS 187          1HB       CYS 187 -15.492  27.034  -0.137
 1256   2HB   CYS 187          2HB       CYS 187 -17.037  27.744   0.348
 1257    HG   CYS 187           HG       CYS 187 -17.103  26.848  -2.161
 1258    H    HIS 188           H        HIS 188 -13.257  28.603   1.573
 1259    HA   HIS 188           HA       HIS 188 -14.578  29.036   4.237
 1260   1HB   HIS 188          1HB       HIS 188 -12.797  26.678   3.506
 1261   2HB   HIS 188          2HB       HIS 188 -13.530  26.983   5.086
 1262    HD1  HIS 188           HD1      HIS 188 -16.406  26.954   5.005
 1263    HD2  HIS 188           HD2      HIS 188 -14.174  25.274   1.870
 1264    HE1  HIS 188           HE1      HIS 188 -17.991  25.376   3.767
 1265    H    GLN 189           H        GLN 189 -12.314  30.280   2.323
 1266    HA   GLN 189           HA       GLN 189 -10.644  31.112   4.633
 1267   1HB   GLN 189          1HB       GLN 189  -9.425  30.166   2.009
 1268   2HB   GLN 189          2HB       GLN 189  -8.545  30.854   3.362
 1269   1HG   GLN 189          1HG       GLN 189  -9.243  28.932   4.788
 1270   2HG   GLN 189          2HG       GLN 189  -9.978  28.168   3.377
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.803  27.087   5.018
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.430  26.886   3.936
 1273    H    ASP 190           H        ASP 190  -9.072  32.947   3.822
 1274    HA   ASP 190           HA       ASP 190  -9.046  35.192   3.211
 1275   1HB   ASP 190          1HB       ASP 190  -8.294  34.028   1.136
 1276   2HB   ASP 190          2HB       ASP 190  -9.957  34.002   0.545
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -6.793  30.390 -13.856
    2   2H5*    G   1          2H5*        G   1  -7.682  28.873 -13.635
    3    H4*    G   1           H4*        G   1  -6.848  29.014 -15.898
    4    H3*    G   1           H3*        G   1  -5.333  26.998 -14.217
    5    H2*    G   1           H2*        G   1  -4.417  26.234 -16.335
    6   2HO*    G   1          2HO*        G   1  -6.482  26.797 -17.555
    7    H1*    G   1           H1*        G   1  -3.718  28.731 -17.079
    8    H8     G   1           H8         G   1  -3.405  29.045 -13.348
    9    H1     G   1           H1         G   1   1.478  25.888 -16.101
   10   1H2     G   1          1H2         G   1   0.873  25.109 -18.032
   11   2H2     G   1          2H2         G   1  -0.642  25.581 -18.779
   12   1H5*    G   2          1H5*        G   2  -6.711  24.812 -17.449
   13   2H5*    G   2          2H5*        G   2  -7.436  23.281 -16.939
   14    H4*    G   2           H4*        G   2  -5.742  22.915 -18.657
   15    H3*    G   2           H3*        G   2  -4.962  21.905 -15.910
   16    H2*    G   2           H2*        G   2  -3.092  20.831 -17.027
   17   2HO*    G   2          2HO*        G   2  -4.466  20.456 -19.062
   18    H1*    G   2           H1*        G   2  -2.411  23.060 -18.415
   19    H8     G   2           H8         G   2  -3.758  24.489 -15.190
   20    H1     G   2           H1         G   2   2.137  21.978 -14.622
   21   1H2     G   2          1H2         G   2   2.519  20.608 -16.247
   22   2H2     G   2          2H2         G   2   1.424  20.449 -17.605
   23   1H5*    G   3          1H5*        G   3  -4.455  18.527 -18.344
   24   2H5*    G   3          2H5*        G   3  -5.218  17.107 -17.618
   25    H4*    G   3           H4*        G   3  -2.854  16.669 -18.121
   26    H3*    G   3           H3*        G   3  -3.541  16.876 -15.166
   27    H2*    G   3           H2*        G   3  -1.304  16.052 -14.778
   28   2HO*    G   3          2HO*        G   3  -1.486  14.602 -16.785
   29    H1*    G   3           H1*        G   3  -0.142  17.651 -16.683
   30    H8     G   3           H8         G   3  -2.826  19.755 -14.990
   31    H1     G   3           H1         G   3   2.669  19.296 -11.670
   32   1H2     G   3          1H2         G   3   3.800  17.593 -12.345
   33   2H2     G   3          2H2         G   3   3.341  16.686 -13.775
   34   1H5*    C   4          1H5*        C   4  -1.738  13.156 -15.244
   35   2H5*    C   4          2H5*        C   4  -2.624  12.002 -14.241
   36    H4*    C   4           H4*        C   4  -0.314  12.195 -13.490
   37    H3*    C   4           H3*        C   4  -2.323  13.393 -11.556
   38    H2*    C   4           H2*        C   4  -0.490  13.716 -10.067
   39   2HO*    C   4          2HO*        C   4   0.453  11.532 -10.744
   40    H1*    C   4           H1*        C   4   1.334  14.457 -12.037
   41   1H4     C   4          1H4         C   4  -0.957  19.568  -8.985
   42   2H4     C   4          2H4         C   4  -2.422  19.533  -9.938
   43    H5     C   4           H5         C   4  -2.862  17.861 -11.606
   44    H6     C   4           H6         C   4  -2.014  15.812 -12.636
   45   1H5*    C   5          1H5*        C   5  -1.349  12.079  -8.558
   46   2H5*    C   5          2H5*        C   5  -2.494  10.990  -7.785
   47    H4*    C   5           H4*        C   5  -1.889  13.008  -6.508
   48    H3*    C   5           H3*        C   5  -4.370  11.831  -6.399
   49    H2*    C   5           H2*        C   5  -5.223  13.256  -8.160
   50   2HO*    C   5          2HO*        C   5  -6.516  13.566  -6.070
   51    H1*    C   5           H1*        C   5  -4.048  15.596  -6.710
   52   1H4     C   5          1H4         C   5  -5.855  18.666 -11.928
   53   2H4     C   5          2H4         C   5  -5.564  17.271 -12.938
   54    H5     C   5           H5         C   5  -4.842  15.167 -12.061
   55    H6     C   5           H6         C   5  -4.313  13.930 -10.023
   56   1H5*    A   6          1H5*        A   6  -2.228  15.167  -4.342
   57   2H5*    A   6          2H5*        A   6  -0.963  13.945  -4.203
   58    H4*    A   6           H4*        A   6  -0.279  15.946  -3.290
   59    H3*    A   6           H3*        A   6  -0.525  13.756  -1.327
   60    H2*    A   6           H2*        A   6  -0.210  15.228   0.550
   61   2HO*    A   6          2HO*        A   6   1.504  16.520   0.041
   62    H1*    A   6           H1*        A   6  -1.519  17.445  -0.355
   63    H8     A   6           H8         A   6  -4.049  15.297  -1.671
   64   1H6     A   6          1H6         A   6  -6.049  14.244   4.103
   65   2H6     A   6          2H6         A   6  -6.370  13.975   2.407
   66    H2     A   6           H2         A   6  -2.128  16.293   4.385
   67   1H5*    U   7          1H5*        U   7   3.287  13.222   0.845
   68   2H5*    U   7          2H5*        U   7   2.240  14.529   0.320
   69    H4*    U   7           H4*        U   7   3.989  15.382   1.685
   70    H3*    U   7           H3*        U   7   3.318  16.581  -0.722
   71    H2*    U   7           H2*        U   7   5.121  15.504  -1.889
   72   2HO*    U   7          2HO*        U   7   5.826  18.076  -0.963
   73    H1*    U   7           H1*        U   7   6.902  16.155   0.491
   74    H3     U   7           H3         U   7  10.576  14.530  -1.478
   75    H5     U   7           H5         U   7   7.878  11.340  -1.583
   76    H6     U   7           H6         U   7   6.085  12.894  -0.978
   77   1H5*    A   8          1H5*        A   8   4.089  20.244  -0.711
   78   2H5*    A   8          2H5*        A   8   3.346  21.093   0.649
   79    H4*    A   8           H4*        A   8   2.595  22.166  -1.297
   80    H3*    A   8           H3*        A   8   0.760  21.215   0.484
   81    H2*    A   8           H2*        A   8   0.381  19.209  -0.823
   82   2HO*    A   8          2HO*        A   8  -1.698  20.175  -0.339
   83    H1*    A   8           H1*        A   8   0.164  21.103  -3.159
   84    H8     A   8           H8         A   8   2.332  17.933  -2.923
   85   1H6     A   8          1H6         A   8  -1.322  15.770  -7.441
   86   2H6     A   8          2H6         A   8   0.224  15.589  -6.645
   87    H2     A   8           H2         A   8  -3.179  19.470  -5.831
   88   1H5*    C   9          1H5*        C   9  -2.491  22.588  -0.359
   89   2H5*    C   9          2H5*        C   9  -2.782  24.106   0.502
   90    H4*    C   9           H4*        C   9  -4.333  22.491   1.289
   91    H3*    C   9           H3*        C   9  -2.219  23.063   3.346
   92    H2*    C   9           H2*        C   9  -3.465  21.582   4.810
   93   2HO*    C   9          2HO*        C   9  -5.573  22.376   3.617
   94    H1*    C   9           H1*        C   9  -3.852  19.620   2.960
   95   1H4     C   9          1H4         C   9   1.781  18.397   5.801
   96   2H4     C   9          2H4         C   9   2.579  18.968   4.350
   97    H5     C   9           H5         C   9   1.432  20.165   2.631
   98    H6     C   9           H6         C   9  -0.748  20.914   1.844
   99   1H5*    C  10          1H5*        C  10  -5.670  23.281   5.403
  100   2H5*    C  10          2H5*        C  10  -5.830  24.680   6.466
  101    H4*    C  10           H4*        C  10  -6.035  22.571   7.717
  102    H3*    C  10           H3*        C  10  -3.507  24.136   8.330
  103    H2*    C  10           H2*        C  10  -3.190  22.572  10.131
  104   2HO*    C  10          2HO*        C  10  -5.562  22.414  10.606
  105    H1*    C  10           H1*        C  10  -3.769  20.368   8.571
  106   1H4     C  10          1H4         C  10   2.518  20.991   8.075
  107   2H4     C  10          2H4         C  10   2.313  21.918   6.605
  108    H5     C  10           H5         C  10   0.177  22.683   5.819
  109    H6     C  10           H6         C  10  -2.229  22.676   6.283
  110   1H5*    U  11          1H5*        U  11  -4.919  24.263  12.217
  111   2H5*    U  11          2H5*        U  11  -4.511  25.819  12.947
  112    H4*    U  11           H4*        U  11  -3.340  23.784  13.897
  113    H3*    U  11           H3*        U  11  -1.670  26.015  12.745
  114    H2*    U  11           H2*        U  11   0.189  24.937  13.797
  115   2HO*    U  11          2HO*        U  11  -1.110  24.321  15.762
  116    H1*    U  11           H1*        U  11  -0.597  22.414  13.042
  117    H3     U  11           H3         U  11   3.107  23.372  10.525
  118    H5     U  11           H5         U  11   0.036  25.491   8.624
  119    H6     U  11           H6         U  11  -1.462  24.875  10.470
  120   1H5*    C  12          1H5*        C  12  -0.019  26.658  16.929
  121   2H5*    C  12          2H5*        C  12   0.847  28.145  16.566
  122    H4*    C  12           H4*        C  12   1.737  25.370  16.562
  123    H3*    C  12           H3*        C  12   2.827  27.738  17.358
  124    H2*    C  12           H2*        C  12   2.899  28.572  15.058
  125   2HO*    C  12          2HO*        C  12   5.328  27.879  16.209
  126    H1*    C  12           H1*        C  12   4.252  25.924  14.418
  127   1H4     C  12          1H4         C  12   4.231  28.442   8.580
  128   2H4     C  12          2H4         C  12   2.521  28.779   8.672
  129    H5     C  12           H5         C  12   1.206  28.370  10.637
  130    H6     C  12           H6         C  12   1.273  27.539  12.942
  131   1H5*    U  13          1H5*        U  13   4.164  23.510  18.508
  132   2H5*    U  13          2H5*        U  13   5.048  23.702  20.023
  133    H4*    U  13           H4*        U  13   5.978  21.729  19.355
  134    H3*    U  13           H3*        U  13   7.845  23.738  18.904
  135    H2*    U  13           H2*        U  13   7.102  24.061  16.617
  136   2HO*    U  13          2HO*        U  13   9.343  22.295  16.700
  137    H1*    U  13           H1*        U  13   7.200  21.021  16.406
  138    H3     U  13           H3         U  13   6.679  21.446  11.913
  139    H5     U  13           H5         U  13   3.756  24.016  13.428
  140    H6     U  13           H6         U  13   4.558  23.518  15.695
  141   1H5*    U  14          1H5*        U  14  10.301  18.823  19.803
  142   2H5*    U  14          2H5*        U  14  11.754  19.451  19.030
  143    H4*    U  14           H4*        U  14   8.964  19.271  17.846
  144    H3*    U  14           H3*        U  14  11.212  17.499  17.768
  145    H2*    U  14           H2*        U  14  12.420  18.911  16.342
  146   2HO*    U  14          2HO*        U  14  10.799  17.181  14.778
  147    H1*    U  14           H1*        U  14   9.767  19.624  15.005
  148    H3     U  14           H3         U  14  12.165  21.715  11.729
  149    H5     U  14           H5         U  14  13.834  23.243  15.248
  150    H6     U  14           H6         U  14  12.406  21.708  16.532
  151   1H5*    G  15          1H5*        G  15   6.472  14.899  16.186
  152   2H5*    G  15          2H5*        G  15   7.018  16.355  15.336
  153    H4*    G  15           H4*        G  15   4.751  16.454  17.344
  154    H3*    G  15           H3*        G  15   4.594  15.788  14.394
  155    H2*    G  15           H2*        G  15   2.327  16.663  14.543
  156   2HO*    G  15          2HO*        G  15   2.022  15.892  16.843
  157    H1*    G  15           H1*        G  15   3.185  18.906  15.809
  158    H8     G  15           H8         G  15   6.133  18.243  13.601
  159    H1     G  15           H1         G  15   0.993  20.306  10.332
  160   1H2     G  15          1H2         G  15  -0.793  20.025  11.515
  161   2H2     G  15          2H2         G  15  -0.727  19.561  13.203
  162   1H5*    G  16          1H5*        G  16   0.903  14.397  15.785
  163   2H5*    G  16          2H5*        G  16   0.567  12.783  15.155
  164    H4*    G  16           H4*        G  16  -1.292  14.277  14.731
  165    H3*    G  16           H3*        G  16   0.197  13.520  12.200
  166    H2*    G  16           H2*        G  16  -1.692  14.539  11.055
  167   2HO*    G  16          2HO*        G  16  -3.275  13.784  12.767
  168    H1*    G  16           H1*        G  16  -1.660  16.768  12.599
  169    H8     G  16           H8         G  16   1.999  15.950  12.454
  170    H1     G  16           H1         G  16  -0.258  17.789   6.747
  171   1H2     G  16          1H2         G  16  -2.416  18.067   6.824
  172   2H2     G  16          2H2         G  16  -3.344  17.570   8.225
  173   1H5*    G  17          1H5*        G  17  -3.559  12.407  11.000
  174   2H5*    G  17          2H5*        G  17  -3.519  10.865  10.132
  175    H4*    G  17           H4*        G  17  -4.396  12.692   8.755
  176    H3*    G  17           H3*        G  17  -1.752  11.578   7.784
  177    H2*    G  17           H2*        G  17  -2.144  12.996   5.810
  178   2HO*    G  17          2HO*        G  17  -4.541  12.686   5.980
  179    H1*    G  17           H1*        G  17  -2.533  15.208   7.239
  180    H8     G  17           H8         G  17  -0.360  13.477   9.710
  181    H1     G  17           H1         G  17   2.857  15.826   4.672
  182   1H2     G  17          1H2         G  17   1.471  16.380   3.090
  183   2H2     G  17          2H2         G  17  -0.241  15.992   3.189
  184   1H5*    C  18          1H5*        C  18  -3.528  11.224   4.278
  185   2H5*    C  18          2H5*        C  18  -3.318   9.638   3.511
  186    H4*    C  18           H4*        C  18  -2.356  11.334   2.100
  187    H3*    C  18           H3*        C  18  -0.150   9.815   3.510
  188    H2*    C  18           H2*        C  18   1.388  11.078   1.991
  189   2HO*    C  18          2HO*        C  18   0.277  11.555   0.095
  190    H1*    C  18           H1*        C  18   0.363  13.348   2.691
  191   1H4     C  18          1H4         C  18   4.408  11.944   7.412
  192   2H4     C  18          2H4         C  18   3.064  11.413   8.389
  193    H5     C  18           H5         C  18   0.811  11.310   7.584
  194    H6     C  18           H6         C  18  -0.600  11.616   5.625
  195   1H5*    C  19          1H5*        C  19   1.279   9.767  -0.188
  196   2H5*    C  19          2H5*        C  19   1.793   8.158  -0.713
  197    H4*    C  19           H4*        C  19   3.552   9.801  -1.091
  198    H3*    C  19           H3*        C  19   4.196   7.768   1.083
  199    H2*    C  19           H2*        C  19   6.433   8.675   0.992
  200   2HO*    C  19          2HO*        C  19   6.091   9.053  -1.458
  201    H1*    C  19           H1*        C  19   5.657  11.279   1.005
  202   1H4     C  19          1H4         C  19   6.339   9.433   7.093
  203   2H4     C  19          2H4         C  19   4.670   8.918   7.147
  204    H5     C  19           H5         C  19   3.225   8.928   5.237
  205    H6     C  19           H6         C  19   3.069   9.525   2.869
  206   1H5*    U  20          1H5*        U  20   7.503   7.510  -1.238
  207   2H5*    U  20          2H5*        U  20   7.887   5.841  -1.667
  208    H4*    U  20           H4*        U  20   9.797   6.836  -0.646
  209    H3*    U  20           H3*        U  20   8.444   4.913   1.283
  210    H2*    U  20           H2*        U  20  10.552   5.040   2.459
  211   2HO*    U  20          2HO*        U  20  11.901   5.237   0.463
  212    H1*    U  20           H1*        U  20  10.587   7.768   2.272
  213    H3     U  20           H3         U  20   9.444   6.662   6.577
  214    H5     U  20           H5         U  20   5.830   6.459   4.483
  215    H6     U  20           H6         U  20   7.086   6.763   2.390
  216   1H5*    G  21          1H5*        G  21  12.222   3.262   0.523
  217   2H5*    G  21          2H5*        G  21  12.161   1.500   0.495
  218    H4*    G  21           H4*        G  21  13.820   2.303   2.065
  219    H3*    G  21           H3*        G  21  11.459   1.076   3.540
  220    H2*    G  21           H2*        G  21  12.986   1.124   5.434
  221   2HO*    G  21          2HO*        G  21  14.971   0.806   3.969
  222    H1*    G  21           H1*        G  21  13.597   3.730   4.983
  223    H8     G  21           H8         G  21  10.001   3.370   3.791
  224    H1     G  21           H1         G  21  10.600   3.397  10.200
  225   1H2     G  21          1H2         G  21  12.668   3.116  10.752
  226   2H2     G  21          2H2         G  21  13.952   3.082   9.559
  227   1H5*    G  22          1H5*        G  22  14.740  -0.961   4.721
  228   2H5*    G  22          2H5*        G  22  14.526  -2.707   4.757
  229    H4*    G  22           H4*        G  22  15.457  -1.904   6.840
  230    H3*    G  22           H3*        G  22  12.609  -2.901   7.160
  231    H2*    G  22           H2*        G  22  13.000  -2.737   9.517
  232   2HO*    G  22          2HO*        G  22  15.255  -3.459   9.470
  233    H1*    G  22           H1*        G  22  14.127  -0.256   9.343
  234    H8     G  22           H8         G  22  11.488  -0.169   6.646
  235    H1     G  22           H1         G  22   9.052   0.153  12.602
  236   1H2     G  22          1H2         G  22  10.552  -0.394  14.049
  237   2H2     G  22          2H2         G  22  12.209  -0.745  13.590
  238   1H5*    U  23          1H5*        U  23  12.220  -7.169   9.487
  239   2H5*    U  23          2H5*        U  23  11.329  -5.672   9.128
  240    H4*    U  23           H4*        U  23  12.963  -6.089  11.636
  241    H3*    U  23           H3*        U  23  10.003  -6.203  10.947
  242    H2*    U  23           H2*        U  23   9.555  -5.651  13.211
  243   2HO*    U  23          2HO*        U  23  11.509  -6.799  14.092
  244    H1*    U  23           H1*        U  23  11.244  -3.531  13.116
  245    H3     U  23           H3         U  23   6.716  -2.465  12.475
  246    H5     U  23           H5         U  23   8.387  -2.717   8.651
  247    H6     U  23           H6         U  23  10.476  -3.526   9.670
  248   1H5*    U  24          1H5*        U  24   9.780  -8.302  13.890
  249   2H5*    U  24          2H5*        U  24   9.115  -9.935  13.803
  250    H4*    U  24           H4*        U  24   7.818  -8.614  15.362
  251    H3*    U  24           H3*        U  24   6.382  -9.058  12.739
  252    H2*    U  24           H2*        U  24   4.428  -8.210  13.758
  253   2HO*    U  24          2HO*        U  24   4.800  -9.193  15.909
  254    H1*    U  24           H1*        U  24   5.772  -6.098  14.923
  255    H3     U  24           H3         U  24   3.172  -4.635  11.369
  256    H5     U  24           H5         U  24   6.755  -5.915   9.610
  257    H6     U  24           H6         U  24   7.492  -6.729  11.807
  258   1H5*    A  25          1H5*        A  25   4.912 -13.087  11.531
  259   2H5*    A  25          2H5*        A  25   6.612 -13.454  11.294
  260    H4*    A  25           H4*        A  25   5.667 -13.044   9.156
  261    H3*    A  25           H3*        A  25   7.851 -11.420   9.927
  262    H2*    A  25           H2*        A  25   6.421  -9.546  10.407
  263   2HO*    A  25          2HO*        A  25   7.981  -8.784   8.956
  264    H1*    A  25           H1*        A  25   4.998 -10.414   7.839
  265    H8     A  25           H8         A  25   3.639  -9.264  11.330
  266   1H6     A  25          1H6         A  25   0.620  -4.938   8.002
  267   2H6     A  25          2H6         A  25   0.672  -5.771   9.544
  268    H2     A  25           H2         A  25   3.432  -7.072   5.292
  269   1H5*    G  26          1H5*        G  26   7.658 -14.869   5.111
  270   2H5*    G  26          2H5*        G  26   7.804 -13.176   4.706
  271    H4*    G  26           H4*        G  26   5.702 -13.481   6.711
  272    H3*    G  26           H3*        G  26   5.848 -15.840   5.151
  273    H2*    G  26           H2*        G  26   5.685 -14.433   3.248
  274   2HO*    G  26          2HO*        G  26   3.200 -15.753   3.748
  275    H1*    G  26           H1*        G  26   3.293 -13.292   4.758
  276    H8     G  26           H8         G  26   5.370 -13.102   1.547
  277    H1     G  26           H1         G  26   0.752  -8.697   1.964
  278   1H2     G  26          1H2         G  26   0.206  -8.454   4.037
  279   2H2     G  26          2H2         G  26   0.717  -9.577   5.284
  280   1H5*    U  27          1H5*        U  27   4.606 -16.103   8.420
  281   2H5*    U  27          2H5*        U  27   3.846 -17.664   8.792
  282    H4*    U  27           H4*        U  27   3.641 -16.570  10.822
  283    H3*    U  27           H3*        U  27   1.083 -15.846   9.324
  284    H2*    U  27           H2*        U  27   0.475 -14.439  11.149
  285   2HO*    U  27          2HO*        U  27   1.608 -16.068  12.703
  286    H1*    U  27           H1*        U  27   2.865 -13.223  11.448
  287    H3     U  27           H3         U  27   0.160 -10.328   9.106
  288    H5     U  27           H5         U  27   2.864 -11.993   6.404
  289    H6     U  27           H6         U  27   3.287 -13.796   8.014
  290   1H5*    A  28          1H5*        A  28  -0.537 -15.908  12.970
  291   2H5*    A  28          2H5*        A  28  -1.791 -17.148  13.025
  292    H4*    A  28           H4*        A  28  -2.750 -15.039  13.700
  293    H3*    A  28           H3*        A  28  -3.646 -15.872  10.909
  294    H2*    A  28           H2*        A  28  -5.144 -13.975  11.018
  295   2HO*    A  28          2HO*        A  28  -5.510 -14.308  13.425
  296    H1*    A  28           H1*        A  28  -3.254 -12.272  11.984
  297    H8     A  28           H8         A  28  -1.070 -14.173   9.683
  298   1H6     A  28          1H6         A  28  -3.475 -10.670   5.130
  299   2H6     A  28          2H6         A  28  -2.200 -11.806   5.533
  300    H2     A  28           H2         A  28  -6.370 -10.747   8.484
  301   1H5*    C  29          1H5*        C  29  -7.238 -15.214  12.074
  302   2H5*    C  29          2H5*        C  29  -8.389 -16.500  11.681
  303    H4*    C  29           H4*        C  29  -8.950 -14.484  10.459
  304    H3*    C  29           H3*        C  29  -7.793 -16.624   8.655
  305    H2*    C  29           H2*        C  29  -8.393 -15.130   6.814
  306   2HO*    C  29          2HO*        C  29 -10.409 -14.357   7.968
  307    H1*    C  29           H1*        C  29  -7.329 -12.955   7.935
  308   1H4     C  29          1H4         C  29  -2.564 -15.774   4.753
  309   2H4     C  29          2H4         C  29  -2.028 -16.527   6.237
  310    H5     C  29           H5         C  29  -3.273 -16.444   8.279
  311    H6     C  29           H6         C  29  -5.290 -15.559   9.336
  312   1H5*    C  30          1H5*        C  30 -11.402 -15.864   6.754
  313   2H5*    C  30          2H5*        C  30 -12.214 -17.352   6.245
  314    H4*    C  30           H4*        C  30 -11.775 -15.865   4.346
  315    H3*    C  30           H3*        C  30 -10.051 -18.360   4.289
  316    H2*    C  30           H2*        C  30  -9.506 -17.653   2.024
  317   2HO*    C  30          2HO*        C  30 -11.778 -16.665   1.751
  318    H1*    C  30           H1*        C  30  -9.041 -15.075   2.810
  319   1H4     C  30          1H4         C  30  -3.634 -18.477   3.113
  320   2H4     C  30          2H4         C  30  -3.958 -18.883   4.784
  321    H5     C  30           H5         C  30  -5.980 -18.259   5.923
  322    H6     C  30           H6         C  30  -8.140 -17.131   5.657
  323   1H5*    U  31          1H5*        U  31 -12.187 -18.164   0.560
  324   2H5*    U  31          2H5*        U  31 -13.063 -19.661   0.244
  325    H4*    U  31           H4*        U  31 -12.022 -18.856  -1.781
  326    H3*    U  31           H3*        U  31 -10.663 -21.350  -0.739
  327    H2*    U  31           H2*        U  31  -9.475 -21.384  -2.821
  328   2HO*    U  31          2HO*        U  31 -11.408 -20.571  -4.068
  329    H1*    U  31           H1*        U  31  -8.898 -18.708  -2.782
  330    H3     U  31           H3         U  31  -4.986 -20.946  -1.745
  331    H5     U  31           H5         U  31  -6.936 -20.352   1.920
  332    H6     U  31           H6         U  31  -8.944 -19.669   0.691
  333   1H5*    C  32          1H5*        C  32 -11.800 -22.780  -4.254
  334   2H5*    C  32          2H5*        C  32 -12.472 -24.412  -4.210
  335    H4*    C  32           H4*        C  32 -10.440 -24.381  -5.539
  336    H3*    C  32           H3*        C  32  -9.983 -25.760  -2.873
  337    H2*    C  32           H2*        C  32  -7.780 -26.281  -3.716
  338   2HO*    C  32          2HO*        C  32  -8.747 -26.538  -6.015
  339    H1*    C  32           H1*        C  32  -7.352 -23.783  -4.796
  340   1H4     C  32          1H4         C  32  -4.828 -24.080   1.061
  341   2H4     C  32          2H4         C  32  -6.384 -23.764   1.794
  342    H5     C  32           H5         C  32  -8.403 -23.487   0.526
  343    H6     C  32           H6         C  32  -9.350 -23.537  -1.733
  344   1H5*    U  33          1H5*        U  33  -8.038 -28.314  -4.961
  345   2H5*    U  33          2H5*        U  33  -8.668 -29.959  -4.860
  346    H4*    U  33           H4*        U  33  -6.326 -30.032  -4.262
  347    H3*    U  33           H3*        U  33  -8.125 -30.207  -1.825
  348    H2*    U  33           H2*        U  33  -6.289 -30.505  -0.517
  349   2HO*    U  33          2HO*        U  33  -4.335 -30.953  -2.573
  350    H1*    U  33           H1*        U  33  -4.574 -28.860  -2.050
  351    H3     U  33           H3         U  33  -4.569 -27.192   2.206
  352    H5     U  33           H5         U  33  -8.534 -26.660   0.986
  353    H6     U  33           H6         U  33  -7.967 -27.723  -1.154
  354   1H5*    U  34          1H5*        U  34  -8.022 -35.823  -1.122
  355   2H5*    U  34          2H5*        U  34  -7.318 -34.837   0.165
  356    H4*    U  34           H4*        U  34  -6.084 -36.918  -0.145
  357    H3*    U  34           H3*        U  34  -4.787 -34.524   0.185
  358    H2*    U  34           H2*        U  34  -4.533 -34.124  -2.168
  359   2HO*    U  34          2HO*        U  34  -2.210 -35.475  -1.197
  360    H1*    U  34           H1*        U  34  -3.698 -37.041  -2.419
  361    H3     U  34           H3         U  34  -2.783 -36.510  -6.810
  362    H5     U  34           H5         U  34  -6.242 -34.202  -6.342
  363    H6     U  34           H6         U  34  -6.235 -34.770  -3.952
  364   1H5*    C  35          1H5*        C  35  -1.311 -34.578   0.860
  365   2H5*    C  35          2H5*        C  35  -0.900 -35.447   2.339
  366    H4*    C  35           H4*        C  35   0.028 -33.203   2.324
  367    H3*    C  35           H3*        C  35  -1.111 -34.284   4.561
  368    H2*    C  35           H2*        C  35  -3.285 -33.389   4.105
  369   2HO*    C  35          2HO*        C  35  -1.865 -31.613   5.820
  370    H1*    C  35           H1*        C  35  -2.041 -30.697   3.454
  371   1H4     C  35          1H4         C  35  -8.273 -30.056   2.218
  372   2H4     C  35          2H4         C  35  -8.215 -31.365   1.051
  373    H5     C  35           H5         C  35  -6.272 -32.705   0.717
  374    H6     C  35           H6         C  35  -3.893 -32.919   1.215
  375   1H5*    G  36          1H5*        G  36   3.251 -30.863   4.479
  376   2H5*    G  36          2H5*        G  36   1.691 -30.974   3.646
  377    H4*    G  36           H4*        G  36   4.274 -32.277   2.703
  378    H3*    G  36           H3*        G  36   2.685 -29.880   1.710
  379    H2*    G  36           H2*        G  36   3.482 -30.404  -0.460
  380   2HO*    G  36          2HO*        G  36   5.741 -30.837   0.591
  381    H1*    G  36           H1*        G  36   3.625 -33.198   0.043
  382    H8     G  36           H8         G  36   2.310 -33.706  -2.175
  383    H1     G  36           H1         G  36  -2.450 -29.651  -0.626
  384   1H2     G  36          1H2         G  36  -2.024 -28.650   1.212
  385   2H2     G  36          2H2         G  36  -0.536 -28.900   2.098
  386   1H5*    G  37          1H5*        G  37   5.179 -28.778  -0.325
  387   2H5*    G  37          2H5*        G  37   5.584 -27.063  -0.378
  388    H4*    G  37           H4*        G  37   4.282 -28.040  -2.356
  389    H3*    G  37           H3*        G  37   3.108 -25.650  -0.887
  390    H2*    G  37           H2*        G  37   1.554 -25.617  -2.801
  391   2HO*    G  37          2HO*        G  37   3.337 -26.540  -4.307
  392    H1*    G  37           H1*        G  37   0.994 -28.240  -2.593
  393    H8     G  37           H8         G  37   1.749 -26.931   0.936
  394    H1     G  37           H1         G  37  -3.920 -25.014  -1.399
  395   1H2     G  37          1H2         G  37  -4.081 -25.560  -3.479
  396   2H2     G  37          2H2         G  37  -2.892 -26.575  -4.271
  397   1H5*    U  38          1H5*        U  38   2.552 -24.683  -4.727
  398   2H5*    U  38          2H5*        U  38   3.191 -23.130  -5.241
  399    H4*    U  38           H4*        U  38   0.875 -23.390  -5.907
  400    H3*    U  38           H3*        U  38   1.211 -21.321  -3.758
  401    H2*    U  38           H2*        U  38  -1.035 -20.631  -4.279
  402   2HO*    U  38          2HO*        U  38  -0.992 -20.996  -6.591
  403    H1*    U  38           H1*        U  38  -1.981 -23.185  -4.167
  404    H3     U  38           H3         U  38  -3.141 -21.415  -0.088
  405    H5     U  38           H5         U  38   0.799 -22.715   0.423
  406    H6     U  38           H6         U  38   0.916 -23.142  -1.985
  407   1H5*    G  39          1H5*        G  39   0.131 -19.070  -7.051
  408   2H5*    G  39          2H5*        G  39   0.945 -17.508  -7.056
  409    H4*    G  39           H4*        G  39  -1.428 -17.224  -7.159
  410    H3*    G  39           H3*        G  39  -0.463 -16.413  -4.413
  411    H2*    G  39           H2*        G  39  -2.750 -15.590  -4.130
  412   2HO*    G  39          2HO*        G  39  -2.934 -15.066  -6.557
  413    H1*    G  39           H1*        G  39  -3.818 -17.922  -4.961
  414    H8     G  39           H8         G  39  -0.441 -18.720  -3.317
  415    H1     G  39           H1         G  39  -5.166 -17.474   0.855
  416   1H2     G  39          1H2         G  39  -6.832 -16.570  -0.179
  417   2H2     G  39          2H2         G  39  -6.900 -16.470  -1.925
  418   1H5*    G  40          1H5*        G  40  -2.701 -13.304  -5.749
  419   2H5*    G  40          2H5*        G  40  -2.034 -11.727  -5.302
  420    H4*    G  40           H4*        G  40  -4.368 -11.897  -4.673
  421    H3*    G  40           H3*        G  40  -2.336 -11.677  -2.422
  422    H2*    G  40           H2*        G  40  -4.282 -11.381  -0.976
  423   2HO*    G  40          2HO*        G  40  -5.476 -10.157  -2.789
  424    H1*    G  40           H1*        G  40  -5.674 -13.431  -2.037
  425    H8     G  40           H8         G  40  -2.134 -14.695  -2.234
  426    H1     G  40           H1         G  40  -4.378 -14.463   3.783
  427   1H2     G  40          1H2         G  40  -6.198 -13.308   3.858
  428   2H2     G  40          2H2         G  40  -6.910 -12.601   2.420
  429   1H5*    G  41          1H5*        G  41  -4.634  -9.150  -0.912
  430   2H5*    G  41          2H5*        G  41  -3.849  -7.619  -0.530
  431    H4*    G  41           H4*        G  41  -4.646  -8.549   1.526
  432    H3*    G  41           H3*        G  41  -1.653  -8.925   1.255
  433    H2*    G  41           H2*        G  41  -1.724  -9.618   3.601
  434   2HO*    G  41          2HO*        G  41  -3.496  -8.284   4.339
  435    H1*    G  41           H1*        G  41  -3.641 -11.425   3.120
  436    H8     G  41           H8         G  41  -1.924 -11.192  -0.241
  437    H1     G  41           H1         G  41   1.266 -14.797   4.009
  438   1H2     G  41          1H2         G  41   0.497 -14.512   5.984
  439   2H2     G  41          2H2         G  41  -0.827 -13.418   6.345
  440   1H5*    A  42          1H5*        A  42  -0.552  -4.906   4.702
  441   2H5*    A  42          2H5*        A  42  -0.357  -6.232   5.856
  442    H4*    A  42           H4*        A  42  -2.973  -5.311   4.596
  443    H3*    A  42           H3*        A  42  -1.875  -5.397   7.422
  444    H2*    A  42           H2*        A  42  -4.141  -5.710   8.208
  445   2HO*    A  42          2HO*        A  42  -5.057  -4.337   6.359
  446    H1*    A  42           H1*        A  42  -4.644  -7.741   6.538
  447    H8     A  42           H8         A  42  -1.133  -8.581   6.690
  448   1H6     A  42          1H6         A  42  -1.852 -10.327  12.616
  449   2H6     A  42          2H6         A  42  -0.849 -10.492  11.194
  450    H2     A  42           H2         A  42  -5.422  -7.977  11.450
  451   1H5*    A  43          1H5*        A  43  -4.600  -2.898   7.810
  452   2H5*    A  43          2H5*        A  43  -4.615  -1.298   8.510
  453    H4*    A  43           H4*        A  43  -5.961  -2.751   9.881
  454    H3*    A  43           H3*        A  43  -3.295  -2.185  11.236
  455    H2*    A  43           H2*        A  43  -4.014  -3.602  13.050
  456   2HO*    A  43          2HO*        A  43  -6.349  -2.758  12.729
  457    H1*    A  43           H1*        A  43  -5.071  -5.578  11.440
  458    H8     A  43           H8         A  43  -2.077  -4.743   9.469
  459   1H6     A  43          1H6         A  43   1.204  -8.231  13.403
  460   2H6     A  43          2H6         A  43   1.170  -7.529  11.796
  461    H2     A  43           H2         A  43  -2.651  -7.219  15.369
  462   1H5*    U  44          1H5*        U  44  -5.347  -1.638  14.412
  463   2H5*    U  44          2H5*        U  44  -4.988  -0.117  15.243
  464    H4*    U  44           H4*        U  44  -4.267  -1.961  16.633
  465    H3*    U  44           H3*        U  44  -1.938  -0.524  15.326
  466    H2*    U  44           H2*        U  44  -0.517  -1.870  16.718
  467   2HO*    U  44          2HO*        U  44  -2.171  -1.785  18.560
  468    H1*    U  44           H1*        U  44  -1.870  -4.193  16.245
  469    H3     U  44           H3         U  44   1.937  -4.640  13.723
  470    H5     U  44           H5         U  44  -0.571  -2.249  11.376
  471    H6     U  44           H6         U  44  -2.080  -2.045  13.294
  472   1H5*    A  45          1H5*        A  45  -0.970  -0.349  19.338
  473   2H5*    A  45          2H5*        A  45  -0.221   1.190  19.775
  474    H4*    A  45           H4*        A  45   1.270  -0.685  20.231
  475    H3*    A  45           H3*        A  45   2.246   1.025  17.912
  476    H2*    A  45           H2*        A  45   4.288  -0.251  18.113
  477   2HO*    A  45          2HO*        A  45   3.991  -0.480  20.567
  478    H1*    A  45           H1*        A  45   2.983  -2.632  18.153
  479    H8     A  45           H8         A  45   0.870  -0.266  16.022
  480   1H6     A  45          1H6         A  45   4.642  -1.763  11.306
  481   2H6     A  45          2H6         A  45   3.113  -1.027  11.741
  482    H2     A  45           H2         A  45   6.404  -3.378  15.035
  483   1H5*    C  46          1H5*        C  46   5.297   0.955  20.657
  484   2H5*    C  46          2H5*        C  46   6.018   2.546  20.901
  485    H4*    C  46           H4*        C  46   7.711   0.907  20.321
  486    H3*    C  46           H3*        C  46   7.223   2.910  18.083
  487    H2*    C  46           H2*        C  46   9.277   2.032  17.175
  488   2HO*    C  46          2HO*        C  46  10.248   1.685  19.404
  489    H1*    C  46           H1*        C  46   8.524  -0.571  17.612
  490   1H4     C  46          1H4         C  46   6.595   0.936  11.723
  491   2H4     C  46          2H4         C  46   5.048   1.465  12.346
  492    H5     C  46           H5         C  46   4.553   1.618  14.691
  493    H6     C  46           H6         C  46   5.454   1.258  16.944
  494   1H5*    C  47          1H5*        C  47  11.209   3.399  19.152
  495   2H5*    C  47          2H5*        C  47  11.666   5.106  19.187
  496    H4*    C  47           H4*        C  47  13.130   3.836  17.713
  497    H3*    C  47           H3*        C  47  11.273   5.693  16.194
  498    H2*    C  47           H2*        C  47  12.754   5.241  14.322
  499   2HO*    C  47          2HO*        C  47  14.750   5.127  15.664
  500    H1*    C  47           H1*        C  47  12.777   2.541  14.832
  501   1H4     C  47          1H4         C  47   8.064   3.646  10.673
  502   2H4     C  47          2H4         C  47   6.956   3.998  11.979
  503    H5     C  47           H5         C  47   7.618   4.085  14.286
  504    H6     C  47           H6         C  47   9.512   3.840  15.825
  505   1H5*    A  48          1H5*        A  48  15.282   7.017  15.423
  506   2H5*    A  48          2H5*        A  48  15.369   8.778  15.351
  507    H4*    A  48           H4*        A  48  16.339   7.757  13.362
  508    H3*    A  48           H3*        A  48  13.734   9.189  12.773
  509    H2*    A  48           H2*        A  48  14.373   8.890  10.433
  510   2HO*    A  48          2HO*        A  48  16.776   9.059  10.959
  511    H1*    A  48           H1*        A  48  14.879   6.253  10.793
  512    H8     A  48           H8         A  48  12.129   7.025  13.290
  513   1H6     A  48          1H6         A  48   8.145   6.629   8.528
  514   2H6     A  48          2H6         A  48   8.295   6.745  10.269
  515    H2     A  48           H2         A  48  12.264   6.647   6.872
  516   1H5*    G  49          1H5*        G  49  16.568  10.877  10.238
  517   2H5*    G  49          2H5*        G  49  16.455  12.631  10.129
  518    H4*    G  49           H4*        G  49  16.480  11.600   7.927
  519    H3*    G  49           H3*        G  49  13.785  12.838   8.591
  520    H2*    G  49           H2*        G  49  13.289  12.429   6.228
  521   2HO*    G  49          2HO*        G  49  15.708  12.755   5.647
  522    H1*    G  49           H1*        G  49  14.130   9.869   6.343
  523    H8     G  49           H8         G  49  12.809  10.363   9.832
  524    H1     G  49           H1         G  49   8.158  10.010   5.409
  525   1H2     G  49          1H2         G  49   8.974  10.406   3.450
  526   2H2     G  49          2H2         G  49  10.702  10.509   3.169
  527   1H5*    G  50          1H5*        G  50  14.633  14.275   4.887
  528   2H5*    G  50          2H5*        G  50  14.497  16.024   4.746
  529    H4*    G  50           H4*        G  50  13.275  14.873   2.966
  530    H3*    G  50           H3*        G  50  11.484  16.330   4.942
  531    H2*    G  50           H2*        G  50   9.676  15.807   3.376
  532   2HO*    G  50          2HO*        G  50  11.335  15.967   1.482
  533    H1*    G  50           H1*        G  50  10.422  13.208   3.080
  534    H8     G  50           H8         G  50  11.282  13.652   6.682
  535    H1     G  50           H1         G  50   4.950  13.183   5.605
  536   1H2     G  50          1H2         G  50   4.543  13.408   3.510
  537   2H2     G  50          2H2         G  50   5.781  13.876   2.362
  538   1H5*    U  51          1H5*        U  51  10.233  17.557   1.316
  539   2H5*    U  51          2H5*        U  51  10.365  19.281   0.978
  540    H4*    U  51           H4*        U  51   8.156  18.456   0.366
  541    H3*    U  51           H3*        U  51   8.604  20.685   2.013
  542    H2*    U  51           H2*        U  51   7.911  19.748   3.956
  543   2HO*    U  51          2HO*        U  51   5.224  20.074   3.066
  544    H1*    U  51           H1*        U  51   5.820  18.046   2.607
  545    H3     U  51           H3         U  51   4.693  16.388   6.601
  546    H5     U  51           H5         U  51   8.805  17.046   7.055
  547    H6     U  51           H6         U  51   8.908  17.699   4.691
  548   1H5*    G  52          1H5*        G  52   7.572  22.554  -2.200
  549   2H5*    G  52          2H5*        G  52   5.948  22.726  -2.850
  550    H4*    G  52           H4*        G  52   7.253  20.062  -2.148
  551    H3*    G  52           H3*        G  52   6.672  21.515  -4.753
  552    H2*    G  52           H2*        G  52   6.574  19.346  -5.796
  553   2HO*    G  52          2HO*        G  52   7.111  18.051  -3.302
  554    H1*    G  52           H1*        G  52   4.974  18.327  -3.825
  555    H8     G  52           H8         G  52   3.847  21.921  -4.157
  556    H1     G  52           H1         G  52   1.408  17.927  -8.566
  557   1H2     G  52          1H2         G  52   2.673  16.187  -8.767
  558   2H2     G  52          2H2         G  52   4.033  15.895  -7.704
  559   1H5*    C  53          1H5*        C  53   9.490  18.754  -6.102
  560   2H5*    C  53          2H5*        C  53  10.650  19.514  -7.203
  561    H4*    C  53           H4*        C  53   9.584  17.619  -8.270
  562    H3*    C  53           H3*        C  53   8.589  20.232  -9.454
  563    H2*    C  53           H2*        C  53   7.603  18.825 -11.162
  564   2HO*    C  53          2HO*        C  53   9.468  17.216 -11.017
  565    H1*    C  53           H1*        C  53   6.550  17.083  -9.343
  566   1H4     C  53          1H4         C  53   2.016  21.462 -10.056
  567   2H4     C  53          2H4         C  53   2.734  22.442  -8.795
  568    H5     C  53           H5         C  53   4.905  22.013  -7.874
  569    H6     C  53           H6         C  53   6.731  20.384  -7.788
  570   1H5*    C  54          1H5*        C  54   9.958  18.128 -12.801
  571   2H5*    C  54          2H5*        C  54  10.827  19.185 -13.915
  572    H4*    C  54           H4*        C  54   9.008  18.031 -15.046
  573    H3*    C  54           H3*        C  54   8.440  21.001 -14.737
  574    H2*    C  54           H2*        C  54   6.637  20.581 -16.301
  575   2HO*    C  54          2HO*        C  54   7.964  18.831 -17.458
  576    H1*    C  54           H1*        C  54   5.780  18.368 -14.952
  577   1H4     C  54          1H4         C  54   2.650  23.301 -12.416
  578   2H4     C  54          2H4         C  54   3.929  23.532 -11.247
  579    H5     C  54           H5         C  54   6.001  22.331 -11.304
  580    H6     C  54           H6         C  54   7.251  20.587 -12.476
  581   1H5*    C  55          1H5*        C  55   8.030  20.367 -18.820
  582   2H5*    C  55          2H5*        C  55   8.855  21.626 -19.745
  583    H4*    C  55           H4*        C  55   6.522  21.447 -20.423
  584    H3*    C  55           H3*        C  55   7.161  23.999 -18.915
  585    H2*    C  55           H2*        C  55   4.981  24.744 -19.552
  586   2HO*    C  55          2HO*        C  55   5.140  23.754 -21.764
  587    H1*    C  55           H1*        C  55   3.761  22.305 -19.068
  588   1H4     C  55          1H4         C  55   3.018  26.057 -13.949
  589   2H4     C  55          2H4         C  55   4.594  25.599 -13.346
  590    H5     C  55           H5         C  55   6.092  24.149 -14.538
  591    H6     C  55           H6         C  55   6.398  22.870 -16.604
  592   1H    MET 104          1H        MET 104  10.022 -16.776   2.619
  593    HA   MET 104           HA       MET 104  11.170 -14.094   2.082
  594   1HB   MET 104          1HB       MET 104  12.950 -15.480   3.205
  595   2HB   MET 104          2HB       MET 104  12.817 -16.658   1.907
  596   1HG   MET 104          1HG       MET 104  14.310 -15.511   0.732
  597   2HG   MET 104          2HG       MET 104  13.213 -14.142   0.619
  598   1HE   MET 104          1HE       MET 104  13.625 -11.824   1.821
  599   2HE   MET 104          2HE       MET 104  12.925 -12.730   3.185
  600   3HE   MET 104          3HE       MET 104  14.382 -11.742   3.422
  601    H    TYR 105           H        TYR 105  10.648 -13.493   0.075
  602    HA   TYR 105           HA       TYR 105   9.891 -15.622  -1.904
  603   1HB   TYR 105          1HB       TYR 105   8.898 -12.788  -1.444
  604   2HB   TYR 105          2HB       TYR 105   8.601 -13.645  -2.957
  605    HD1  TYR 105           HD1      TYR 105   8.025 -14.055   0.861
  606    HD2  TYR 105           HD2      TYR 105   6.990 -15.333  -3.170
  607    HE1  TYR 105           HE1      TYR 105   6.347 -15.596   1.763
  608    HE2  TYR 105           HE2      TYR 105   5.178 -16.739  -2.218
  609    HH   TYR 105           HH       TYR 105   4.537 -16.896   1.302
  610    H    VAL 106           H        VAL 106  11.197 -15.925  -3.585
  611    HA   VAL 106           HA       VAL 106  13.359 -13.899  -4.026
  612    HB   VAL 106           HB       VAL 106  13.285 -16.884  -4.591
  613   1HG1  VAL 106          1HG1      VAL 106  14.942 -15.804  -6.051
  614   2HG1  VAL 106          2HG1      VAL 106  15.661 -14.972  -4.652
  615   3HG1  VAL 106          3HG1      VAL 106  15.748 -16.736  -4.802
  616   1HG2  VAL 106          1HG2      VAL 106  14.639 -15.349  -2.360
  617   2HG2  VAL 106          2HG2      VAL 106  13.248 -16.458  -2.189
  618   3HG2  VAL 106          3HG2      VAL 106  14.814 -17.102  -2.709
  619    H    CYS 107           H        CYS 107  13.864 -13.100  -5.996
  620    HA   CYS 107           HA       CYS 107  12.092 -13.601  -8.278
  621   1HB   CYS 107          1HB       CYS 107  13.000 -11.326  -7.770
  622   2HB   CYS 107          2HB       CYS 107  14.635 -11.946  -8.011
  623    H    HIS 108           H        HIS 108  12.461 -14.990  -9.898
  624    HA   HIS 108           HA       HIS 108  15.067 -16.449  -9.903
  625   1HB   HIS 108          1HB       HIS 108  12.308 -17.368 -10.836
  626   2HB   HIS 108          2HB       HIS 108  13.791 -18.333 -10.905
  627    HD2  HIS 108           HD2      HIS 108  10.885 -18.346  -8.891
  628    HE1  HIS 108           HE1      HIS 108  13.867 -18.643  -5.846
  629    HE2  HIS 108           HE2      HIS 108  11.384 -18.921  -6.371
  630    H    PHE 109           H        PHE 109  14.293 -13.851 -11.321
  631    HA   PHE 109           HA       PHE 109  14.270 -14.370 -14.165
  632   1HB   PHE 109          1HB       PHE 109  13.923 -12.116 -12.797
  633   2HB   PHE 109          2HB       PHE 109  15.666 -11.975 -12.911
  634    HD1  PHE 109           HD1      PHE 109  12.472 -11.762 -14.599
  635    HD2  PHE 109           HD2      PHE 109  16.747 -11.604 -15.087
  636    HE1  PHE 109           HE1      PHE 109  12.140 -10.833 -16.888
  637    HE2  PHE 109           HE2      PHE 109  16.427 -10.657 -17.400
  638    HZ   PHE 109           HZ       PHE 109  14.117 -10.270 -18.283
  639    H    GLU 110           H        GLU 110  16.092 -14.224 -15.640
  640    HA   GLU 110           HA       GLU 110  18.082 -16.074 -15.025
  641   1HB   GLU 110          1HB       GLU 110  17.378 -15.371 -17.311
  642   2HB   GLU 110          2HB       GLU 110  18.255 -13.849 -17.118
  643   1HG   GLU 110          1HG       GLU 110  20.385 -15.111 -16.882
  644   2HG   GLU 110          2HG       GLU 110  19.503 -16.634 -16.983
  645    H    ASN 111           H        ASN 111  19.615 -15.967 -13.487
  646    HA   ASN 111           HA       ASN 111  21.616 -15.361 -12.495
  647   1HB   ASN 111          1HB       ASN 111  22.185 -14.589 -14.920
  648   2HB   ASN 111          2HB       ASN 111  21.847 -12.952 -14.351
  649   1HD2  ASN 111          1HD2      ASN 111  23.945 -12.136 -14.481
  650   2HD2  ASN 111          2HD2      ASN 111  25.259 -12.779 -13.506
  651    H    CYS 112           H        CYS 112  18.815 -13.991 -11.974
  652    HA   CYS 112           HA       CYS 112  19.595 -11.429 -10.758
  653   1HB   CYS 112          1HB       CYS 112  17.448 -11.660 -11.889
  654   2HB   CYS 112          2HB       CYS 112  16.922 -12.911 -10.735
  655    H    GLY 113           H        GLY 113  17.578 -14.055  -9.315
  656   1HA   GLY 113          1HA       GLY 113  17.729 -15.192  -7.310
  657   2HA   GLY 113          2HA       GLY 113  19.446 -14.753  -7.269
  658    H    LYS 114           H        LYS 114  17.328 -11.985  -7.434
  659    HA   LYS 114           HA       LYS 114  18.107 -11.075  -4.786
  660   1HB   LYS 114          1HB       LYS 114  17.416  -9.763  -6.947
  661   2HB   LYS 114          2HB       LYS 114  15.766  -9.923  -6.319
  662   1HG   LYS 114          1HG       LYS 114  16.349  -8.652  -4.338
  663   2HG   LYS 114          2HG       LYS 114  18.093  -8.798  -4.674
  664   1HD   LYS 114          1HD       LYS 114  17.866  -7.441  -6.703
  665   2HD   LYS 114          2HD       LYS 114  16.121  -7.401  -6.478
  666   1HE   LYS 114          1HE       LYS 114  16.982  -5.301  -5.896
  667   2HE   LYS 114          2HE       LYS 114  16.336  -6.084  -4.444
  668   1HZ   LYS 114          1HZ       LYS 114  18.632  -6.645  -3.812
  669   2HZ   LYS 114          2HZ       LYS 114  19.225  -5.945  -5.165
  670   3HZ   LYS 114          3HZ       LYS 114  18.505  -5.035  -4.021
  671    H    ALA 115           H        ALA 115  16.917 -10.914  -2.872
  672    HA   ALA 115           HA       ALA 115  14.423 -12.578  -2.780
  673   1HB   ALA 115          1HB       ALA 115  16.639 -12.387  -0.689
  674   2HB   ALA 115          2HB       ALA 115  15.174 -13.400  -0.620
  675   3HB   ALA 115          3HB       ALA 115  16.406 -13.725  -1.847
  676    H    PHE 116           H        PHE 116  12.698 -11.845  -1.626
  677    HA   PHE 116           HA       PHE 116  12.972  -9.179  -0.281
  678   1HB   PHE 116          1HB       PHE 116  10.537 -10.140  -1.829
  679   2HB   PHE 116          2HB       PHE 116  10.878  -8.564  -1.197
  680    HD1  PHE 116           HD1      PHE 116  11.827 -10.999  -3.840
  681    HD2  PHE 116           HD2      PHE 116  12.331  -6.970  -2.386
  682    HE1  PHE 116           HE1      PHE 116  13.185 -10.477  -5.814
  683    HE2  PHE 116           HE2      PHE 116  13.687  -6.439  -4.410
  684    HZ   PHE 116           HZ       PHE 116  14.138  -8.241  -6.094
  685    H    LYS 117           H        LYS 117  11.395  -8.680   1.354
  686    HA   LYS 117           HA       LYS 117  10.812 -10.947   3.060
  687   1HB   LYS 117          1HB       LYS 117  10.704  -9.397   4.651
  688   2HB   LYS 117          2HB       LYS 117  11.283  -8.269   3.436
  689   1HG   LYS 117          1HG       LYS 117   9.023  -7.468   3.032
  690   2HG   LYS 117          2HG       LYS 117   8.433  -8.633   4.251
  691   1HD   LYS 117          1HD       LYS 117  10.335  -6.422   4.940
  692   2HD   LYS 117          2HD       LYS 117   8.556  -6.277   5.013
  693   1HE   LYS 117          1HE       LYS 117   8.349  -8.066   6.593
  694   2HE   LYS 117          2HE       LYS 117  10.059  -8.509   6.429
  695   1HZ   LYS 117          1HZ       LYS 117   9.762  -7.250   8.398
  696   2HZ   LYS 117          2HZ       LYS 117  10.617  -6.301   7.317
  697   3HZ   LYS 117          3HZ       LYS 117   9.023  -6.007   7.603
  698    H    LYS 118           H        LYS 118   8.879  -8.872   0.844
  699    HA   LYS 118           HA       LYS 118   6.587 -10.802   1.251
  700   1HB   LYS 118          1HB       LYS 118   6.406  -7.838   0.575
  701   2HB   LYS 118          2HB       LYS 118   5.048  -8.909   0.757
  702   1HG   LYS 118          1HG       LYS 118   6.997  -8.205   2.930
  703   2HG   LYS 118          2HG       LYS 118   5.476  -7.380   2.708
  704   1HD   LYS 118          1HD       LYS 118   4.192  -9.168   3.299
  705   2HD   LYS 118          2HD       LYS 118   5.459 -10.364   2.966
  706   1HE   LYS 118          1HE       LYS 118   5.455  -8.613   5.401
  707   2HE   LYS 118          2HE       LYS 118   4.690 -10.230   5.266
  708   1HZ   LYS 118          1HZ       LYS 118   6.698 -11.238   4.899
  709   2HZ   LYS 118          2HZ       LYS 118   7.557  -9.887   4.762
  710   3HZ   LYS 118          3HZ       LYS 118   6.940 -10.312   6.212
  711    H    HIS 119           H        HIS 119   5.375 -11.437  -0.544
  712    HA   HIS 119           HA       HIS 119   6.795 -11.634  -3.026
  713   1HB   HIS 119          1HB       HIS 119   4.701 -12.611  -3.905
  714   2HB   HIS 119          2HB       HIS 119   5.253 -13.321  -2.416
  715    HD1  HIS 119           HD1      HIS 119   2.497 -10.592  -3.159
  716    HD2  HIS 119           HD2      HIS 119   3.426 -14.091  -0.976
  717    HE1  HIS 119           HE1      HIS 119   0.335 -11.271  -1.897
  718    HE2  HIS 119           HE2      HIS 119   0.934 -13.372  -0.593
  719    H    ASN 120           H        ASN 120   4.451  -9.262  -1.818
  720    HA   ASN 120           HA       ASN 120   3.784  -8.105  -4.367
  721   1HB   ASN 120          1HB       ASN 120   3.591  -7.229  -1.475
  722   2HB   ASN 120          2HB       ASN 120   3.470  -5.995  -2.732
  723   1HD2  ASN 120          1HD2      ASN 120   1.440  -7.968  -0.923
  724   2HD2  ASN 120          2HD2      ASN 120   0.195  -8.159  -2.163
  725    H    GLN 121           H        GLN 121   6.589  -7.754  -2.192
  726    HA   GLN 121           HA       GLN 121   7.750  -5.484  -3.655
  727   1HB   GLN 121          1HB       GLN 121   9.189  -7.481  -1.912
  728   2HB   GLN 121          2HB       GLN 121   9.701  -5.856  -2.398
  729   1HG   GLN 121          1HG       GLN 121   8.025  -4.848  -0.956
  730   2HG   GLN 121          2HG       GLN 121   7.486  -6.463  -0.459
  731   1HE2  GLN 121          1HE2      GLN 121   9.457  -3.955   0.583
  732   2HE2  GLN 121          2HE2      GLN 121  10.526  -4.922   1.583
  733    H    LEU 122           H        LEU 122   8.046  -9.078  -3.656
  734    HA   LEU 122           HA       LEU 122  10.096  -9.292  -5.594
  735   1HB   LEU 122          1HB       LEU 122   9.389 -11.201  -4.297
  736   2HB   LEU 122          2HB       LEU 122   7.747 -11.091  -4.880
  737    HG   LEU 122           HG       LEU 122   8.351 -11.837  -7.089
  738   1HD1  LEU 122          1HD1      LEU 122  10.674 -10.891  -7.130
  739   2HD1  LEU 122          2HD1      LEU 122  11.132 -12.130  -5.928
  740   3HD1  LEU 122          3HD1      LEU 122  10.555 -12.588  -7.561
  741   1HD2  LEU 122          1HD2      LEU 122   9.554 -13.642  -4.917
  742   2HD2  LEU 122          2HD2      LEU 122   7.835 -13.562  -5.364
  743   3HD2  LEU 122          3HD2      LEU 122   9.043 -14.135  -6.534
  744    H    LYS 123           H        LYS 123   6.504  -9.339  -6.078
  745    HA   LYS 123           HA       LYS 123   6.483  -9.278  -8.895
  746   1HB   LYS 123          1HB       LYS 123   4.563  -8.081  -6.842
  747   2HB   LYS 123          2HB       LYS 123   4.249  -8.040  -8.583
  748   1HG   LYS 123          1HG       LYS 123   4.463 -10.509  -8.700
  749   2HG   LYS 123          2HG       LYS 123   4.682 -10.584  -6.955
  750   1HD   LYS 123          1HD       LYS 123   2.191  -9.558  -8.395
  751   2HD   LYS 123          2HD       LYS 123   2.394 -11.160  -7.673
  752   1HE   LYS 123          1HE       LYS 123   2.826 -10.011  -5.454
  753   2HE   LYS 123          2HE       LYS 123   2.337  -8.486  -6.213
  754   1HZ   LYS 123          1HZ       LYS 123   0.177  -9.533  -6.702
  755   2HZ   LYS 123          2HZ       LYS 123   0.633 -10.920  -5.960
  756   3HZ   LYS 123          3HZ       LYS 123   0.452  -9.523  -5.095
  757    H    VAL 124           H        VAL 124   6.756  -6.548  -6.571
  758    HA   VAL 124           HA       VAL 124   6.750  -4.414  -8.477
  759    HB   VAL 124           HB       VAL 124   7.911  -4.779  -5.713
  760   1HG1  VAL 124          1HG1      VAL 124   8.188  -2.242  -7.354
  761   2HG1  VAL 124          2HG1      VAL 124   8.364  -2.346  -5.590
  762   3HG1  VAL 124          3HG1      VAL 124   9.507  -3.193  -6.632
  763   1HG2  VAL 124          1HG2      VAL 124   5.417  -4.401  -6.477
  764   2HG2  VAL 124          2HG2      VAL 124   6.069  -3.621  -5.056
  765   3HG2  VAL 124          3HG2      VAL 124   5.988  -2.727  -6.620
  766    H    HIS 125           H        HIS 125   9.436  -6.453  -7.210
  767    HA   HIS 125           HA       HIS 125  11.516  -5.012  -8.503
  768   1HB   HIS 125          1HB       HIS 125  11.986  -6.471  -6.664
  769   2HB   HIS 125          2HB       HIS 125  11.299  -7.870  -7.486
  770    HD1  HIS 125           HD1      HIS 125  14.378  -5.555  -7.791
  771    HD2  HIS 125           HD2      HIS 125  12.795  -9.247  -9.066
  772    HE1  HIS 125           HE1      HIS 125  16.282  -6.782  -8.947
  773    H    GLN 126           H        GLN 126   9.667  -7.947  -9.510
  774    HA   GLN 126           HA       GLN 126  11.152  -8.420 -11.903
  775   1HB   GLN 126          1HB       GLN 126   8.333  -9.215 -11.051
  776   2HB   GLN 126          2HB       GLN 126   9.073  -9.695 -12.613
  777   1HG   GLN 126          1HG       GLN 126  11.088 -10.519 -11.359
  778   2HG   GLN 126          2HG       GLN 126  10.297 -10.177  -9.827
  779   1HE2  GLN 126          1HE2      GLN 126  11.389 -12.575 -10.351
  780   2HE2  GLN 126          2HE2      GLN 126  10.101 -13.794 -10.532
  781    H    PHE 127           H        PHE 127   8.416  -6.264 -11.218
  782    HA   PHE 127           HA       PHE 127   7.647  -5.604 -13.857
  783   1HB   PHE 127          1HB       PHE 127   6.307  -4.302 -12.795
  784   2HB   PHE 127          2HB       PHE 127   7.041  -4.745 -11.308
  785    HD1  PHE 127           HD1      PHE 127   7.895  -2.101 -14.010
  786    HD2  PHE 127           HD2      PHE 127   7.022  -3.016  -9.906
  787    HE1  PHE 127           HE1      PHE 127   8.402   0.207 -13.390
  788    HE2  PHE 127           HE2      PHE 127   7.579  -0.809  -9.201
  789    HZ   PHE 127           HZ       PHE 127   8.390   0.895 -10.963
  790    H    SER 128           H        SER 128  10.561  -4.731 -12.041
  791    HA   SER 128           HA       SER 128  11.423  -2.576 -13.792
  792   1HB   SER 128          1HB       SER 128  12.228  -3.037 -11.437
  793   2HB   SER 128          2HB       SER 128  13.179  -4.394 -12.089
  794    HG   SER 128           HG       SER 128  14.381  -2.416 -11.965
  795    H    HIS 129           H        HIS 129  12.205  -6.123 -13.619
  796    HA   HIS 129           HA       HIS 129  14.026  -6.139 -15.853
  797   1HB   HIS 129          1HB       HIS 129  12.234  -8.340 -14.739
  798   2HB   HIS 129          2HB       HIS 129  13.465  -8.548 -15.961
  799    HD1  HIS 129           HD1      HIS 129  16.104  -8.173 -15.083
  800    HD2  HIS 129           HD2      HIS 129  12.980  -9.153 -12.474
  801    HE1  HIS 129           HE1      HIS 129  17.161  -9.328 -13.051
  802    H    THR 130           H        THR 130  10.482  -6.518 -15.601
  803    HA   THR 130           HA       THR 130  10.148  -7.139 -18.451
  804    HB   THR 130           HB       THR 130   7.728  -6.922 -17.941
  805    HG1  THR 130           HG1      THR 130   8.683  -5.994 -15.495
  806   1HG2  THR 130          1HG2      THR 130   7.455  -8.773 -16.462
  807   2HG2  THR 130          2HG2      THR 130   9.036  -9.080 -17.229
  808   3HG2  THR 130          3HG2      THR 130   8.940  -8.450 -15.571
  809    H    GLN 131           H        GLN 131  10.425  -4.273 -16.535
  810    HA   GLN 131           HA       GLN 131  10.146  -2.043 -16.917
  811   1HB   GLN 131          1HB       GLN 131  11.564  -2.886 -19.053
  812   2HB   GLN 131          2HB       GLN 131  10.113  -2.375 -19.914
  813   1HG   GLN 131          1HG       GLN 131  11.096  -0.308 -19.816
  814   2HG   GLN 131          2HG       GLN 131  10.432  -0.238 -18.182
  815   1HE2  GLN 131          1HE2      GLN 131  12.276  -1.847 -16.645
  816   2HE2  GLN 131          2HE2      GLN 131  13.839  -1.090 -16.820
  817    H    GLN 132           H        GLN 132   7.735  -3.717 -16.668
  818    HA   GLN 132           HA       GLN 132   5.863  -1.650 -17.756
  819   1HB   GLN 132          1HB       GLN 132   4.120  -3.297 -18.122
  820   2HB   GLN 132          2HB       GLN 132   5.512  -3.555 -19.161
  821   1HG   GLN 132          1HG       GLN 132   4.682  -5.691 -18.573
  822   2HG   GLN 132          2HG       GLN 132   6.198  -5.453 -17.727
  823   1HE2  GLN 132          1HE2      GLN 132   6.177  -5.892 -15.570
  824   2HE2  GLN 132          2HE2      GLN 132   4.725  -5.976 -14.560
  825    H    LEU 133           H        LEU 133   3.922  -1.377 -16.418
  826    HA   LEU 133           HA       LEU 133   4.760  -1.591 -13.611
  827   1HB   LEU 133          1HB       LEU 133   2.791   0.141 -15.107
  828   2HB   LEU 133          2HB       LEU 133   2.764   0.113 -13.335
  829    HG   LEU 133           HG       LEU 133   5.382   0.587 -14.903
  830   1HD1  LEU 133          1HD1      LEU 133   3.458   2.673 -13.785
  831   2HD1  LEU 133          2HD1      LEU 133   5.061   2.980 -14.491
  832   3HD1  LEU 133          3HD1      LEU 133   3.755   2.356 -15.512
  833   1HD2  LEU 133          1HD2      LEU 133   6.188   1.525 -12.864
  834   2HD2  LEU 133          2HD2      LEU 133   4.614   1.312 -12.083
  835   3HD2  LEU 133          3HD2      LEU 133   5.592  -0.104 -12.527
  836    HA   PRO 134           HA       PRO 134   1.960  -4.882 -12.899
  837   1HB   PRO 134          1HB       PRO 134   2.189  -4.828 -10.076
  838   2HB   PRO 134          2HB       PRO 134   3.245  -5.714 -11.215
  839   1HG   PRO 134          1HG       PRO 134   3.825  -3.326  -9.613
  840   2HG   PRO 134          2HG       PRO 134   4.933  -4.357 -10.528
  841   1HD   PRO 134          1HD       PRO 134   3.942  -1.742 -11.204
  842   2HD   PRO 134          2HD       PRO 134   4.989  -2.816 -12.136
  843    H    TYR 135           H        TYR 135   1.513  -1.920 -10.947
  844    HA   TYR 135           HA       TYR 135  -1.193  -2.826 -10.147
  845   1HB   TYR 135          1HB       TYR 135   0.456  -0.444  -9.171
  846   2HB   TYR 135          2HB       TYR 135  -1.034  -1.027  -8.471
  847    HD1  TYR 135           HD1      TYR 135   2.589  -1.503  -8.594
  848    HD2  TYR 135           HD2      TYR 135  -1.166  -3.271  -7.407
  849    HE1  TYR 135           HE1      TYR 135   3.828  -3.164  -7.222
  850    HE2  TYR 135           HE2      TYR 135   0.102  -5.021  -6.105
  851    HH   TYR 135           HH       TYR 135   3.664  -5.134  -6.000
  852    H    GLU 136           H        GLU 136  -2.503  -2.434 -11.915
  853    HA   GLU 136           HA       GLU 136  -2.412   0.273 -13.170
  854   1HB   GLU 136          1HB       GLU 136  -4.047  -2.174 -13.973
  855   2HB   GLU 136          2HB       GLU 136  -3.809  -0.698 -14.905
  856   1HG   GLU 136          1HG       GLU 136  -1.402  -1.275 -15.174
  857   2HG   GLU 136          2HG       GLU 136  -1.647  -2.752 -14.246
  858    H    CYS 137           H        CYS 137  -4.171   1.673 -13.107
  859    HA   CYS 137           HA       CYS 137  -6.194   1.286 -11.045
  860   1HB   CYS 137          1HB       CYS 137  -5.360   3.506 -11.487
  861   2HB   CYS 137          2HB       CYS 137  -5.780   3.397 -13.184
  862    HA   PRO 138           HA       PRO 138  -8.739  -0.964 -13.937
  863   1HB   PRO 138          1HB       PRO 138 -10.441  -2.153 -12.191
  864   2HB   PRO 138          2HB       PRO 138  -8.682  -2.475 -12.121
  865   1HG   PRO 138          1HG       PRO 138 -10.271  -0.473 -10.462
  866   2HG   PRO 138          2HG       PRO 138  -9.133  -1.726  -9.875
  867   1HD   PRO 138          1HD       PRO 138  -8.395   0.902 -10.320
  868   2HD   PRO 138          2HD       PRO 138  -7.274  -0.481 -10.523
  869    H    HIS 139           H        HIS 139  -9.604   1.963 -12.610
  870    HA   HIS 139           HA       HIS 139 -12.474   1.924 -12.653
  871   1HB   HIS 139          1HB       HIS 139 -11.066   3.656 -11.526
  872   2HB   HIS 139          2HB       HIS 139 -10.588   4.276 -13.109
  873    HD2  HIS 139           HD2      HIS 139 -12.181   6.041 -14.198
  874    HE1  HIS 139           HE1      HIS 139 -15.628   5.518 -11.745
  875    HE2  HIS 139           HE2      HIS 139 -14.608   6.889 -13.634
  876    H    GLU 140           H        GLU 140 -13.977   2.543 -14.205
  877    HA   GLU 140           HA       GLU 140 -13.330   1.962 -16.953
  878   1HB   GLU 140          1HB       GLU 140 -15.798   3.226 -15.663
  879   2HB   GLU 140          2HB       GLU 140 -15.678   2.771 -17.372
  880   1HG   GLU 140          1HG       GLU 140 -15.226   0.413 -16.704
  881   2HG   GLU 140          2HG       GLU 140 -15.421   0.860 -15.007
  882    H    GLY 141           H        GLY 141 -12.115   3.266 -18.209
  883   1HA   GLY 141          1HA       GLY 141 -12.079   5.247 -19.612
  884   2HA   GLY 141          2HA       GLY 141 -12.822   6.174 -18.297
  885    H    CYS 142           H        CYS 142 -10.580   4.304 -16.747
  886    HA   CYS 142           HA       CYS 142  -8.471   6.419 -16.948
  887   1HB   CYS 142          1HB       CYS 142  -9.694   5.881 -14.722
  888   2HB   CYS 142          2HB       CYS 142  -8.784   4.373 -14.722
  889    H    ASP 143           H        ASP 143  -6.229   5.740 -16.915
  890    HA   ASP 143           HA       ASP 143  -5.668   2.896 -17.586
  891   1HB   ASP 143          1HB       ASP 143  -6.179   4.246 -19.711
  892   2HB   ASP 143          2HB       ASP 143  -4.727   5.184 -19.371
  893    H    LYS 144           H        LYS 144  -5.011   5.211 -15.491
  894    HA   LYS 144           HA       LYS 144  -2.139   5.597 -15.613
  895   1HB   LYS 144          1HB       LYS 144  -4.272   5.893 -13.471
  896   2HB   LYS 144          2HB       LYS 144  -2.577   5.903 -13.033
  897   1HG   LYS 144          1HG       LYS 144  -3.357   8.149 -13.195
  898   2HG   LYS 144          2HG       LYS 144  -2.099   7.837 -14.390
  899   1HD   LYS 144          1HD       LYS 144  -3.744   7.721 -16.176
  900   2HD   LYS 144          2HD       LYS 144  -5.079   7.864 -15.030
  901   1HE   LYS 144          1HE       LYS 144  -2.935  10.006 -15.341
  902   2HE   LYS 144          2HE       LYS 144  -4.385   9.953 -16.341
  903   1HZ   LYS 144          1HZ       LYS 144  -4.336  10.384 -13.394
  904   2HZ   LYS 144          2HZ       LYS 144  -4.841  11.398 -14.586
  905   3HZ   LYS 144          3HZ       LYS 144  -5.699  10.050 -14.249
  906    H    ARG 145           H        ARG 145  -0.462   4.493 -14.582
  907    HA   ARG 145           HA       ARG 145  -1.134   1.948 -13.137
  908   1HB   ARG 145          1HB       ARG 145   1.202   2.113 -15.076
  909   2HB   ARG 145          2HB       ARG 145   0.426   0.698 -14.298
  910   1HG   ARG 145          1HG       ARG 145  -1.578   1.033 -15.664
  911   2HG   ARG 145          2HG       ARG 145  -0.811   2.397 -16.495
  912   1HD   ARG 145          1HD       ARG 145   0.801   1.020 -17.570
  913   2HD   ARG 145          2HD       ARG 145   0.495  -0.333 -16.469
  914    HE   ARG 145           HE       ARG 145  -1.384  -0.964 -17.650
  915   1HH1  ARG 145          1HH1      ARG 145  -0.574   2.202 -18.957
  916   2HH1  ARG 145          2HH1      ARG 145  -2.102   2.280 -19.809
  917   1HH2  ARG 145          1HH2      ARG 145  -3.133  -0.805 -18.667
  918   2HH2  ARG 145          2HH2      ARG 145  -3.559   0.637 -19.606
  919    H    PHE 146           H        PHE 146   0.402   1.271 -11.632
  920    HA   PHE 146           HA       PHE 146   2.281   3.433 -10.759
  921   1HB   PHE 146          1HB       PHE 146   0.377   1.828  -8.988
  922   2HB   PHE 146          2HB       PHE 146   1.454   3.103  -8.476
  923    HD1  PHE 146           HD1      PHE 146   1.091   5.463  -9.096
  924    HD2  PHE 146           HD2      PHE 146  -1.704   2.379 -10.261
  925    HE1  PHE 146           HE1      PHE 146  -0.526   7.190  -9.854
  926    HE2  PHE 146           HE2      PHE 146  -3.325   4.078 -10.919
  927    HZ   PHE 146           HZ       PHE 146  -2.690   6.509 -10.831
  928    H    SER 147           H        SER 147   3.936   2.812  -9.306
  929    HA   SER 147           HA       SER 147   5.041   0.202 -10.059
  930   1HB   SER 147          1HB       SER 147   7.028   1.190  -8.655
  931   2HB   SER 147          2HB       SER 147   6.569   1.981 -10.179
  932    HG   SER 147           HG       SER 147   6.505   3.685  -8.980
  933    H    LEU 148           H        LEU 148   3.277   1.503  -7.355
  934    HA   LEU 148           HA       LEU 148   3.763  -1.036  -5.886
  935   1HB   LEU 148          1HB       LEU 148   4.253   1.763  -4.856
  936   2HB   LEU 148          2HB       LEU 148   3.646   0.562  -3.739
  937    HG   LEU 148           HG       LEU 148   6.220   0.246  -5.330
  938   1HD1  LEU 148          1HD1      LEU 148   5.782   0.889  -2.384
  939   2HD1  LEU 148          2HD1      LEU 148   7.347   0.604  -3.178
  940   3HD1  LEU 148          3HD1      LEU 148   6.370   2.017  -3.611
  941   1HD2  LEU 148          1HD2      LEU 148   6.670  -1.675  -3.896
  942   2HD2  LEU 148          2HD2      LEU 148   5.214  -1.372  -2.937
  943   3HD2  LEU 148          3HD2      LEU 148   5.060  -1.898  -4.621
  944    HA   PRO 149           HA       PRO 149  -0.589  -1.057  -5.381
  945   1HB   PRO 149          1HB       PRO 149  -0.871  -2.240  -2.859
  946   2HB   PRO 149          2HB       PRO 149  -0.499  -3.098  -4.367
  947   1HG   PRO 149          1HG       PRO 149   1.379  -2.290  -2.166
  948   2HG   PRO 149          2HG       PRO 149   1.370  -3.778  -3.189
  949   1HD   PRO 149          1HD       PRO 149   3.092  -1.691  -3.656
  950   2HD   PRO 149          2HD       PRO 149   2.466  -2.724  -4.895
  951    H    SER 150           H        SER 150   1.298   0.273  -2.655
  952    HA   SER 150           HA       SER 150  -0.819   1.696  -1.348
  953   1HB   SER 150          1HB       SER 150   1.089   3.139  -0.491
  954   2HB   SER 150          2HB       SER 150   1.267   1.398  -0.207
  955    HG   SER 150           HG       SER 150   3.180   2.451  -1.053
  956    H    ARG 151           H        ARG 151   1.284   2.498  -4.121
  957    HA   ARG 151           HA       ARG 151   0.474   5.289  -4.288
  958   1HB   ARG 151          1HB       ARG 151   1.823   3.415  -6.289
  959   2HB   ARG 151          2HB       ARG 151   1.570   5.152  -6.567
  960   1HG   ARG 151          1HG       ARG 151   2.878   5.705  -4.575
  961   2HG   ARG 151          2HG       ARG 151   3.045   4.001  -4.157
  962   1HD   ARG 151          1HD       ARG 151   4.342   3.639  -6.269
  963   2HD   ARG 151          2HD       ARG 151   4.312   5.402  -6.528
  964    HE   ARG 151           HE       ARG 151   5.132   5.127  -3.900
  965   1HH1  ARG 151          1HH1      ARG 151   6.576   3.667  -6.776
  966   2HH1  ARG 151          2HH1      ARG 151   8.135   3.608  -5.991
  967   1HH2  ARG 151          1HH2      ARG 151   6.898   4.882  -3.021
  968   2HH2  ARG 151          2HH2      ARG 151   8.338   4.267  -3.841
  969    H    LEU 152           H        LEU 152  -0.586   2.242  -5.846
  970    HA   LEU 152           HA       LEU 152  -2.560   3.433  -7.599
  971   1HB   LEU 152          1HB       LEU 152  -1.775   1.171  -7.950
  972   2HB   LEU 152          2HB       LEU 152  -2.255   0.693  -6.318
  973    HG   LEU 152           HG       LEU 152  -4.598   0.806  -6.872
  974   1HD1  LEU 152          1HD1      LEU 152  -3.785   1.645  -9.688
  975   2HD1  LEU 152          2HD1      LEU 152  -5.425   1.295  -9.095
  976   3HD1  LEU 152          3HD1      LEU 152  -4.574   2.719  -8.517
  977   1HD2  LEU 152          1HD2      LEU 152  -3.226  -1.247  -7.474
  978   2HD2  LEU 152          2HD2      LEU 152  -4.703  -1.034  -8.443
  979   3HD2  LEU 152          3HD2      LEU 152  -3.123  -0.612  -9.125
  980    H    LYS 153           H        LYS 153  -2.704   2.015  -4.266
  981    HA   LYS 153           HA       LYS 153  -5.479   2.395  -3.793
  982   1HB   LYS 153          1HB       LYS 153  -3.061   2.321  -1.954
  983   2HB   LYS 153          2HB       LYS 153  -4.686   2.571  -1.315
  984   1HG   LYS 153          1HG       LYS 153  -5.475   0.466  -2.152
  985   2HG   LYS 153          2HG       LYS 153  -3.997   0.185  -3.075
  986   1HD   LYS 153          1HD       LYS 153  -2.688   0.098  -0.956
  987   2HD   LYS 153          2HD       LYS 153  -4.186   0.353  -0.033
  988   1HE   LYS 153          1HE       LYS 153  -5.124  -1.738  -1.015
  989   2HE   LYS 153          2HE       LYS 153  -3.624  -1.988  -1.914
  990   1HZ   LYS 153          1HZ       LYS 153  -3.645  -3.275   0.148
  991   2HZ   LYS 153          2HZ       LYS 153  -2.454  -2.167   0.228
  992   3HZ   LYS 153          3HZ       LYS 153  -3.844  -1.935   1.053
  993    H    ARG 154           H        ARG 154  -2.743   4.690  -3.419
  994    HA   ARG 154           HA       ARG 154  -4.374   6.814  -2.279
  995   1HB   ARG 154          1HB       ARG 154  -1.716   6.439  -2.368
  996   2HB   ARG 154          2HB       ARG 154  -1.853   7.411  -3.837
  997   1HG   ARG 154          1HG       ARG 154  -3.121   9.135  -2.397
  998   2HG   ARG 154          2HG       ARG 154  -2.752   8.114  -0.999
  999   1HD   ARG 154          1HD       ARG 154  -1.071   9.799  -0.988
 1000   2HD   ARG 154          2HD       ARG 154  -0.282   8.346  -1.628
 1001    HE   ARG 154           HE       ARG 154  -1.467  10.387  -3.468
 1002   1HH1  ARG 154          1HH1      ARG 154   1.547   8.800  -2.582
 1003   2HH1  ARG 154          2HH1      ARG 154   2.455   9.949  -3.545
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.352  11.625  -4.555
 1005   2HH2  ARG 154          2HH2      ARG 154   1.391  11.749  -4.311
 1006    H    HIS 155           H        HIS 155  -3.416   5.882  -5.599
 1007    HA   HIS 155           HA       HIS 155  -4.491   8.203  -6.917
 1008   1HB   HIS 155          1HB       HIS 155  -2.969   6.767  -8.092
 1009   2HB   HIS 155          2HB       HIS 155  -4.007   5.350  -7.883
 1010    HD1  HIS 155           HD1      HIS 155  -4.072   8.731  -9.751
 1011    HD2  HIS 155           HD2      HIS 155  -5.993   4.990  -9.593
 1012    HE1  HIS 155           HE1      HIS 155  -5.907   8.822 -11.500
 1013    H    GLU 156           H        GLU 156  -5.944   5.078  -5.910
 1014    HA   GLU 156           HA       GLU 156  -8.409   5.286  -7.248
 1015   1HB   GLU 156          1HB       GLU 156  -7.612   4.014  -4.597
 1016   2HB   GLU 156          2HB       GLU 156  -9.282   4.001  -5.153
 1017   1HG   GLU 156          1HG       GLU 156  -8.582   2.939  -7.286
 1018   2HG   GLU 156          2HG       GLU 156  -6.927   2.847  -6.695
 1019    H    LYS 157           H        LYS 157  -7.257   7.018  -4.364
 1020    HA   LYS 157           HA       LYS 157  -9.783   7.934  -3.351
 1021   1HB   LYS 157          1HB       LYS 157  -7.124   9.417  -3.280
 1022   2HB   LYS 157          2HB       LYS 157  -8.493   9.647  -2.212
 1023   1HG   LYS 157          1HG       LYS 157  -6.703   7.192  -2.331
 1024   2HG   LYS 157          2HG       LYS 157  -6.741   8.418  -1.070
 1025   1HD   LYS 157          1HD       LYS 157  -9.051   7.733  -0.465
 1026   2HD   LYS 157          2HD       LYS 157  -9.016   6.491  -1.741
 1027   1HE   LYS 157          1HE       LYS 157  -7.062   5.424  -0.672
 1028   2HE   LYS 157          2HE       LYS 157  -7.081   6.646   0.607
 1029   1HZ   LYS 157          1HZ       LYS 157  -9.297   5.848   1.247
 1030   2HZ   LYS 157          2HZ       LYS 157  -9.280   4.718   0.065
 1031   3HZ   LYS 157          3HZ       LYS 157  -8.225   4.620   1.305
 1032    H    VAL 158           H        VAL 158  -7.840   8.924  -6.152
 1033    HA   VAL 158           HA       VAL 158  -8.992  11.507  -6.598
 1034    HB   VAL 158           HB       VAL 158  -8.006   9.493  -8.689
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.308  11.360  -9.696
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.285  12.514  -8.788
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.582  11.503 -10.064
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.636  11.895  -7.465
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.186  10.217  -7.037
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.920  10.840  -8.691
 1041    H    HIS 159           H        HIS 159 -10.012   8.218  -7.608
 1042    HA   HIS 159           HA       HIS 159 -12.347   9.188  -9.069
 1043   1HB   HIS 159          1HB       HIS 159 -11.462   6.416  -8.140
 1044   2HB   HIS 159          2HB       HIS 159 -12.934   6.715  -9.085
 1045    HD1  HIS 159           HD1      HIS 159 -12.186   8.469 -11.403
 1046    HD2  HIS 159           HD2      HIS 159  -9.451   5.783  -9.664
 1047    HE1  HIS 159           HE1      HIS 159 -10.291   8.173 -13.086
 1048    H    ALA 160           H        ALA 160 -11.652   8.151  -5.748
 1049    HA   ALA 160           HA       ALA 160 -14.417   7.852  -4.923
 1050   1HB   ALA 160          1HB       ALA 160 -12.442   6.869  -3.709
 1051   2HB   ALA 160          2HB       ALA 160 -11.970   8.517  -3.220
 1052   3HB   ALA 160          3HB       ALA 160 -13.506   7.834  -2.665
 1053    H    GLY 161           H        GLY 161 -12.208  10.588  -5.335
 1054   1HA   GLY 161          1HA       GLY 161 -12.920  12.831  -5.591
 1055   2HA   GLY 161          2HA       GLY 161 -14.449  12.441  -4.806
 1056    H    TYR 162           H        TYR 162 -13.305  14.748  -4.076
 1057    HA   TYR 162           HA       TYR 162 -12.118  14.158  -1.383
 1058   1HB   TYR 162          1HB       TYR 162 -11.542  16.534  -3.197
 1059   2HB   TYR 162          2HB       TYR 162 -10.854  16.276  -1.587
 1060    HD1  TYR 162           HD1      TYR 162  -8.907  14.763  -1.337
 1061    HD2  TYR 162           HD2      TYR 162 -11.048  15.007  -5.077
 1062    HE1  TYR 162           HE1      TYR 162  -7.190  13.316  -2.439
 1063    HE2  TYR 162           HE2      TYR 162  -9.534  13.368  -6.062
 1064    HH   TYR 162           HH       TYR 162  -6.469  12.392  -4.501
 1065    HA   PRO 163           HA       PRO 163 -16.092  16.228  -0.855
 1066   1HB   PRO 163          1HB       PRO 163 -16.907  14.995   1.449
 1067   2HB   PRO 163          2HB       PRO 163 -16.867  14.142  -0.121
 1068   1HG   PRO 163          1HG       PRO 163 -14.780  14.068   2.075
 1069   2HG   PRO 163          2HG       PRO 163 -15.516  12.691   1.195
 1070   1HD   PRO 163          1HD       PRO 163 -13.104  13.784   0.490
 1071   2HD   PRO 163          2HD       PRO 163 -14.237  13.113  -0.728
 1072    H    CYS 164           H        CYS 164 -16.800  17.991   0.302
 1073    HA   CYS 164           HA       CYS 164 -14.866  19.370   1.967
 1074   1HB   CYS 164          1HB       CYS 164 -16.706  20.307   0.321
 1075   2HB   CYS 164          2HB       CYS 164 -17.772  20.179   1.740
 1076    H    LYS 165           H        LYS 165 -14.842  19.726   4.117
 1077    HA   LYS 165           HA       LYS 165 -17.115  18.825   5.789
 1078   1HB   LYS 165          1HB       LYS 165 -15.172  17.035   5.547
 1079   2HB   LYS 165          2HB       LYS 165 -14.308  18.076   6.678
 1080   1HG   LYS 165          1HG       LYS 165 -16.263  17.838   8.275
 1081   2HG   LYS 165          2HG       LYS 165 -17.050  16.775   7.109
 1082   1HD   LYS 165          1HD       LYS 165 -14.359  16.245   8.445
 1083   2HD   LYS 165          2HD       LYS 165 -15.912  15.576   8.968
 1084   1HE   LYS 165          1HE       LYS 165 -16.175  14.460   6.754
 1085   2HE   LYS 165          2HE       LYS 165 -14.593  15.082   6.261
 1086   1HZ   LYS 165          1HZ       LYS 165 -14.427  12.814   7.110
 1087   2HZ   LYS 165          2HZ       LYS 165 -13.598  13.820   8.090
 1088   3HZ   LYS 165          3HZ       LYS 165 -15.057  13.247   8.551
 1089    H    LYS 166           H        LYS 166 -15.430  21.320   4.792
 1090    HA   LYS 166           HA       LYS 166 -14.332  22.525   7.199
 1091   1HB   LYS 166          1HB       LYS 166 -15.360  23.708   4.608
 1092   2HB   LYS 166          2HB       LYS 166 -14.532  24.655   5.842
 1093   1HG   LYS 166          1HG       LYS 166 -13.267  22.257   4.443
 1094   2HG   LYS 166          2HG       LYS 166 -13.138  23.921   3.868
 1095   1HD   LYS 166          1HD       LYS 166 -11.978  24.641   5.834
 1096   2HD   LYS 166          2HD       LYS 166 -12.218  23.068   6.638
 1097   1HE   LYS 166          1HE       LYS 166 -10.885  21.956   4.877
 1098   2HE   LYS 166          2HE       LYS 166 -10.651  23.503   4.058
 1099   1HZ   LYS 166          1HZ       LYS 166  -9.453  24.288   6.036
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.686  22.856   6.793
 1101   3HZ   LYS 166          3HZ       LYS 166  -8.752  22.926   5.456
 1102    H    ASP 167           H        ASP 167 -17.582  22.142   5.945
 1103    HA   ASP 167           HA       ASP 167 -18.645  23.393   8.397
 1104   1HB   ASP 167          1HB       ASP 167 -18.494  25.227   6.599
 1105   2HB   ASP 167          2HB       ASP 167 -19.691  24.317   5.683
 1106    H    ASP 168           H        ASP 168 -20.659  22.564   9.001
 1107    HA   ASP 168           HA       ASP 168 -21.291  19.957   8.059
 1108   1HB   ASP 168          1HB       ASP 168 -21.756  20.828  10.347
 1109   2HB   ASP 168          2HB       ASP 168 -23.004  21.884   9.689
 1110    H    SER 169           H        SER 169 -22.499  23.151   7.077
 1111    HA   SER 169           HA       SER 169 -24.784  21.966   5.595
 1112   1HB   SER 169          1HB       SER 169 -25.480  24.251   5.225
 1113   2HB   SER 169          2HB       SER 169 -25.055  24.062   6.925
 1114    HG   SER 169           HG       SER 169 -22.995  25.034   6.427
 1115    H    CYS 170           H        CYS 170 -21.755  21.699   4.864
 1116    HA   CYS 170           HA       CYS 170 -22.013  22.631   2.035
 1117   1HB   CYS 170          1HB       CYS 170 -20.145  23.613   3.507
 1118   2HB   CYS 170          2HB       CYS 170 -19.443  22.005   3.505
 1119    H    SER 171           H        SER 171 -21.855  21.078   0.450
 1120    HA   SER 171           HA       SER 171 -21.199  18.270   1.283
 1121   1HB   SER 171          1HB       SER 171 -23.598  19.155  -0.380
 1122   2HB   SER 171          2HB       SER 171 -23.172  17.484   0.026
 1123    HG   SER 171           HG       SER 171 -24.786  18.331   1.420
 1124    H    PHE 172           H        PHE 172 -19.928  20.549  -0.470
 1125    HA   PHE 172           HA       PHE 172 -19.909  19.647  -3.196
 1126   1HB   PHE 172          1HB       PHE 172 -19.109  21.845  -2.724
 1127   2HB   PHE 172          2HB       PHE 172 -18.015  21.273  -1.477
 1128    HD1  PHE 172           HD1      PHE 172 -15.891  20.160  -1.997
 1129    HD2  PHE 172           HD2      PHE 172 -18.446  21.623  -5.136
 1130    HE1  PHE 172           HE1      PHE 172 -14.063  19.832  -3.631
 1131    HE2  PHE 172           HE2      PHE 172 -16.547  21.479  -6.742
 1132    HZ   PHE 172           HZ       PHE 172 -14.340  20.615  -5.984
 1133    H    VAL 173           H        VAL 173 -18.651  18.172  -4.286
 1134    HA   VAL 173           HA       VAL 173 -16.439  16.839  -2.784
 1135    HB   VAL 173           HB       VAL 173 -18.373  15.446  -4.674
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.157  13.374  -3.968
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.040  14.478  -4.766
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.042  14.349  -2.994
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.527  15.758  -2.598
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.915  14.104  -2.552
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.086  15.396  -1.642
 1142    H    GLY 174           H        GLY 174 -14.548  17.152  -3.764
 1143   1HA   GLY 174          1HA       GLY 174 -14.527  18.221  -6.519
 1144   2HA   GLY 174          2HA       GLY 174 -13.139  18.059  -5.429
 1145    H    LYS 175           H        LYS 175 -13.936  17.195  -8.366
 1146    HA   LYS 175           HA       LYS 175 -13.596  14.360  -8.479
 1147   1HB   LYS 175          1HB       LYS 175 -14.420  15.626 -10.347
 1148   2HB   LYS 175          2HB       LYS 175 -12.974  16.582 -10.475
 1149   1HG   LYS 175          1HG       LYS 175 -12.856  13.587 -10.905
 1150   2HG   LYS 175          2HG       LYS 175 -13.496  14.636 -12.160
 1151   1HD   LYS 175          1HD       LYS 175 -10.696  14.885 -11.012
 1152   2HD   LYS 175          2HD       LYS 175 -11.106  14.076 -12.512
 1153   1HE   LYS 175          1HE       LYS 175 -11.707  16.108 -13.586
 1154   2HE   LYS 175          2HE       LYS 175 -11.829  16.988 -12.060
 1155   1HZ   LYS 175          1HZ       LYS 175  -9.453  16.792 -11.763
 1156   2HZ   LYS 175          2HZ       LYS 175  -9.283  15.940 -13.159
 1157   3HZ   LYS 175          3HZ       LYS 175  -9.754  17.504 -13.209
 1158    H    THR 176           H        THR 176 -11.307  16.923  -7.808
 1159    HA   THR 176           HA       THR 176  -9.186  14.904  -7.437
 1160    HB   THR 176           HB       THR 176  -7.634  16.863  -8.558
 1161    HG1  THR 176           HG1      THR 176  -8.992  18.037  -9.638
 1162   1HG2  THR 176          1HG2      THR 176  -7.410  15.331 -10.490
 1163   2HG2  THR 176          2HG2      THR 176  -7.342  14.478  -8.932
 1164   3HG2  THR 176          3HG2      THR 176  -8.808  14.425  -9.926
 1165    H    TRP 177           H        TRP 177  -7.332  15.761  -6.226
 1166    HA   TRP 177           HA       TRP 177  -8.197  17.057  -3.906
 1167   1HB   TRP 177          1HB       TRP 177  -6.244  15.656  -3.928
 1168   2HB   TRP 177          2HB       TRP 177  -5.439  16.673  -5.097
 1169    HD1  TRP 177           HD1      TRP 177  -3.495  17.660  -4.065
 1170    HE1  TRP 177           HE1      TRP 177  -2.849  18.892  -1.901
 1171    HE3  TRP 177           HE3      TRP 177  -7.807  16.905  -1.472
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.796  18.778   0.807
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.824  17.299   0.979
 1174    HH2  TRP 177           HH2      TRP 177  -5.815  18.162   2.135
 1175    H    THR 178           H        THR 178  -6.490  18.488  -6.747
 1176    HA   THR 178           HA       THR 178  -6.098  21.098  -5.735
 1177    HB   THR 178           HB       THR 178  -6.462  21.795  -8.193
 1178    HG1  THR 178           HG1      THR 178  -6.112  19.201  -8.995
 1179   1HG2  THR 178          1HG2      THR 178  -4.226  21.485  -7.326
 1180   2HG2  THR 178          2HG2      THR 178  -4.305  19.747  -7.654
 1181   3HG2  THR 178          3HG2      THR 178  -4.361  20.906  -8.993
 1182    H    LEU 179           H        LEU 179  -8.947  19.788  -7.523
 1183    HA   LEU 179           HA       LEU 179 -10.404  22.198  -7.597
 1184   1HB   LEU 179          1HB       LEU 179 -11.470  19.338  -7.455
 1185   2HB   LEU 179          2HB       LEU 179 -12.398  20.758  -7.938
 1186    HG   LEU 179           HG       LEU 179 -10.011  19.572  -9.390
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.947  19.807 -10.154
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.652  19.084 -11.139
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.105  18.345  -9.592
 1190   1HD2  LEU 179          1HD2      LEU 179  -9.918  21.987  -9.758
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.548  21.212 -11.212
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.667  22.038 -10.100
 1193    H    TYR 180           H        TYR 180 -10.196  19.754  -5.003
 1194    HA   TYR 180           HA       TYR 180 -12.317  20.899  -3.380
 1195   1HB   TYR 180          1HB       TYR 180 -11.790  18.684  -2.886
 1196   2HB   TYR 180          2HB       TYR 180 -10.052  18.954  -2.902
 1197    HD1  TYR 180           HD1      TYR 180 -13.129  20.058  -1.005
 1198    HD2  TYR 180           HD2      TYR 180  -8.907  19.190  -0.876
 1199    HE1  TYR 180           HE1      TYR 180 -13.094  20.535   1.431
 1200    HE2  TYR 180           HE2      TYR 180  -8.913  19.540   1.593
 1201    HH   TYR 180           HH       TYR 180 -11.900  20.400   3.371
 1202    H    LEU 181           H        LEU 181  -8.720  21.085  -3.281
 1203    HA   LEU 181           HA       LEU 181  -8.533  22.948  -1.173
 1204   1HB   LEU 181          1HB       LEU 181  -6.786  22.419  -3.606
 1205   2HB   LEU 181          2HB       LEU 181  -6.367  23.623  -2.421
 1206    HG   LEU 181           HG       LEU 181  -6.749  20.616  -1.911
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.699  20.886  -3.048
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.312  22.405  -2.182
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.257  20.856  -1.340
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.744  21.085   0.363
 1211   2HD2  LEU 181          2HD2      LEU 181  -6.042  22.822   0.040
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.386  21.667   0.137
 1213    H    LYS 182           H        LYS 182  -8.955  23.561  -4.692
 1214    HA   LYS 182           HA       LYS 182  -8.866  26.439  -4.578
 1215   1HB   LYS 182          1HB       LYS 182 -10.188  24.476  -6.501
 1216   2HB   LYS 182          2HB       LYS 182 -10.322  26.223  -6.682
 1217   1HG   LYS 182          1HG       LYS 182  -7.797  26.367  -6.764
 1218   2HG   LYS 182          2HG       LYS 182  -7.757  24.598  -6.845
 1219   1HD   LYS 182          1HD       LYS 182  -9.343  24.759  -8.846
 1220   2HD   LYS 182          2HD       LYS 182  -9.127  26.518  -8.773
 1221   1HE   LYS 182          1HE       LYS 182  -6.592  26.044  -9.008
 1222   2HE   LYS 182          2HE       LYS 182  -7.060  24.384  -9.418
 1223   1HZ   LYS 182          1HZ       LYS 182  -7.712  26.879 -10.873
 1224   2HZ   LYS 182          2HZ       LYS 182  -6.950  25.562 -11.485
 1225   3HZ   LYS 182          3HZ       LYS 182  -8.538  25.485 -11.166
 1226    H    HIS 183           H        HIS 183 -11.592  24.095  -4.309
 1227    HA   HIS 183           HA       HIS 183 -13.683  26.029  -4.035
 1228   1HB   HIS 183          1HB       HIS 183 -14.294  23.774  -4.488
 1229   2HB   HIS 183          2HB       HIS 183 -13.370  23.120  -3.155
 1230    HD1  HIS 183           HD1      HIS 183 -16.766  24.758  -3.797
 1231    HD2  HIS 183           HD2      HIS 183 -14.390  23.243  -0.671
 1232    HE1  HIS 183           HE1      HIS 183 -18.276  24.611  -1.741
 1233    H    VAL 184           H        VAL 184 -11.562  24.426  -1.612
 1234    HA   VAL 184           HA       VAL 184 -12.794  25.518   0.725
 1235    HB   VAL 184           HB       VAL 184 -10.054  24.411   0.086
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.421  24.506   2.435
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.547  26.132   1.763
 1238   3HG1  VAL 184          3HG1      VAL 184 -10.857  25.509   2.804
 1239   1HG2  VAL 184          1HG2      VAL 184 -11.828  22.826   0.307
 1240   2HG2  VAL 184          2HG2      VAL 184 -10.888  22.739   1.785
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.468  23.608   1.761
 1242    H    ALA 185           H        ALA 185 -10.069  26.690  -1.287
 1243    HA   ALA 185           HA       ALA 185  -9.427  28.897   0.354
 1244   1HB   ALA 185          1HB       ALA 185  -9.103  28.584  -2.666
 1245   2HB   ALA 185          2HB       ALA 185  -8.249  29.758  -1.643
 1246   3HB   ALA 185          3HB       ALA 185  -7.955  28.021  -1.431
 1247    H    GLU 186           H        GLU 186 -11.917  28.491  -2.143
 1248    HA   GLU 186           HA       GLU 186 -12.469  31.381  -2.300
 1249   1HB   GLU 186          1HB       GLU 186 -12.493  29.829  -4.274
 1250   2HB   GLU 186          2HB       GLU 186 -13.922  29.035  -3.608
 1251   1HG   GLU 186          1HG       GLU 186 -15.225  31.091  -3.854
 1252   2HG   GLU 186          2HG       GLU 186 -13.773  32.010  -4.268
 1253    H    CYS 187           H        CYS 187 -13.838  28.519  -0.688
 1254    HA   CYS 187           HA       CYS 187 -16.317  30.065  -0.024
 1255   1HB   CYS 187          1HB       CYS 187 -15.766  27.067  -0.151
 1256   2HB   CYS 187          2HB       CYS 187 -17.295  27.783   0.369
 1257    HG   CYS 187           HG       CYS 187 -17.463  26.880  -2.124
 1258    H    HIS 188           H        HIS 188 -13.488  28.633   1.494
 1259    HA   HIS 188           HA       HIS 188 -14.720  29.125   4.187
 1260   1HB   HIS 188          1HB       HIS 188 -13.031  26.699   3.458
 1261   2HB   HIS 188          2HB       HIS 188 -13.757  27.042   5.034
 1262    HD1  HIS 188           HD1      HIS 188 -16.631  27.036   4.952
 1263    HD2  HIS 188           HD2      HIS 188 -14.388  25.287   1.860
 1264    HE1  HIS 188           HE1      HIS 188 -18.202  25.392   3.779
 1265    H    GLN 189           H        GLN 189 -12.443  30.247   2.194
 1266    HA   GLN 189           HA       GLN 189 -10.647  31.009   4.432
 1267   1HB   GLN 189          1HB       GLN 189  -9.881  28.884   2.866
 1268   2HB   GLN 189          2HB       GLN 189  -9.197  30.227   1.942
 1269   1HG   GLN 189          1HG       GLN 189  -7.928  30.968   3.915
 1270   2HG   GLN 189          2HG       GLN 189  -8.744  29.761   4.914
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.085  28.330   5.480
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.044  27.528   4.307
 1273    H    ASP 190           H        ASP 190 -12.664  32.135   2.275
 1274    HA   ASP 190           HA       ASP 190 -11.088  33.989   0.679
 1275   1HB   ASP 190          1HB       ASP 190 -13.273  34.998   0.151
 1276   2HB   ASP 190          2HB       ASP 190 -13.278  33.260  -0.076
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -6.292  31.442 -14.203
    2   2H5*    G   1          2H5*        G   1  -7.252  29.990 -13.883
    3    H4*    G   1           H4*        G   1  -6.400  29.972 -16.157
    4    H3*    G   1           H3*        G   1  -5.070  27.919 -14.376
    5    H2*    G   1           H2*        G   1  -4.131  27.028 -16.440
    6   2HO*    G   1          2HO*        G   1  -6.143  27.709 -17.724
    7    H1*    G   1           H1*        G   1  -3.264  29.449 -17.271
    8    H8     G   1           H8         G   1  -3.010  29.875 -13.545
    9    H1     G   1           H1         G   1   1.771  26.431 -16.112
   10   1H2     G   1          1H2         G   1   1.164  25.611 -18.034
   11   2H2     G   1          2H2         G   1  -0.302  26.151 -18.827
   12   1H5*    G   2          1H5*        G   2  -6.430  25.726 -17.641
   13   2H5*    G   2          2H5*        G   2  -7.240  24.241 -17.138
   14    H4*    G   2           H4*        G   2  -5.490  23.774 -18.771
   15    H3*    G   2           H3*        G   2  -4.840  22.775 -15.986
   16    H2*    G   2           H2*        G   2  -3.011  21.584 -17.060
   17   2HO*    G   2          2HO*        G   2  -4.361  21.284 -19.124
   18    H1*    G   2           H1*        G   2  -2.187  23.773 -18.436
   19    H8     G   2           H8         G   2  -3.526  25.267 -15.236
   20    H1     G   2           H1         G   2   2.213  22.446 -14.544
   21   1H2     G   2          1H2         G   2   2.565  21.070 -16.172
   22   2H2     G   2          2H2         G   2   1.494  20.981 -17.559
   23   1H5*    G   3          1H5*        G   3  -4.420  19.391 -18.398
   24   2H5*    G   3          2H5*        G   3  -5.243  17.995 -17.696
   25    H4*    G   3           H4*        G   3  -2.913  17.464 -18.210
   26    H3*    G   3           H3*        G   3  -3.537  17.638 -15.245
   27    H2*    G   3           H2*        G   3  -1.352  16.661 -14.915
   28   2HO*    G   3          2HO*        G   3  -1.596  15.287 -16.951
   29    H1*    G   3           H1*        G   3  -0.138  18.303 -16.733
   30    H8     G   3           H8         G   3  -2.772  20.453 -15.035
   31    H1     G   3           H1         G   3   2.639  19.685 -11.633
   32   1H2     G   3          1H2         G   3   3.709  17.945 -12.331
   33   2H2     G   3          2H2         G   3   3.237  17.092 -13.787
   34   1H5*    C   4          1H5*        C   4  -1.999  13.766 -15.497
   35   2H5*    C   4          2H5*        C   4  -2.977  12.635 -14.561
   36    H4*    C   4           H4*        C   4  -0.635  12.602 -13.829
   37    H3*    C   4           H3*        C   4  -2.579  13.718 -11.796
   38    H2*    C   4           H2*        C   4  -0.749  13.979 -10.298
   39   2HO*    C   4          2HO*        C   4   0.142  11.789 -11.100
   40    H1*    C   4           H1*        C   4   1.142  14.723 -12.211
   41   1H4     C   4          1H4         C   4  -0.959  19.850  -9.052
   42   2H4     C   4          2H4         C   4  -2.405  19.909 -10.033
   43    H5     C   4           H5         C   4  -2.908  18.288 -11.731
   44    H6     C   4           H6         C   4  -2.127  16.242 -12.813
   45   1H5*    C   5          1H5*        C   5  -1.332  12.274  -8.750
   46   2H5*    C   5          2H5*        C   5  -2.424  11.117  -7.989
   47    H4*    C   5           H4*        C   5  -1.913  13.087  -6.607
   48    H3*    C   5           H3*        C   5  -4.381  11.899  -6.613
   49    H2*    C   5           H2*        C   5  -5.169  13.372  -8.387
   50   2HO*    C   5          2HO*        C   5  -6.525  13.584  -6.296
   51    H1*    C   5           H1*        C   5  -4.109  15.665  -6.797
   52   1H4     C   5          1H4         C   5  -5.893  18.865 -11.953
   53   2H4     C   5          2H4         C   5  -5.551  17.506 -13.004
   54    H5     C   5           H5         C   5  -4.711  15.435 -12.191
   55    H6     C   5           H6         C   5  -4.212  14.134 -10.185
   56   1H5*    A   6          1H5*        A   6  -2.271  15.138  -4.448
   57   2H5*    A   6          2H5*        A   6  -1.089  13.853  -4.210
   58    H4*    A   6           H4*        A   6  -0.366  15.890  -3.339
   59    H3*    A   6           H3*        A   6  -0.721  13.732  -1.344
   60    H2*    A   6           H2*        A   6  -0.355  15.223   0.512
   61   2HO*    A   6          2HO*        A   6   1.381  16.474  -0.022
   62    H1*    A   6           H1*        A   6  -1.628  17.437  -0.418
   63    H8     A   6           H8         A   6  -4.160  15.289  -1.751
   64   1H6     A   6          1H6         A   6  -6.190  14.221   4.015
   65   2H6     A   6          2H6         A   6  -6.498  13.947   2.317
   66    H2     A   6           H2         A   6  -2.291  16.312   4.322
   67   1H5*    U   7          1H5*        U   7   3.060  13.138   0.908
   68   2H5*    U   7          2H5*        U   7   2.025  14.445   0.360
   69    H4*    U   7           H4*        U   7   3.807  15.300   1.715
   70    H3*    U   7           H3*        U   7   3.134  16.496  -0.700
   71    H2*    U   7           H2*        U   7   4.889  15.384  -1.884
   72   2HO*    U   7          2HO*        U   7   5.652  17.946  -0.981
   73    H1*    U   7           H1*        U   7   6.726  16.000   0.461
   74    H3     U   7           H3         U   7  10.316  14.260  -1.560
   75    H5     U   7           H5         U   7   7.515  11.157  -1.646
   76    H6     U   7           H6         U   7   5.784  12.764  -0.996
   77   1H5*    A   8          1H5*        A   8   4.006  20.171  -0.682
   78   2H5*    A   8          2H5*        A   8   3.264  21.029   0.669
   79    H4*    A   8           H4*        A   8   2.552  22.120  -1.282
   80    H3*    A   8           H3*        A   8   0.687  21.190   0.483
   81    H2*    A   8           H2*        A   8   0.282  19.196  -0.831
   82   2HO*    A   8          2HO*        A   8  -1.784  20.176  -0.360
   83    H1*    A   8           H1*        A   8   0.122  21.106  -3.160
   84    H8     A   8           H8         A   8   2.234  17.903  -2.948
   85   1H6     A   8          1H6         A   8  -1.373  15.894  -7.565
   86   2H6     A   8          2H6         A   8   0.164  15.688  -6.762
   87    H2     A   8           H2         A   8  -3.236  19.555  -5.868
   88   1H5*    C   9          1H5*        C   9  -2.561  22.604  -0.378
   89   2H5*    C   9          2H5*        C   9  -2.836  24.122   0.486
   90    H4*    C   9           H4*        C   9  -4.413  22.535   1.273
   91    H3*    C   9           H3*        C   9  -2.272  23.041   3.324
   92    H2*    C   9           H2*        C   9  -3.547  21.595   4.791
   93   2HO*    C   9          2HO*        C   9  -5.647  22.431   3.625
   94    H1*    C   9           H1*        C   9  -3.963  19.641   2.936
   95   1H4     C   9          1H4         C   9   1.691  18.432   5.767
   96   2H4     C   9          2H4         C   9   2.483  18.983   4.303
   97    H5     C   9           H5         C   9   1.326  20.165   2.581
   98    H6     C   9           H6         C   9  -0.860  20.903   1.795
   99   1H5*    C  10          1H5*        C  10  -5.646  23.289   5.462
  100   2H5*    C  10          2H5*        C  10  -5.768  24.701   6.512
  101    H4*    C  10           H4*        C  10  -5.961  22.611   7.793
  102    H3*    C  10           H3*        C  10  -3.398  24.152   8.327
  103    H2*    C  10           H2*        C  10  -3.078  22.619  10.154
  104   2HO*    C  10          2HO*        C  10  -5.442  22.477  10.665
  105    H1*    C  10           H1*        C  10  -3.675  20.407   8.615
  106   1H4     C  10          1H4         C  10   2.592  20.996   7.976
  107   2H4     C  10          2H4         C  10   2.354  21.862   6.475
  108    H5     C  10           H5         C  10   0.201  22.609   5.713
  109    H6     C  10           H6         C  10  -2.190  22.639   6.242
  110   1H5*    U  11          1H5*        U  11  -4.699  24.420  12.248
  111   2H5*    U  11          2H5*        U  11  -4.250  25.996  12.914
  112    H4*    U  11           H4*        U  11  -3.084  23.983  13.905
  113    H3*    U  11           H3*        U  11  -1.421  26.141  12.614
  114    H2*    U  11           H2*        U  11   0.457  25.102  13.684
  115   2HO*    U  11          2HO*        U  11  -0.856  24.584  15.689
  116    H1*    U  11           H1*        U  11  -0.377  22.554  13.056
  117    H3     U  11           H3         U  11   3.293  23.394  10.440
  118    H5     U  11           H5         U  11   0.177  25.381   8.468
  119    H6     U  11           H6         U  11  -1.283  24.873  10.376
  120   1H5*    C  12          1H5*        C  12   0.291  26.978  16.847
  121   2H5*    C  12          2H5*        C  12   1.280  28.324  16.278
  122    H4*    C  12           H4*        C  12   1.786  25.355  16.237
  123    H3*    C  12           H3*        C  12   2.895  27.425  17.638
  124    H2*    C  12           H2*        C  12   3.562  28.633  15.684
  125   2HO*    C  12          2HO*        C  12   5.515  27.654  17.167
  126    H1*    C  12           H1*        C  12   4.707  26.043  14.591
  127   1H4     C  12          1H4         C  12   5.708  30.042   9.735
  128   2H4     C  12          2H4         C  12   4.039  30.555   9.740
  129    H5     C  12           H5         C  12   2.427  29.764  11.332
  130    H6     C  12           H6         C  12   2.091  28.301  13.271
  131   1H5*    U  13          1H5*        U  13   3.921  22.910  18.558
  132   2H5*    U  13          2H5*        U  13   4.709  22.890  20.137
  133    H4*    U  13           H4*        U  13   5.747  21.064  19.230
  134    H3*    U  13           H3*        U  13   7.552  23.198  19.166
  135    H2*    U  13           H2*        U  13   6.963  23.761  16.897
  136   2HO*    U  13          2HO*        U  13   9.241  22.052  16.938
  137    H1*    U  13           H1*        U  13   7.127  20.764  16.340
  138    H3     U  13           H3         U  13   6.882  21.654  11.896
  139    H5     U  13           H5         U  13   3.928  24.143  13.489
  140    H6     U  13           H6         U  13   4.572  23.387  15.736
  141   1H5*    U  14          1H5*        U  14  10.157  18.318  19.717
  142   2H5*    U  14          2H5*        U  14  11.639  19.080  19.141
  143    H4*    U  14           H4*        U  14   8.957  18.952  17.721
  144    H3*    U  14           H3*        U  14  11.300  17.277  17.626
  145    H2*    U  14           H2*        U  14  12.508  18.848  16.393
  146   2HO*    U  14          2HO*        U  14  11.000  17.248  14.596
  147    H1*    U  14           H1*        U  14   9.888  19.628  15.030
  148    H3     U  14           H3         U  14  12.346  22.115  12.093
  149    H5     U  14           H5         U  14  13.834  23.304  15.818
  150    H6     U  14           H6         U  14  12.402  21.607  16.874
  151   1H5*    G  15          1H5*        G  15   6.519  14.859  15.827
  152   2H5*    G  15          2H5*        G  15   7.089  16.367  15.090
  153    H4*    G  15           H4*        G  15   4.943  16.420  17.224
  154    H3*    G  15           H3*        G  15   4.580  15.824  14.279
  155    H2*    G  15           H2*        G  15   2.372  16.794  14.552
  156   2HO*    G  15          2HO*        G  15   2.151  16.002  16.855
  157    H1*    G  15           H1*        G  15   3.377  18.988  15.780
  158    H8     G  15           H8         G  15   6.241  18.269  13.507
  159    H1     G  15           H1         G  15   1.069  20.398  10.339
  160   1H2     G  15          1H2         G  15  -0.696  20.158  11.560
  161   2H2     G  15          2H2         G  15  -0.602  19.703  13.250
  162   1H5*    G  16          1H5*        G  16   0.920  14.565  15.794
  163   2H5*    G  16          2H5*        G  16   0.509  12.957  15.191
  164    H4*    G  16           H4*        G  16  -1.312  14.511  14.805
  165    H3*    G  16           H3*        G  16   0.085  13.676  12.248
  166    H2*    G  16           H2*        G  16  -1.787  14.749  11.132
  167   2HO*    G  16          2HO*        G  16  -3.361  14.076  12.873
  168    H1*    G  16           H1*        G  16  -1.641  16.995  12.648
  169    H8     G  16           H8         G  16   1.983  16.090  12.459
  170    H1     G  16           H1         G  16  -0.313  17.861   6.746
  171   1H2     G  16          1H2         G  16  -2.466  18.164   6.839
  172   2H2     G  16          2H2         G  16  -3.385  17.728   8.266
  173   1H5*    G  17          1H5*        G  17  -3.723  12.643  11.139
  174   2H5*    G  17          2H5*        G  17  -3.740  11.092  10.291
  175    H4*    G  17           H4*        G  17  -4.571  12.936   8.897
  176    H3*    G  17           H3*        G  17  -1.973  11.720   7.919
  177    H2*    G  17           H2*        G  17  -2.316  13.133   5.939
  178   2HO*    G  17          2HO*        G  17  -4.726  12.915   6.102
  179    H1*    G  17           H1*        G  17  -2.650  15.360   7.343
  180    H8     G  17           H8         G  17  -0.484  13.604   9.801
  181    H1     G  17           H1         G  17   2.704  15.843   4.694
  182   1H2     G  17          1H2         G  17   1.311  16.370   3.112
  183   2H2     G  17          2H2         G  17  -0.407  16.026   3.244
  184   1H5*    C  18          1H5*        C  18  -3.777  11.441   4.413
  185   2H5*    C  18          2H5*        C  18  -3.588   9.859   3.640
  186    H4*    C  18           H4*        C  18  -2.577  11.562   2.253
  187    H3*    C  18           H3*        C  18  -0.421   9.962   3.654
  188    H2*    C  18           H2*        C  18   1.134  11.136   2.095
  189   2HO*    C  18          2HO*        C  18   0.025  11.642   0.214
  190    H1*    C  18           H1*        C  18   0.209  13.457   2.850
  191   1H4     C  18          1H4         C  18   4.264  11.917   7.492
  192   2H4     C  18          2H4         C  18   2.916  11.435   8.492
  193    H5     C  18           H5         C  18   0.646  11.396   7.714
  194    H6     C  18           H6         C  18  -0.774  11.710   5.762
  195   1H5*    C  19          1H5*        C  19   0.912   9.789  -0.065
  196   2H5*    C  19          2H5*        C  19   1.333   8.150  -0.586
  197    H4*    C  19           H4*        C  19   3.142   9.699  -1.036
  198    H3*    C  19           H3*        C  19   3.761   7.753   1.214
  199    H2*    C  19           H2*        C  19   6.047   8.521   0.945
  200   2HO*    C  19          2HO*        C  19   5.605   8.864  -1.499
  201    H1*    C  19           H1*        C  19   5.355  11.153   0.972
  202   1H4     C  19          1H4         C  19   6.191   9.381   7.057
  203   2H4     C  19          2H4         C  19   4.503   8.942   7.181
  204    H5     C  19           H5         C  19   2.998   8.955   5.317
  205    H6     C  19           H6         C  19   2.781   9.516   2.945
  206   1H5*    U  20          1H5*        U  20   6.834   7.269  -1.287
  207   2H5*    U  20          2H5*        U  20   7.157   5.591  -1.697
  208    H4*    U  20           H4*        U  20   9.172   6.603  -0.881
  209    H3*    U  20           H3*        U  20   7.958   4.720   1.170
  210    H2*    U  20           H2*        U  20  10.135   4.855   2.220
  211   2HO*    U  20          2HO*        U  20  11.341   5.036   0.117
  212    H1*    U  20           H1*        U  20  10.181   7.575   2.015
  213    H3     U  20           H3         U  20   9.216   6.582   6.384
  214    H5     U  20           H5         U  20   5.514   6.354   4.455
  215    H6     U  20           H6         U  20   6.678   6.601   2.303
  216   1H5*    G  21          1H5*        G  21  11.681   3.072   0.205
  217   2H5*    G  21          2H5*        G  21  11.647   1.310   0.196
  218    H4*    G  21           H4*        G  21  13.381   2.161   1.663
  219    H3*    G  21           H3*        G  21  11.135   0.901   3.275
  220    H2*    G  21           H2*        G  21  12.747   1.027   5.101
  221   2HO*    G  21          2HO*        G  21  14.661   0.737   3.528
  222    H1*    G  21           H1*        G  21  13.276   3.635   4.585
  223    H8     G  21           H8         G  21   9.640   3.175   3.562
  224    H1     G  21           H1         G  21  10.512   3.309   9.936
  225   1H2     G  21          1H2         G  21  12.603   3.045  10.404
  226   2H2     G  21          2H2         G  21  13.836   3.005   9.160
  227   1H5*    G  22          1H5*        G  22  14.534  -1.003   4.381
  228   2H5*    G  22          2H5*        G  22  14.380  -2.754   4.461
  229    H4*    G  22           H4*        G  22  15.362  -1.872   6.492
  230    H3*    G  22           H3*        G  22  12.569  -2.971   6.925
  231    H2*    G  22           H2*        G  22  13.013  -2.729   9.267
  232   2HO*    G  22          2HO*        G  22  15.296  -3.367   9.170
  233    H1*    G  22           H1*        G  22  14.047  -0.215   9.010
  234    H8     G  22           H8         G  22  11.336  -0.277   6.386
  235    H1     G  22           H1         G  22   9.049   0.123  12.392
  236   1H2     G  22          1H2         G  22  10.589  -0.394  13.811
  237   2H2     G  22          2H2         G  22  12.242  -0.712  13.319
  238   1H5*    U  23          1H5*        U  23  12.331  -7.172   9.343
  239   2H5*    U  23          2H5*        U  23  11.408  -5.702   8.951
  240    H4*    U  23           H4*        U  23  13.052  -6.029  11.464
  241    H3*    U  23           H3*        U  23  10.091  -6.207  10.799
  242    H2*    U  23           H2*        U  23   9.660  -5.638  13.066
  243   2HO*    U  23          2HO*        U  23  11.642  -6.728  13.941
  244    H1*    U  23           H1*        U  23  11.299  -3.480  12.906
  245    H3     U  23           H3         U  23   6.747  -2.508  12.305
  246    H5     U  23           H5         U  23   8.372  -2.809   8.465
  247    H6     U  23           H6         U  23  10.482  -3.574   9.472
  248   1H5*    U  24          1H5*        U  24   9.904  -8.275  13.776
  249   2H5*    U  24          2H5*        U  24   9.261  -9.917  13.709
  250    H4*    U  24           H4*        U  24   7.964  -8.598  15.265
  251    H3*    U  24           H3*        U  24   6.497  -9.077  12.668
  252    H2*    U  24           H2*        U  24   4.544  -8.245  13.701
  253   2HO*    U  24          2HO*        U  24   4.948  -9.191  15.861
  254    H1*    U  24           H1*        U  24   5.882  -6.101  14.813
  255    H3     U  24           H3         U  24   3.247  -4.728  11.247
  256    H5     U  24           H5         U  24   6.849  -5.967   9.500
  257    H6     U  24           H6         U  24   7.595  -6.761  11.701
  258   1H5*    A  25          1H5*        A  25   5.002 -13.121  11.501
  259   2H5*    A  25          2H5*        A  25   6.693 -13.478  11.210
  260    H4*    A  25           H4*        A  25   5.686 -13.063   9.096
  261    H3*    A  25           H3*        A  25   7.892 -11.468   9.823
  262    H2*    A  25           H2*        A  25   6.516  -9.598  10.393
  263   2HO*    A  25          2HO*        A  25   8.040  -8.792   8.923
  264    H1*    A  25           H1*        A  25   5.012 -10.427   7.839
  265    H8     A  25           H8         A  25   3.627  -9.326  11.329
  266   1H6     A  25          1H6         A  25   0.642  -4.988   7.977
  267   2H6     A  25          2H6         A  25   0.661  -5.846   9.507
  268    H2     A  25           H2         A  25   3.621  -7.000   5.349
  269   1H5*    G  26          1H5*        G  26   7.868 -14.768   4.981
  270   2H5*    G  26          2H5*        G  26   7.854 -13.062   4.622
  271    H4*    G  26           H4*        G  26   5.820 -13.518   6.627
  272    H3*    G  26           H3*        G  26   6.108 -15.909   5.103
  273    H2*    G  26           H2*        G  26   5.948 -14.531   3.159
  274   2HO*    G  26          2HO*        G  26   3.475 -15.918   3.591
  275    H1*    G  26           H1*        G  26   3.467 -13.483   4.598
  276    H8     G  26           H8         G  26   5.486 -13.340   1.363
  277    H1     G  26           H1         G  26   0.913  -8.891   1.796
  278   1H2     G  26          1H2         G  26   0.476  -8.540   3.880
  279   2H2     G  26          2H2         G  26   1.022  -9.620   5.151
  280   1H5*    U  27          1H5*        U  27   4.807 -16.188   8.312
  281   2H5*    U  27          2H5*        U  27   4.073 -17.754   8.725
  282    H4*    U  27           H4*        U  27   3.820 -16.603  10.711
  283    H3*    U  27           H3*        U  27   1.271 -15.939   9.170
  284    H2*    U  27           H2*        U  27   0.644 -14.505  10.978
  285   2HO*    U  27          2HO*        U  27   1.792 -16.103  12.555
  286    H1*    U  27           H1*        U  27   3.024 -13.275  11.265
  287    H3     U  27           H3         U  27   0.338 -10.397   8.905
  288    H5     U  27           H5         U  27   3.127 -12.008   6.260
  289    H6     U  27           H6         U  27   3.468 -13.863   7.834
  290   1H5*    A  28          1H5*        A  28  -0.327 -15.973  12.877
  291   2H5*    A  28          2H5*        A  28  -1.579 -17.210  12.953
  292    H4*    A  28           H4*        A  28  -2.521 -15.099  13.649
  293    H3*    A  28           H3*        A  28  -3.487 -15.949  10.890
  294    H2*    A  28           H2*        A  28  -4.951 -14.027  10.986
  295   2HO*    A  28          2HO*        A  28  -5.267 -14.323  13.415
  296    H1*    A  28           H1*        A  28  -3.032 -12.328  11.892
  297    H8     A  28           H8         A  28  -0.900 -14.312   9.610
  298   1H6     A  28          1H6         A  28  -3.261 -10.819   5.032
  299   2H6     A  28          2H6         A  28  -1.999 -11.966   5.445
  300    H2     A  28           H2         A  28  -6.151 -10.820   8.393
  301   1H5*    C  29          1H5*        C  29  -7.042 -15.204  12.132
  302   2H5*    C  29          2H5*        C  29  -8.226 -16.472  11.791
  303    H4*    C  29           H4*        C  29  -8.775 -14.466  10.541
  304    H3*    C  29           H3*        C  29  -7.713 -16.674   8.761
  305    H2*    C  29           H2*        C  29  -8.293 -15.203   6.897
  306   2HO*    C  29          2HO*        C  29 -10.274 -14.360   8.055
  307    H1*    C  29           H1*        C  29  -7.173 -13.021   7.954
  308   1H4     C  29          1H4         C  29  -2.429 -15.862   4.790
  309   2H4     C  29          2H4         C  29  -1.901 -16.620   6.274
  310    H5     C  29           H5         C  29  -3.156 -16.548   8.309
  311    H6     C  29           H6         C  29  -5.173 -15.659   9.360
  312   1H5*    C  30          1H5*        C  30 -11.371 -15.854   6.938
  313   2H5*    C  30          2H5*        C  30 -12.205 -17.327   6.430
  314    H4*    C  30           H4*        C  30 -11.742 -15.847   4.528
  315    H3*    C  30           H3*        C  30 -10.067 -18.374   4.476
  316    H2*    C  30           H2*        C  30  -9.472 -17.676   2.226
  317   2HO*    C  30          2HO*        C  30 -11.730 -16.651   1.927
  318    H1*    C  30           H1*        C  30  -8.989 -15.094   3.006
  319   1H4     C  30          1H4         C  30  -3.627 -18.564   3.335
  320   2H4     C  30          2H4         C  30  -3.982 -19.003   4.992
  321    H5     C  30           H5         C  30  -6.008 -18.371   6.116
  322    H6     C  30           H6         C  30  -8.151 -17.215   5.840
  323   1H5*    U  31          1H5*        U  31 -12.197 -18.117   0.741
  324   2H5*    U  31          2H5*        U  31 -13.110 -19.592   0.422
  325    H4*    U  31           H4*        U  31 -12.041 -18.817  -1.602
  326    H3*    U  31           H3*        U  31 -10.765 -21.345  -0.539
  327    H2*    U  31           H2*        U  31  -9.556 -21.425  -2.608
  328   2HO*    U  31          2HO*        U  31 -11.457 -20.563  -3.873
  329    H1*    U  31           H1*        U  31  -8.905 -18.766  -2.585
  330    H3     U  31           H3         U  31  -5.047 -21.053  -1.495
  331    H5     U  31           H5         U  31  -7.012 -20.382   2.147
  332    H6     U  31           H6         U  31  -9.002 -19.688   0.895
  333   1H5*    C  32          1H5*        C  32 -11.909 -22.767  -4.058
  334   2H5*    C  32          2H5*        C  32 -12.633 -24.378  -4.007
  335    H4*    C  32           H4*        C  32 -10.582 -24.427  -5.307
  336    H3*    C  32           H3*        C  32 -10.212 -25.786  -2.616
  337    H2*    C  32           H2*        C  32  -8.016 -26.392  -3.412
  338   2HO*    C  32          2HO*        C  32  -8.954 -26.661  -5.719
  339    H1*    C  32           H1*        C  32  -7.491 -23.928  -4.534
  340   1H4     C  32          1H4         C  32  -5.025 -24.166   1.347
  341   2H4     C  32          2H4         C  32  -6.575 -23.775   2.057
  342    H5     C  32           H5         C  32  -8.574 -23.473   0.766
  343    H6     C  32           H6         C  32  -9.507 -23.557  -1.498
  344   1H5*    U  33          1H5*        U  33  -8.332 -28.465  -4.614
  345   2H5*    U  33          2H5*        U  33  -9.038 -30.077  -4.477
  346    H4*    U  33           H4*        U  33  -6.718 -30.240  -3.825
  347    H3*    U  33           H3*        U  33  -8.567 -30.245  -1.419
  348    H2*    U  33           H2*        U  33  -6.772 -30.595  -0.070
  349   2HO*    U  33          2HO*        U  33  -4.810 -31.207  -2.074
  350    H1*    U  33           H1*        U  33  -4.948 -29.090  -1.624
  351    H3     U  33           H3         U  33  -4.901 -27.261   2.560
  352    H5     U  33           H5         U  33  -8.834 -26.615   1.295
  353    H6     U  33           H6         U  33  -8.300 -27.775  -0.802
  354   1H5*    U  34          1H5*        U  34  -8.726 -35.799  -0.412
  355   2H5*    U  34          2H5*        U  34  -7.908 -34.764   0.761
  356    H4*    U  34           H4*        U  34  -6.808 -36.928   0.557
  357    H3*    U  34           H3*        U  34  -5.362 -34.600   0.647
  358    H2*    U  34           H2*        U  34  -5.276 -34.390  -1.750
  359   2HO*    U  34          2HO*        U  34  -3.105 -34.175  -1.140
  360    H1*    U  34           H1*        U  34  -4.529 -37.335  -1.803
  361    H3     U  34           H3         U  34  -3.824 -37.225  -6.261
  362    H5     U  34           H5         U  34  -7.160 -34.735  -5.835
  363    H6     U  34           H6         U  34  -7.060 -35.106  -3.407
  364   1H5*    C  35          1H5*        C  35  -1.929 -34.765   1.379
  365   2H5*    C  35          2H5*        C  35  -1.549 -35.623   2.873
  366    H4*    C  35           H4*        C  35  -0.553 -33.405   2.830
  367    H3*    C  35           H3*        C  35  -1.736 -34.413   5.081
  368    H2*    C  35           H2*        C  35  -3.878 -33.459   4.600
  369   2HO*    C  35          2HO*        C  35  -2.411 -31.701   6.296
  370    H1*    C  35           H1*        C  35  -2.540 -30.821   3.909
  371   1H4     C  35          1H4         C  35  -8.745 -29.972   2.653
  372   2H4     C  35          2H4         C  35  -8.736 -31.311   1.518
  373    H5     C  35           H5         C  35  -6.850 -32.737   1.226
  374    H6     C  35           H6         C  35  -4.480 -33.027   1.727
  375   1H5*    G  36          1H5*        G  36   2.741 -31.133   4.994
  376   2H5*    G  36          2H5*        G  36   1.193 -31.215   4.137
  377    H4*    G  36           H4*        G  36   3.746 -32.626   3.273
  378    H3*    G  36           H3*        G  36   2.263 -30.203   2.191
  379    H2*    G  36           H2*        G  36   3.050 -30.823   0.043
  380   2HO*    G  36          2HO*        G  36   5.285 -31.307   1.127
  381    H1*    G  36           H1*        G  36   3.092 -33.607   0.626
  382    H8     G  36           H8         G  36   1.753 -34.156  -1.566
  383    H1     G  36           H1         G  36  -2.862 -29.888  -0.166
  384   1H2     G  36          1H2         G  36  -2.399 -28.831   1.631
  385   2H2     G  36          2H2         G  36  -0.914 -29.092   2.520
  386   1H5*    G  37          1H5*        G  37   4.816 -29.255   0.146
  387   2H5*    G  37          2H5*        G  37   5.286 -27.558   0.049
  388    H4*    G  37           H4*        G  37   3.960 -28.536  -1.911
  389    H3*    G  37           H3*        G  37   2.859 -26.069  -0.513
  390    H2*    G  37           H2*        G  37   1.312 -26.039  -2.431
  391   2HO*    G  37          2HO*        G  37   3.068 -27.056  -3.906
  392    H1*    G  37           H1*        G  37   0.668 -28.635  -2.157
  393    H8     G  37           H8         G  37   1.454 -27.249   1.338
  394    H1     G  37           H1         G  37  -4.146 -25.224  -1.074
  395   1H2     G  37          1H2         G  37  -4.317 -25.828  -3.139
  396   2H2     G  37          2H2         G  37  -3.165 -26.910  -3.892
  397   1H5*    U  38          1H5*        U  38   2.332 -25.185  -4.379
  398   2H5*    U  38          2H5*        U  38   3.017 -23.666  -4.930
  399    H4*    U  38           H4*        U  38   0.692 -23.873  -5.588
  400    H3*    U  38           H3*        U  38   1.095 -21.759  -3.493
  401    H2*    U  38           H2*        U  38  -1.131 -21.015  -4.030
  402   2HO*    U  38          2HO*        U  38  -1.098 -21.451  -6.335
  403    H1*    U  38           H1*        U  38  -2.151 -23.532  -3.849
  404    H3     U  38           H3         U  38  -3.253 -21.626   0.180
  405    H5     U  38           H5         U  38   0.641 -23.042   0.726
  406    H6     U  38           H6         U  38   0.748 -23.523  -1.672
  407   1H5*    G  39          1H5*        G  39   0.043 -19.552  -6.819
  408   2H5*    G  39          2H5*        G  39   0.896 -18.012  -6.863
  409    H4*    G  39           H4*        G  39  -1.472 -17.676  -6.948
  410    H3*    G  39           H3*        G  39  -0.454 -16.825  -4.233
  411    H2*    G  39           H2*        G  39  -2.710 -15.909  -3.963
  412   2HO*    G  39          2HO*        G  39  -2.911 -15.430  -6.382
  413    H1*    G  39           H1*        G  39  -3.854 -18.233  -4.709
  414    H8     G  39           H8         G  39  -0.495 -19.117  -3.083
  415    H1     G  39           H1         G  39  -5.099 -17.531   1.109
  416   1H2     G  39          1H2         G  39  -6.745 -16.596   0.068
  417   2H2     G  39          2H2         G  39  -6.835 -16.553  -1.679
  418   1H5*    G  40          1H5*        G  40  -2.549 -13.630  -5.705
  419   2H5*    G  40          2H5*        G  40  -1.801 -12.070  -5.328
  420    H4*    G  40           H4*        G  40  -4.159 -12.110  -4.711
  421    H3*    G  40           H3*        G  40  -2.152 -11.829  -2.449
  422    H2*    G  40           H2*        G  40  -4.090 -11.510  -1.004
  423   2HO*    G  40          2HO*        G  40  -5.280 -10.325  -2.853
  424    H1*    G  40           H1*        G  40  -5.511 -13.565  -2.008
  425    H8     G  40           H8         G  40  -1.992 -14.883  -2.202
  426    H1     G  40           H1         G  40  -4.207 -14.540   3.819
  427   1H2     G  40          1H2         G  40  -6.005 -13.346   3.888
  428   2H2     G  40          2H2         G  40  -6.702 -12.633   2.448
  429   1H5*    G  41          1H5*        G  41  -4.460  -9.297  -0.943
  430   2H5*    G  41          2H5*        G  41  -3.687  -7.753  -0.588
  431    H4*    G  41           H4*        G  41  -4.415  -8.702   1.496
  432    H3*    G  41           H3*        G  41  -1.421  -9.028   1.148
  433    H2*    G  41           H2*        G  41  -1.434  -9.722   3.500
  434   2HO*    G  41          2HO*        G  41  -3.229  -8.415   4.256
  435    H1*    G  41           H1*        G  41  -3.367 -11.546   3.048
  436    H8     G  41           H8         G  41  -1.613 -11.306  -0.310
  437    H1     G  41           H1         G  41   1.465 -14.994   3.957
  438   1H2     G  41          1H2         G  41   0.701 -14.674   5.932
  439   2H2     G  41          2H2         G  41  -0.611 -13.564   6.282
  440   1H5*    A  42          1H5*        A  42  -0.363  -5.018   4.664
  441   2H5*    A  42          2H5*        A  42  -0.220  -6.348   5.821
  442    H4*    A  42           H4*        A  42  -2.778  -5.380   4.488
  443    H3*    A  42           H3*        A  42  -1.753  -5.467   7.335
  444    H2*    A  42           H2*        A  42  -4.016  -5.807   8.095
  445   2HO*    A  42          2HO*        A  42  -4.907  -4.424   6.229
  446    H1*    A  42           H1*        A  42  -4.507  -7.831   6.416
  447    H8     A  42           H8         A  42  -0.978  -8.636   6.536
  448   1H6     A  42          1H6         A  42  -1.639 -10.405  12.468
  449   2H6     A  42          2H6         A  42  -0.644 -10.557  11.039
  450    H2     A  42           H2         A  42  -5.267  -8.139  11.319
  451   1H5*    A  43          1H5*        A  43  -4.504  -2.967   7.668
  452   2H5*    A  43          2H5*        A  43  -4.527  -1.368   8.369
  453    H4*    A  43           H4*        A  43  -5.896  -2.817   9.722
  454    H3*    A  43           H3*        A  43  -3.243  -2.278  11.114
  455    H2*    A  43           H2*        A  43  -4.024  -3.671  12.924
  456   2HO*    A  43          2HO*        A  43  -6.338  -2.805  12.559
  457    H1*    A  43           H1*        A  43  -5.054  -5.646  11.295
  458    H8     A  43           H8         A  43  -2.011  -4.810   9.391
  459   1H6     A  43          1H6         A  43   1.180  -8.285  13.407
  460   2H6     A  43          2H6         A  43   1.181  -7.591  11.797
  461    H2     A  43           H2         A  43  -2.725  -7.287  15.276
  462   1H5*    U  44          1H5*        U  44  -5.275  -1.721  14.269
  463   2H5*    U  44          2H5*        U  44  -4.915  -0.203  15.108
  464    H4*    U  44           H4*        U  44  -4.200  -2.053  16.492
  465    H3*    U  44           H3*        U  44  -1.867  -0.613  15.194
  466    H2*    U  44           H2*        U  44  -0.451  -1.959  16.592
  467   2HO*    U  44          2HO*        U  44  -2.099  -1.879  18.431
  468    H1*    U  44           H1*        U  44  -1.799  -4.283  16.107
  469    H3     U  44           H3         U  44   2.022  -4.705  13.601
  470    H5     U  44           H5         U  44  -0.505  -2.356  11.235
  471    H6     U  44           H6         U  44  -2.013  -2.142  13.154
  472   1H5*    A  45          1H5*        A  45  -0.901  -0.419  19.214
  473   2H5*    A  45          2H5*        A  45  -0.156   1.126  19.639
  474    H4*    A  45           H4*        A  45   1.343  -0.742  20.102
  475    H3*    A  45           H3*        A  45   2.307   0.959  17.773
  476    H2*    A  45           H2*        A  45   4.353  -0.313  17.972
  477   2HO*    A  45          2HO*        A  45   4.065  -0.534  20.428
  478    H1*    A  45           H1*        A  45   3.054  -2.694  18.021
  479    H8     A  45           H8         A  45   0.918  -0.348  15.896
  480   1H6     A  45          1H6         A  45   4.667  -1.850  11.164
  481   2H6     A  45          2H6         A  45   3.134  -1.125  11.604
  482    H2     A  45           H2         A  45   6.474  -3.414  14.893
  483   1H5*    C  46          1H5*        C  46   5.396   0.880  20.477
  484   2H5*    C  46          2H5*        C  46   6.129   2.467  20.713
  485    H4*    C  46           H4*        C  46   7.802   0.813  20.120
  486    H3*    C  46           H3*        C  46   7.317   2.820  17.885
  487    H2*    C  46           H2*        C  46   9.351   1.917  16.954
  488   2HO*    C  46          2HO*        C  46  10.322   1.546  19.189
  489    H1*    C  46           H1*        C  46   8.567  -0.676  17.385
  490   1H4     C  46          1H4         C  46   6.551   0.881  11.539
  491   2H4     C  46          2H4         C  46   5.017   1.413  12.192
  492    H5     C  46           H5         C  46   4.565   1.553  14.546
  493    H6     C  46           H6         C  46   5.505   1.179  16.780
  494   1H5*    C  47          1H5*        C  47  11.331   3.217  18.854
  495   2H5*    C  47          2H5*        C  47  11.823   4.913  18.900
  496    H4*    C  47           H4*        C  47  13.233   3.633  17.382
  497    H3*    C  47           H3*        C  47  11.387   5.549  15.929
  498    H2*    C  47           H2*        C  47  12.821   5.101  14.019
  499   2HO*    C  47          2HO*        C  47  14.829   4.903  15.369
  500    H1*    C  47           H1*        C  47  12.784   2.396  14.472
  501   1H4     C  47          1H4         C  47   7.961   3.610  10.486
  502   2H4     C  47          2H4         C  47   6.896   3.948  11.832
  503    H5     C  47           H5         C  47   7.635   4.008  14.117
  504    H6     C  47           H6         C  47   9.576   3.726  15.590
  505   1H5*    A  48          1H5*        A  48  15.376   6.760  15.031
  506   2H5*    A  48          2H5*        A  48  15.518   8.518  14.969
  507    H4*    A  48           H4*        A  48  16.376   7.488  12.934
  508    H3*    A  48           H3*        A  48  13.797   9.009  12.468
  509    H2*    A  48           H2*        A  48  14.332   8.724  10.103
  510   2HO*    A  48          2HO*        A  48  16.764   8.809  10.545
  511    H1*    A  48           H1*        A  48  14.778   6.069  10.402
  512    H8     A  48           H8         A  48  12.147   6.897  13.010
  513   1H6     A  48          1H6         A  48   7.977   6.571   8.406
  514   2H6     A  48          2H6         A  48   8.197   6.672  10.140
  515    H2     A  48           H2         A  48  12.028   6.558   6.588
  516   1H5*    G  49          1H5*        G  49  16.581  10.634   9.864
  517   2H5*    G  49          2H5*        G  49  16.505  12.390   9.749
  518    H4*    G  49           H4*        G  49  16.400  11.345   7.552
  519    H3*    G  49           H3*        G  49  13.772  12.654   8.341
  520    H2*    G  49           H2*        G  49  13.167  12.256   6.001
  521   2HO*    G  49          2HO*        G  49  15.569  12.522   5.319
  522    H1*    G  49           H1*        G  49  13.963   9.676   6.076
  523    H8     G  49           H8         G  49  12.754  10.236   9.606
  524    H1     G  49           H1         G  49   7.972   9.894   5.319
  525   1H2     G  49          1H2         G  49   8.739  10.236   3.330
  526   2H2     G  49          2H2         G  49  10.458  10.306   3.000
  527   1H5*    G  50          1H5*        G  50  14.523  14.065   4.620
  528   2H5*    G  50          2H5*        G  50  14.404  15.814   4.474
  529    H4*    G  50           H4*        G  50  13.089  14.666   2.754
  530    H3*    G  50           H3*        G  50  11.398  16.158   4.794
  531    H2*    G  50           H2*        G  50   9.533  15.663   3.287
  532   2HO*    G  50          2HO*        G  50  11.106  15.805   1.335
  533    H1*    G  50           H1*        G  50  10.247  13.048   2.965
  534    H8     G  50           H8         G  50  11.174  13.513   6.557
  535    H1     G  50           H1         G  50   4.819  13.103   5.592
  536   1H2     G  50          1H2         G  50   4.381  13.297   3.504
  537   2H2     G  50          2H2         G  50   5.609  13.712   2.327
  538   1H5*    U  51          1H5*        U  51  10.069  17.421   1.191
  539   2H5*    U  51          2H5*        U  51  10.216  19.150   0.874
  540    H4*    U  51           H4*        U  51   7.983  18.361   0.305
  541    H3*    U  51           H3*        U  51   8.510  20.559   1.983
  542    H2*    U  51           H2*        U  51   7.821  19.622   3.922
  543   2HO*    U  51          2HO*        U  51   5.123  19.977   3.066
  544    H1*    U  51           H1*        U  51   5.697  17.953   2.582
  545    H3     U  51           H3         U  51   4.605  16.318   6.587
  546    H5     U  51           H5         U  51   8.735  16.907   6.981
  547    H6     U  51           H6         U  51   8.814  17.550   4.613
  548   1H5*    G  52          1H5*        G  52   7.472  22.514  -2.153
  549   2H5*    G  52          2H5*        G  52   5.850  22.706  -2.797
  550    H4*    G  52           H4*        G  52   7.132  20.025  -2.121
  551    H3*    G  52           H3*        G  52   6.594  21.527  -4.706
  552    H2*    G  52           H2*        G  52   6.476  19.379  -5.788
  553   2HO*    G  52          2HO*        G  52   6.970  18.027  -3.316
  554    H1*    G  52           H1*        G  52   4.838  18.338  -3.862
  555    H8     G  52           H8         G  52   3.778  21.960  -4.105
  556    H1     G  52           H1         G  52   1.286  18.118  -8.620
  557   1H2     G  52          1H2         G  52   2.521  16.367  -8.867
  558   2H2     G  52          2H2         G  52   3.876  16.026  -7.810
  559   1H5*    C  53          1H5*        C  53   9.392  18.763  -6.035
  560   2H5*    C  53          2H5*        C  53  10.592  19.504  -7.108
  561    H4*    C  53           H4*        C  53   9.477  17.662  -8.233
  562    H3*    C  53           H3*        C  53   8.581  20.336  -9.363
  563    H2*    C  53           H2*        C  53   7.554  19.009 -11.106
  564   2HO*    C  53          2HO*        C  53   9.362  17.329 -10.988
  565    H1*    C  53           H1*        C  53   6.431  17.260  -9.337
  566   1H4     C  53          1H4         C  53   2.045  21.798  -9.964
  567   2H4     C  53          2H4         C  53   2.783  22.721  -8.674
  568    H5     C  53           H5         C  53   4.936  22.198  -7.750
  569    H6     C  53           H6         C  53   6.710  20.512  -7.701
  570   1H5*    C  54          1H5*        C  54   9.885  18.264 -12.731
  571   2H5*    C  54          2H5*        C  54  10.808  19.305 -13.818
  572    H4*    C  54           H4*        C  54   8.950  18.249 -14.978
  573    H3*    C  54           H3*        C  54   8.514  21.235 -14.618
  574    H2*    C  54           H2*        C  54   6.709  20.929 -16.199
  575   2HO*    C  54          2HO*        C  54   7.973  19.159 -17.388
  576    H1*    C  54           H1*        C  54   5.752  18.713 -14.914
  577   1H4     C  54          1H4         C  54   2.742  23.681 -12.310
  578   2H4     C  54          2H4         C  54   4.015  23.860 -11.125
  579    H5     C  54           H5         C  54   6.060  22.608 -11.190
  580    H6     C  54           H6         C  54   7.272  20.843 -12.379
  581   1H5*    C  55          1H5*        C  55   8.169  20.680 -18.734
  582   2H5*    C  55          2H5*        C  55   9.052  21.927 -19.618
  583    H4*    C  55           H4*        C  55   6.718  21.827 -20.338
  584    H3*    C  55           H3*        C  55   7.422  24.339 -18.781
  585    H2*    C  55           H2*        C  55   5.280  25.171 -19.410
  586   2HO*    C  55          2HO*        C  55   5.096  24.535 -21.590
  587    H1*    C  55           H1*        C  55   3.980  22.752 -19.022
  588   1H4     C  55          1H4         C  55   3.216  26.431 -13.853
  589   2H4     C  55          2H4         C  55   4.761  25.912 -13.219
  590    H5     C  55           H5         C  55   6.249  24.449 -14.402
  591    H6     C  55           H6         C  55   6.568  23.197 -16.485
  592   1H    MET 104          1H        MET 104  10.493 -17.303   2.314
  593    HA   MET 104           HA       MET 104  11.348 -14.494   2.038
  594   1HB   MET 104          1HB       MET 104  13.323 -15.687   2.999
  595   2HB   MET 104          2HB       MET 104  13.313 -16.800   1.634
  596   1HG   MET 104          1HG       MET 104  14.500 -15.384   0.398
  597   2HG   MET 104          2HG       MET 104  13.342 -14.081   0.617
  598   1HE   MET 104          1HE       MET 104  14.680 -12.002   3.550
  599   2HE   MET 104          2HE       MET 104  13.844 -11.898   1.991
  600   3HE   MET 104          3HE       MET 104  13.229 -12.988   3.258
  601    H    TYR 105           H        TYR 105  10.953 -13.765   0.024
  602    HA   TYR 105           HA       TYR 105  10.207 -15.781  -2.069
  603   1HB   TYR 105          1HB       TYR 105   9.236 -12.952  -1.496
  604   2HB   TYR 105          2HB       TYR 105   8.898 -13.781  -3.012
  605    HD1  TYR 105           HD1      TYR 105   8.355 -14.221   0.814
  606    HD2  TYR 105           HD2      TYR 105   7.243 -15.412  -3.224
  607    HE1  TYR 105           HE1      TYR 105   6.642 -15.723   1.712
  608    HE2  TYR 105           HE2      TYR 105   5.398 -16.774  -2.273
  609    HH   TYR 105           HH       TYR 105   4.778 -16.942   1.250
  610    H    VAL 106           H        VAL 106  11.582 -16.015  -3.705
  611    HA   VAL 106           HA       VAL 106  13.694 -13.920  -4.058
  612    HB   VAL 106           HB       VAL 106  13.706 -16.887  -4.725
  613   1HG1  VAL 106          1HG1      VAL 106  16.026 -14.904  -4.681
  614   2HG1  VAL 106          2HG1      VAL 106  16.171 -16.661  -4.881
  615   3HG1  VAL 106          3HG1      VAL 106  15.356 -15.717  -6.116
  616   1HG2  VAL 106          1HG2      VAL 106  13.609 -16.525  -2.304
  617   2HG2  VAL 106          2HG2      VAL 106  15.190 -17.141  -2.825
  618   3HG2  VAL 106          3HG2      VAL 106  15.001 -15.405  -2.426
  619    H    CYS 107           H        CYS 107  14.202 -13.047  -6.000
  620    HA   CYS 107           HA       CYS 107  12.469 -13.517  -8.317
  621   1HB   CYS 107          1HB       CYS 107  13.337 -11.244  -7.736
  622   2HB   CYS 107          2HB       CYS 107  14.984 -11.833  -7.974
  623    H    HIS 108           H        HIS 108  12.859 -14.896  -9.935
  624    HA   HIS 108           HA       HIS 108  15.498 -16.297  -9.966
  625   1HB   HIS 108          1HB       HIS 108  12.761 -17.236 -10.941
  626   2HB   HIS 108          2HB       HIS 108  14.258 -18.176 -11.025
  627    HD2  HIS 108           HD2      HIS 108  11.342 -18.292  -9.030
  628    HE1  HIS 108           HE1      HIS 108  14.319 -18.644  -5.986
  629    HE2  HIS 108           HE2      HIS 108  11.842 -18.943  -6.528
  630    H    PHE 109           H        PHE 109  14.698 -13.682 -11.335
  631    HA   PHE 109           HA       PHE 109  14.688 -14.139 -14.187
  632   1HB   PHE 109          1HB       PHE 109  14.306 -11.919 -12.779
  633   2HB   PHE 109          2HB       PHE 109  16.050 -11.752 -12.879
  634    HD1  PHE 109           HD1      PHE 109  12.861 -11.558 -14.583
  635    HD2  PHE 109           HD2      PHE 109  17.134 -11.334 -15.053
  636    HE1  PHE 109           HE1      PHE 109  12.525 -10.629 -16.871
  637    HE2  PHE 109           HE2      PHE 109  16.812 -10.381 -17.361
  638    HZ   PHE 109           HZ       PHE 109  14.500 -10.029 -18.255
  639    H    GLU 110           H        GLU 110  16.496 -13.967 -15.661
  640    HA   GLU 110           HA       GLU 110  18.527 -15.777 -15.078
  641   1HB   GLU 110          1HB       GLU 110  17.803 -15.055 -17.350
  642   2HB   GLU 110          2HB       GLU 110  18.651 -13.520 -17.139
  643   1HG   GLU 110          1HG       GLU 110  20.808 -14.742 -16.926
  644   2HG   GLU 110          2HG       GLU 110  19.954 -16.282 -17.041
  645    H    ASN 111           H        ASN 111  20.062 -15.663 -13.544
  646    HA   ASN 111           HA       ASN 111  22.054 -15.032 -12.546
  647   1HB   ASN 111          1HB       ASN 111  22.601 -14.213 -14.960
  648   2HB   ASN 111          2HB       ASN 111  22.231 -12.592 -14.365
  649   1HD2  ASN 111          1HD2      ASN 111  24.313 -11.731 -14.489
  650   2HD2  ASN 111          2HD2      ASN 111  25.642 -12.360 -13.525
  651    H    CYS 112           H        CYS 112  19.229 -13.727 -11.995
  652    HA   CYS 112           HA       CYS 112  19.973 -11.176 -10.724
  653   1HB   CYS 112          1HB       CYS 112  17.835 -11.392 -11.869
  654   2HB   CYS 112          2HB       CYS 112  17.315 -12.687 -10.762
  655    H    GLY 113           H        GLY 113  17.977 -13.859  -9.359
  656   1HA   GLY 113          1HA       GLY 113  18.106 -15.023  -7.368
  657   2HA   GLY 113          2HA       GLY 113  19.828 -14.599  -7.319
  658    H    LYS 114           H        LYS 114  17.686 -11.833  -7.438
  659    HA   LYS 114           HA       LYS 114  18.456 -10.967  -4.767
  660   1HB   LYS 114          1HB       LYS 114  17.783  -9.608  -6.891
  661   2HB   LYS 114          2HB       LYS 114  16.123  -9.813  -6.317
  662   1HG   LYS 114          1HG       LYS 114  16.649  -8.599  -4.265
  663   2HG   LYS 114          2HG       LYS 114  18.397  -8.677  -4.604
  664   1HD   LYS 114          1HD       LYS 114  18.096  -7.290  -6.623
  665   2HD   LYS 114          2HD       LYS 114  16.359  -7.286  -6.339
  666   1HE   LYS 114          1HE       LYS 114  17.216  -5.186  -5.756
  667   2HE   LYS 114          2HE       LYS 114  16.611  -5.995  -4.299
  668   1HZ   LYS 114          1HZ       LYS 114  19.481  -5.813  -5.084
  669   2HZ   LYS 114          2HZ       LYS 114  18.777  -4.930  -3.909
  670   3HZ   LYS 114          3HZ       LYS 114  18.927  -6.541  -3.728
  671    H    ALA 115           H        ALA 115  17.260 -10.896  -2.860
  672    HA   ALA 115           HA       ALA 115  14.821 -12.638  -2.839
  673   1HB   ALA 115          1HB       ALA 115  16.835 -13.738  -1.933
  674   2HB   ALA 115          2HB       ALA 115  17.009 -12.434  -0.723
  675   3HB   ALA 115          3HB       ALA 115  15.582 -13.505  -0.711
  676    H    PHE 116           H        PHE 116  13.066 -12.012  -1.694
  677    HA   PHE 116           HA       PHE 116  13.214  -9.384  -0.261
  678   1HB   PHE 116          1HB       PHE 116  10.872 -10.420  -1.908
  679   2HB   PHE 116          2HB       PHE 116  11.072  -8.847  -1.193
  680    HD1  PHE 116           HD1      PHE 116  12.272 -11.124  -3.867
  681    HD2  PHE 116           HD2      PHE 116  12.393  -7.102  -2.323
  682    HE1  PHE 116           HE1      PHE 116  13.651 -10.455  -5.786
  683    HE2  PHE 116           HE2      PHE 116  13.783  -6.422  -4.287
  684    HZ   PHE 116           HZ       PHE 116  14.438  -8.155  -5.986
  685    H    LYS 117           H        LYS 117  11.641  -9.024   1.395
  686    HA   LYS 117           HA       LYS 117  11.146 -11.334   3.025
  687   1HB   LYS 117          1HB       LYS 117  10.887  -9.803   4.620
  688   2HB   LYS 117          2HB       LYS 117  11.378  -8.631   3.423
  689   1HG   LYS 117          1HG       LYS 117   8.938  -8.108   3.020
  690   2HG   LYS 117          2HG       LYS 117   8.611  -9.159   4.424
  691   1HD   LYS 117          1HD       LYS 117  10.490  -6.843   4.715
  692   2HD   LYS 117          2HD       LYS 117   8.726  -6.632   4.802
  693   1HE   LYS 117          1HE       LYS 117   8.515  -8.295   6.550
  694   2HE   LYS 117          2HE       LYS 117  10.230  -8.720   6.431
  695   1HZ   LYS 117          1HZ       LYS 117  10.736  -6.421   7.114
  696   2HZ   LYS 117          2HZ       LYS 117   9.134  -6.133   7.356
  697   3HZ   LYS 117          3HZ       LYS 117   9.888  -7.286   8.266
  698    H    LYS 118           H        LYS 118   9.139  -9.399   0.768
  699    HA   LYS 118           HA       LYS 118   6.977 -11.482   1.054
  700   1HB   LYS 118          1HB       LYS 118   6.670  -8.435   1.098
  701   2HB   LYS 118          2HB       LYS 118   5.311  -9.530   0.802
  702   1HG   LYS 118          1HG       LYS 118   6.129 -10.820   2.890
  703   2HG   LYS 118          2HG       LYS 118   7.182  -9.470   3.126
  704   1HD   LYS 118          1HD       LYS 118   5.414  -8.015   3.757
  705   2HD   LYS 118          2HD       LYS 118   4.221  -9.156   3.082
  706   1HE   LYS 118          1HE       LYS 118   4.244  -9.499   5.546
  707   2HE   LYS 118          2HE       LYS 118   4.821 -10.845   4.701
  708   1HZ   LYS 118          1HZ       LYS 118   6.468  -8.869   6.157
  709   2HZ   LYS 118          2HZ       LYS 118   6.318 -10.437   6.515
  710   3HZ   LYS 118          3HZ       LYS 118   7.157 -10.068   5.220
  711    H    HIS 119           H        HIS 119   5.553 -11.757  -0.740
  712    HA   HIS 119           HA       HIS 119   6.981 -11.805  -3.220
  713   1HB   HIS 119          1HB       HIS 119   4.877 -12.669  -4.183
  714   2HB   HIS 119          2HB       HIS 119   5.389 -13.505  -2.748
  715    HD1  HIS 119           HD1      HIS 119   2.661 -10.756  -3.500
  716    HD2  HIS 119           HD2      HIS 119   3.569 -14.204  -1.220
  717    HE1  HIS 119           HE1      HIS 119   0.527 -11.337  -2.138
  718    HE2  HIS 119           HE2      HIS 119   1.102 -13.424  -0.808
  719    H    ASN 120           H        ASN 120   4.676  -9.465  -1.873
  720    HA   ASN 120           HA       ASN 120   4.012  -8.151  -4.339
  721   1HB   ASN 120          1HB       ASN 120   3.782  -7.534  -1.407
  722   2HB   ASN 120          2HB       ASN 120   3.867  -6.134  -2.471
  723   1HD2  ASN 120          1HD2      ASN 120   1.620  -8.277  -1.120
  724   2HD2  ASN 120          2HD2      ASN 120   0.390  -8.110  -2.363
  725    H    GLN 121           H        GLN 121   6.794  -7.864  -2.105
  726    HA   GLN 121           HA       GLN 121   7.953  -5.542  -3.464
  727   1HB   GLN 121          1HB       GLN 121   9.533  -7.524  -1.860
  728   2HB   GLN 121          2HB       GLN 121   9.768  -5.781  -2.084
  729   1HG   GLN 121          1HG       GLN 121   7.911  -5.311  -0.576
  730   2HG   GLN 121          2HG       GLN 121   7.632  -7.054  -0.356
  731   1HE2  GLN 121          1HE2      GLN 121   9.185  -4.428   1.098
  732   2HE2  GLN 121          2HE2      GLN 121  10.369  -5.357   1.999
  733    H    LEU 122           H        LEU 122   8.336  -9.123  -3.576
  734    HA   LEU 122           HA       LEU 122  10.433  -9.244  -5.464
  735   1HB   LEU 122          1HB       LEU 122   9.706 -11.206  -4.262
  736   2HB   LEU 122          2HB       LEU 122   8.077 -11.073  -4.884
  737    HG   LEU 122           HG       LEU 122   8.741 -11.750  -7.100
  738   1HD1  LEU 122          1HD1      LEU 122  10.958 -12.471  -7.551
  739   2HD1  LEU 122          2HD1      LEU 122  11.065 -10.796  -7.035
  740   3HD1  LEU 122          3HD1      LEU 122  11.493 -12.093  -5.887
  741   1HD2  LEU 122          1HD2      LEU 122   9.889 -13.622  -4.954
  742   2HD2  LEU 122          2HD2      LEU 122   8.184 -13.530  -5.446
  743   3HD2  LEU 122          3HD2      LEU 122   9.424 -14.066  -6.599
  744    H    LYS 123           H        LYS 123   6.859  -9.303  -6.056
  745    HA   LYS 123           HA       LYS 123   6.964  -9.170  -8.872
  746   1HB   LYS 123          1HB       LYS 123   4.897  -8.249  -6.832
  747   2HB   LYS 123          2HB       LYS 123   4.652  -7.992  -8.570
  748   1HG   LYS 123          1HG       LYS 123   5.003 -10.384  -9.018
  749   2HG   LYS 123          2HG       LYS 123   5.240 -10.706  -7.296
  750   1HD   LYS 123          1HD       LYS 123   2.940 -10.169  -6.793
  751   2HD   LYS 123          2HD       LYS 123   2.674  -9.513  -8.429
  752   1HE   LYS 123          1HE       LYS 123   3.120 -11.720  -9.421
  753   2HE   LYS 123          2HE       LYS 123   3.425 -12.415  -7.824
  754   1HZ   LYS 123          1HZ       LYS 123   0.813 -11.194  -8.533
  755   2HZ   LYS 123          2HZ       LYS 123   1.137 -12.778  -8.755
  756   3HZ   LYS 123          3HZ       LYS 123   1.150 -12.185  -7.254
  757    H    VAL 124           H        VAL 124   7.048  -6.512  -6.464
  758    HA   VAL 124           HA       VAL 124   7.027  -4.307  -8.289
  759    HB   VAL 124           HB       VAL 124   8.066  -4.778  -5.508
  760   1HG1  VAL 124          1HG1      VAL 124   8.657  -2.383  -5.262
  761   2HG1  VAL 124          2HG1      VAL 124   9.804  -3.255  -6.272
  762   3HG1  VAL 124          3HG1      VAL 124   8.587  -2.200  -7.030
  763   1HG2  VAL 124          1HG2      VAL 124   5.652  -4.292  -6.162
  764   2HG2  VAL 124          2HG2      VAL 124   6.351  -3.230  -4.960
  765   3HG2  VAL 124          3HG2      VAL 124   6.256  -2.691  -6.667
  766    H    HIS 125           H        HIS 125   9.739  -6.329  -7.042
  767    HA   HIS 125           HA       HIS 125  11.799  -4.839  -8.322
  768   1HB   HIS 125          1HB       HIS 125  12.322  -6.296  -6.511
  769   2HB   HIS 125          2HB       HIS 125  11.620  -7.701  -7.309
  770    HD1  HIS 125           HD1      HIS 125  14.694  -5.399  -7.664
  771    HD2  HIS 125           HD2      HIS 125  13.094  -9.092  -8.926
  772    HE1  HIS 125           HE1      HIS 125  16.583  -6.628  -8.842
  773    H    GLN 126           H        GLN 126  10.010  -7.806  -9.353
  774    HA   GLN 126           HA       GLN 126  11.511  -8.253 -11.734
  775   1HB   GLN 126          1HB       GLN 126   8.699  -9.084 -10.893
  776   2HB   GLN 126          2HB       GLN 126   9.430  -9.536 -12.469
  777   1HG   GLN 126          1HG       GLN 126  11.450 -10.374 -11.263
  778   2HG   GLN 126          2HG       GLN 126  10.704 -10.035  -9.708
  779   1HE2  GLN 126          1HE2      GLN 126  11.768 -12.434 -10.265
  780   2HE2  GLN 126          2HE2      GLN 126  10.472 -13.648 -10.421
  781    H    PHE 127           H        PHE 127   8.740  -6.127 -11.089
  782    HA   PHE 127           HA       PHE 127   7.973  -5.506 -13.734
  783   1HB   PHE 127          1HB       PHE 127   6.613  -4.200 -12.700
  784   2HB   PHE 127          2HB       PHE 127   7.336  -4.631 -11.203
  785    HD1  PHE 127           HD1      PHE 127   8.176  -1.993 -13.909
  786    HD2  PHE 127           HD2      PHE 127   7.325  -2.910  -9.798
  787    HE1  PHE 127           HE1      PHE 127   8.679   0.316 -13.298
  788    HE2  PHE 127           HE2      PHE 127   7.879  -0.689  -9.107
  789    HZ   PHE 127           HZ       PHE 127   8.661   1.011 -10.870
  790    H    SER 128           H        SER 128  10.874  -4.574 -11.933
  791    HA   SER 128           HA       SER 128  11.704  -2.412 -13.686
  792   1HB   SER 128          1HB       SER 128  12.531  -2.858 -11.341
  793   2HB   SER 128          2HB       SER 128  13.477  -4.218 -11.990
  794    HG   SER 128           HG       SER 128  14.682  -2.242 -11.884
  795    H    HIS 129           H        HIS 129  12.524  -5.951 -13.529
  796    HA   HIS 129           HA       HIS 129  14.334  -5.933 -15.773
  797   1HB   HIS 129          1HB       HIS 129  12.585  -8.171 -14.666
  798   2HB   HIS 129          2HB       HIS 129  13.834  -8.346 -15.874
  799    HD1  HIS 129           HD1      HIS 129  16.453  -7.922 -14.968
  800    HD2  HIS 129           HD2      HIS 129  13.316  -8.981 -12.407
  801    HE1  HIS 129           HE1      HIS 129  17.505  -9.081 -12.934
  802    H    THR 130           H        THR 130  10.801  -6.377 -15.493
  803    HA   THR 130           HA       THR 130  10.455  -7.009 -18.337
  804    HB   THR 130           HB       THR 130   8.038  -6.825 -17.814
  805    HG1  THR 130           HG1      THR 130   8.991  -5.864 -15.380
  806   1HG2  THR 130          1HG2      THR 130   9.300  -8.327 -15.448
  807   2HG2  THR 130          2HG2      THR 130   7.803  -8.671 -16.312
  808   3HG2  THR 130          3HG2      THR 130   9.371  -8.961 -17.106
  809    H    GLN 131           H        GLN 131  10.739  -4.133 -16.449
  810    HA   GLN 131           HA       GLN 131  10.423  -1.909 -16.832
  811   1HB   GLN 131          1HB       GLN 131  11.842  -2.744 -18.969
  812   2HB   GLN 131          2HB       GLN 131  10.379  -2.257 -19.827
  813   1HG   GLN 131          1HG       GLN 131  11.344  -0.176 -19.741
  814   2HG   GLN 131          2HG       GLN 131  10.678  -0.105 -18.109
  815   1HE2  GLN 131          1HE2      GLN 131  12.529  -1.660 -16.546
  816   2HE2  GLN 131          2HE2      GLN 131  14.087  -0.897 -16.731
  817    H    GLN 132           H        GLN 132   8.032  -3.610 -16.569
  818    HA   GLN 132           HA       GLN 132   6.135  -1.566 -17.649
  819   1HB   GLN 132          1HB       GLN 132   4.413  -3.221 -18.028
  820   2HB   GLN 132          2HB       GLN 132   5.813  -3.487 -19.056
  821   1HG   GLN 132          1HG       GLN 132   4.976  -5.617 -18.454
  822   2HG   GLN 132          2HG       GLN 132   6.489  -5.374 -17.605
  823   1HE2  GLN 132          1HE2      GLN 132   6.463  -5.823 -15.451
  824   2HE2  GLN 132          2HE2      GLN 132   5.009  -5.890 -14.442
  825    H    LEU 133           H        LEU 133   4.209  -1.306 -16.306
  826    HA   LEU 133           HA       LEU 133   5.052  -1.538 -13.499
  827   1HB   LEU 133          1HB       LEU 133   3.069   0.183 -14.983
  828   2HB   LEU 133          2HB       LEU 133   3.068   0.163 -13.210
  829    HG   LEU 133           HG       LEU 133   5.659   0.642 -14.821
  830   1HD1  LEU 133          1HD1      LEU 133   4.004   2.384 -15.441
  831   2HD1  LEU 133          2HD1      LEU 133   3.732   2.733 -13.716
  832   3HD1  LEU 133          3HD1      LEU 133   5.321   3.038 -14.453
  833   1HD2  LEU 133          1HD2      LEU 133   6.492   1.595 -12.813
  834   2HD2  LEU 133          2HD2      LEU 133   4.925   1.432 -12.013
  835   3HD2  LEU 133          3HD2      LEU 133   5.871  -0.015 -12.430
  836    HA   PRO 134           HA       PRO 134   2.224  -4.810 -12.797
  837   1HB   PRO 134          1HB       PRO 134   2.460  -4.802  -9.977
  838   2HB   PRO 134          2HB       PRO 134   3.529  -5.650 -11.133
  839   1HG   PRO 134          1HG       PRO 134   4.092  -3.290  -9.489
  840   2HG   PRO 134          2HG       PRO 134   5.205  -4.298 -10.423
  841   1HD   PRO 134          1HD       PRO 134   4.193  -1.679 -11.075
  842   2HD   PRO 134          2HD       PRO 134   5.261  -2.734 -12.001
  843    H    TYR 135           H        TYR 135   1.802  -1.883 -10.768
  844    HA   TYR 135           HA       TYR 135  -0.892  -2.784  -9.955
  845   1HB   TYR 135          1HB       TYR 135   0.733  -0.342  -9.083
  846   2HB   TYR 135          2HB       TYR 135  -0.757  -0.896  -8.362
  847    HD1  TYR 135           HD1      TYR 135   2.859  -1.436  -8.526
  848    HD2  TYR 135           HD2      TYR 135  -0.902  -3.056  -7.158
  849    HE1  TYR 135           HE1      TYR 135   4.087  -3.078  -7.109
  850    HE2  TYR 135           HE2      TYR 135   0.348  -4.768  -5.807
  851    HH   TYR 135           HH       TYR 135   2.389  -5.651  -5.275
  852    H    GLU 136           H        GLU 136  -2.226  -2.492 -11.724
  853    HA   GLU 136           HA       GLU 136  -2.210   0.165 -13.081
  854   1HB   GLU 136          1HB       GLU 136  -2.118  -1.792 -14.544
  855   2HB   GLU 136          2HB       GLU 136  -3.508  -2.517 -13.752
  856   1HG   GLU 136          1HG       GLU 136  -4.997  -0.805 -14.638
  857   2HG   GLU 136          2HG       GLU 136  -3.645   0.078 -15.342
  858    H    CYS 137           H        CYS 137  -3.993   1.531 -13.045
  859    HA   CYS 137           HA       CYS 137  -5.977   1.181 -10.943
  860   1HB   CYS 137          1HB       CYS 137  -5.180   3.388 -11.452
  861   2HB   CYS 137          2HB       CYS 137  -5.578   3.224 -13.146
  862    HA   PRO 138           HA       PRO 138  -8.548  -1.195 -13.711
  863   1HB   PRO 138          1HB       PRO 138 -10.212  -2.333 -11.894
  864   2HB   PRO 138          2HB       PRO 138  -8.451  -2.643 -11.849
  865   1HG   PRO 138          1HG       PRO 138 -10.016  -0.596 -10.225
  866   2HG   PRO 138          2HG       PRO 138  -8.862  -1.826  -9.621
  867   1HD   PRO 138          1HD       PRO 138  -8.137   0.785 -10.159
  868   2HD   PRO 138          2HD       PRO 138  -7.019  -0.604 -10.356
  869    H    HIS 139           H        HIS 139  -9.411   1.777 -12.507
  870    HA   HIS 139           HA       HIS 139 -12.272   1.749 -12.465
  871   1HB   HIS 139          1HB       HIS 139 -10.792   3.558 -11.547
  872   2HB   HIS 139          2HB       HIS 139 -10.423   4.057 -13.198
  873    HD2  HIS 139           HD2      HIS 139 -13.343   3.931 -10.656
  874    HE1  HIS 139           HE1      HIS 139 -14.561   6.573 -13.775
  875    HE2  HIS 139           HE2      HIS 139 -15.177   5.632 -11.489
  876    H    GLU 140           H        GLU 140 -13.837   2.187 -14.008
  877    HA   GLU 140           HA       GLU 140 -13.254   1.411 -16.725
  878   1HB   GLU 140          1HB       GLU 140 -15.425   1.019 -15.551
  879   2HB   GLU 140          2HB       GLU 140 -15.763   2.750 -15.585
  880   1HG   GLU 140          1HG       GLU 140 -15.720   2.688 -18.085
  881   2HG   GLU 140          2HG       GLU 140 -15.311   0.973 -18.033
  882    H    GLY 141           H        GLY 141 -11.961   2.712 -17.942
  883   1HA   GLY 141          1HA       GLY 141 -12.105   4.585 -19.543
  884   2HA   GLY 141          2HA       GLY 141 -12.808   5.576 -18.253
  885    H    CYS 142           H        CYS 142 -10.443   3.778 -16.755
  886    HA   CYS 142           HA       CYS 142  -8.383   5.915 -17.149
  887   1HB   CYS 142          1HB       CYS 142  -9.541   5.519 -14.856
  888   2HB   CYS 142          2HB       CYS 142  -8.600   4.036 -14.776
  889    H    ASP 143           H        ASP 143  -6.118   5.229 -17.052
  890    HA   ASP 143           HA       ASP 143  -5.575   2.360 -17.614
  891   1HB   ASP 143          1HB       ASP 143  -4.608   2.728 -19.728
  892   2HB   ASP 143          2HB       ASP 143  -6.144   3.568 -19.797
  893    H    LYS 144           H        LYS 144  -4.837   4.818 -15.682
  894    HA   LYS 144           HA       LYS 144  -1.968   5.143 -15.944
  895   1HB   LYS 144          1HB       LYS 144  -3.784   5.474 -13.498
  896   2HB   LYS 144          2HB       LYS 144  -2.096   5.956 -13.616
  897   1HG   LYS 144          1HG       LYS 144  -3.140   7.297 -15.780
  898   2HG   LYS 144          2HG       LYS 144  -4.516   7.314 -14.659
  899   1HD   LYS 144          1HD       LYS 144  -3.078   8.335 -12.906
  900   2HD   LYS 144          2HD       LYS 144  -1.699   8.258 -14.002
  901   1HE   LYS 144          1HE       LYS 144  -2.414  10.472 -14.187
  902   2HE   LYS 144          2HE       LYS 144  -3.031   9.681 -15.643
  903   1HZ   LYS 144          1HZ       LYS 144  -5.191   9.462 -14.365
  904   2HZ   LYS 144          2HZ       LYS 144  -4.542  10.461 -13.212
  905   3HZ   LYS 144          3HZ       LYS 144  -4.778  11.003 -14.730
  906    H    ARG 145           H        ARG 145  -0.279   4.182 -14.755
  907    HA   ARG 145           HA       ARG 145  -0.948   1.797 -13.085
  908   1HB   ARG 145          1HB       ARG 145   1.300   1.764 -15.138
  909   2HB   ARG 145          2HB       ARG 145   0.743   0.492 -14.010
  910   1HG   ARG 145          1HG       ARG 145  -1.388   0.358 -15.243
  911   2HG   ARG 145          2HG       ARG 145  -0.718   1.421 -16.495
  912   1HD   ARG 145          1HD       ARG 145   0.978  -0.158 -17.076
  913   2HD   ARG 145          2HD       ARG 145   0.797  -1.029 -15.549
  914    HE   ARG 145           HE       ARG 145  -1.589  -1.112 -17.248
  915   1HH1  ARG 145          1HH1      ARG 145   1.231  -2.959 -16.158
  916   2HH1  ARG 145          2HH1      ARG 145   0.649  -4.391 -16.945
  917   1HH2  ARG 145          1HH2      ARG 145  -2.327  -2.923 -17.905
  918   2HH2  ARG 145          2HH2      ARG 145  -1.382  -4.411 -17.894
  919    H    PHE 146           H        PHE 146   0.638   1.241 -11.561
  920    HA   PHE 146           HA       PHE 146   2.552   3.460 -10.936
  921   1HB   PHE 146          1HB       PHE 146   0.700   2.065  -8.949
  922   2HB   PHE 146          2HB       PHE 146   1.780   3.398  -8.621
  923    HD1  PHE 146           HD1      PHE 146  -1.426   2.467 -10.244
  924    HD2  PHE 146           HD2      PHE 146   1.370   5.676  -9.515
  925    HE1  PHE 146           HE1      PHE 146  -3.064   4.069 -11.088
  926    HE2  PHE 146           HE2      PHE 146  -0.268   7.292 -10.453
  927    HZ   PHE 146           HZ       PHE 146  -2.451   6.490 -11.297
  928    H    SER 147           H        SER 147   4.181   2.905  -9.337
  929    HA   SER 147           HA       SER 147   5.316   0.296 -10.004
  930   1HB   SER 147          1HB       SER 147   7.232   1.234  -8.537
  931   2HB   SER 147          2HB       SER 147   6.815   2.137 -10.004
  932    HG   SER 147           HG       SER 147   6.890   3.684  -8.547
  933    H    LEU 148           H        LEU 148   3.598   1.718  -7.280
  934    HA   LEU 148           HA       LEU 148   3.910  -0.850  -5.796
  935   1HB   LEU 148          1HB       LEU 148   4.611   1.911  -4.828
  936   2HB   LEU 148          2HB       LEU 148   3.836   0.854  -3.697
  937    HG   LEU 148           HG       LEU 148   6.213   0.941  -3.349
  938   1HD1  LEU 148          1HD1      LEU 148   5.117  -1.044  -2.575
  939   2HD1  LEU 148          2HD1      LEU 148   5.172  -1.760  -4.203
  940   3HD1  LEU 148          3HD1      LEU 148   6.671  -1.535  -3.265
  941   1HD2  LEU 148          1HD2      LEU 148   6.739  -0.708  -5.798
  942   2HD2  LEU 148          2HD2      LEU 148   6.872   1.057  -5.847
  943   3HD2  LEU 148          3HD2      LEU 148   7.881   0.103  -4.734
  944    HA   PRO 149           HA       PRO 149  -0.460  -0.525  -5.270
  945   1HB   PRO 149          1HB       PRO 149  -0.810  -1.586  -2.706
  946   2HB   PRO 149          2HB       PRO 149  -0.500  -2.530  -4.181
  947   1HG   PRO 149          1HG       PRO 149   1.473  -1.705  -2.051
  948   2HG   PRO 149          2HG       PRO 149   1.314  -3.280  -2.920
  949   1HD   PRO 149          1HD       PRO 149   3.205  -1.485  -3.672
  950   2HD   PRO 149          2HD       PRO 149   2.322  -2.447  -4.819
  951    H    SER 150           H        SER 150   1.649   0.936  -2.828
  952    HA   SER 150           HA       SER 150  -0.332   2.497  -1.429
  953   1HB   SER 150          1HB       SER 150   1.680   3.933  -0.843
  954   2HB   SER 150          2HB       SER 150   1.838   2.215  -0.430
  955    HG   SER 150           HG       SER 150   3.504   3.606  -1.843
  956    H    ARG 151           H        ARG 151   1.729   3.121  -4.302
  957    HA   ARG 151           HA       ARG 151   0.824   5.858  -4.677
  958   1HB   ARG 151          1HB       ARG 151   2.451   3.855  -6.236
  959   2HB   ARG 151          2HB       ARG 151   1.768   5.228  -7.114
  960   1HG   ARG 151          1HG       ARG 151   3.116   6.749  -6.186
  961   2HG   ARG 151          2HG       ARG 151   3.035   6.064  -4.572
  962   1HD   ARG 151          1HD       ARG 151   4.615   4.514  -6.601
  963   2HD   ARG 151          2HD       ARG 151   5.269   6.070  -6.074
  964    HE   ARG 151           HE       ARG 151   4.586   4.879  -3.682
  965   1HH1  ARG 151          1HH1      ARG 151   6.709   3.799  -6.270
  966   2HH1  ARG 151          2HH1      ARG 151   7.876   3.183  -5.129
  967   1HH2  ARG 151          1HH2      ARG 151   5.915   3.970  -2.390
  968   2HH2  ARG 151          2HH2      ARG 151   7.385   3.162  -2.926
  969    H    LEU 152           H        LEU 152  -0.214   2.656  -5.910
  970    HA   LEU 152           HA       LEU 152  -2.170   3.641  -7.794
  971   1HB   LEU 152          1HB       LEU 152  -1.390   1.338  -7.841
  972   2HB   LEU 152          2HB       LEU 152  -1.945   1.081  -6.178
  973    HG   LEU 152           HG       LEU 152  -4.250   1.158  -6.816
  974   1HD1  LEU 152          1HD1      LEU 152  -4.168   2.891  -8.667
  975   2HD1  LEU 152          2HD1      LEU 152  -3.426   1.657  -9.705
  976   3HD1  LEU 152          3HD1      LEU 152  -5.065   1.436  -9.062
  977   1HD2  LEU 152          1HD2      LEU 152  -2.836  -0.514  -8.923
  978   2HD2  LEU 152          2HD2      LEU 152  -2.904  -0.972  -7.209
  979   3HD2  LEU 152          3HD2      LEU 152  -4.399  -0.827  -8.160
  980    H    LYS 153           H        LYS 153  -2.342   2.686  -4.303
  981    HA   LYS 153           HA       LYS 153  -5.142   3.177  -3.989
  982   1HB   LYS 153          1HB       LYS 153  -2.784   2.990  -2.107
  983   2HB   LYS 153          2HB       LYS 153  -4.312   3.596  -1.475
  984   1HG   LYS 153          1HG       LYS 153  -4.147   0.993  -3.039
  985   2HG   LYS 153          2HG       LYS 153  -3.932   1.066  -1.285
  986   1HD   LYS 153          1HD       LYS 153  -6.163   1.885  -0.923
  987   2HD   LYS 153          2HD       LYS 153  -6.417   2.206  -2.640
  988   1HE   LYS 153          1HE       LYS 153  -6.160  -0.252  -3.097
  989   2HE   LYS 153          2HE       LYS 153  -6.134  -0.531  -1.348
  990   1HZ   LYS 153          1HZ       LYS 153  -8.348   0.807  -2.835
  991   2HZ   LYS 153          2HZ       LYS 153  -8.384  -0.748  -2.317
  992   3HZ   LYS 153          3HZ       LYS 153  -8.351   0.474  -1.232
  993    H    ARG 154           H        ARG 154  -2.327   5.376  -3.715
  994    HA   ARG 154           HA       ARG 154  -3.811   7.690  -2.810
  995   1HB   ARG 154          1HB       ARG 154  -1.142   7.194  -4.124
  996   2HB   ARG 154          2HB       ARG 154  -1.764   8.830  -4.166
  997   1HG   ARG 154          1HG       ARG 154  -1.871   7.469  -1.503
  998   2HG   ARG 154          2HG       ARG 154  -0.268   7.821  -2.145
  999   1HD   ARG 154          1HD       ARG 154  -1.066   9.668  -0.698
 1000   2HD   ARG 154          2HD       ARG 154  -0.763  10.190  -2.346
 1001    HE   ARG 154           HE       ARG 154  -3.022  10.575  -2.685
 1002   1HH1  ARG 154          1HH1      ARG 154  -2.614   9.229   0.550
 1003   2HH1  ARG 154          2HH1      ARG 154  -4.281   9.548   0.964
 1004   1HH2  ARG 154          1HH2      ARG 154  -4.961  11.179  -1.999
 1005   2HH2  ARG 154          2HH2      ARG 154  -5.539  10.771  -0.393
 1006    H    HIS 155           H        HIS 155  -3.002   6.406  -6.054
 1007    HA   HIS 155           HA       HIS 155  -4.259   8.522  -7.534
 1008   1HB   HIS 155          1HB       HIS 155  -2.706   7.023  -8.606
 1009   2HB   HIS 155          2HB       HIS 155  -3.697   5.605  -8.239
 1010    HD1  HIS 155           HD1      HIS 155  -3.993   8.870 -10.255
 1011    HD2  HIS 155           HD2      HIS 155  -5.711   5.045  -9.848
 1012    HE1  HIS 155           HE1      HIS 155  -5.903   8.791 -11.929
 1013    H    GLU 156           H        GLU 156  -5.476   5.364  -6.281
 1014    HA   GLU 156           HA       GLU 156  -8.010   5.390  -7.435
 1015   1HB   GLU 156          1HB       GLU 156  -6.798   3.633  -5.905
 1016   2HB   GLU 156          2HB       GLU 156  -7.605   4.461  -4.566
 1017   1HG   GLU 156          1HG       GLU 156  -9.795   4.008  -5.643
 1018   2HG   GLU 156          2HG       GLU 156  -8.957   3.310  -7.041
 1019    H    LYS 157           H        LYS 157  -6.819   7.276  -4.659
 1020    HA   LYS 157           HA       LYS 157  -9.333   8.115  -3.577
 1021   1HB   LYS 157          1HB       LYS 157  -6.921   8.430  -2.633
 1022   2HB   LYS 157          2HB       LYS 157  -6.831   9.815  -3.710
 1023   1HG   LYS 157          1HG       LYS 157  -7.509  10.886  -1.834
 1024   2HG   LYS 157          2HG       LYS 157  -9.094  10.549  -2.488
 1025   1HD   LYS 157          1HD       LYS 157  -7.648   8.921  -0.347
 1026   2HD   LYS 157          2HD       LYS 157  -8.917  10.117  -0.063
 1027   1HE   LYS 157          1HE       LYS 157 -10.508   8.729  -1.390
 1028   2HE   LYS 157          2HE       LYS 157  -9.243   7.503  -1.592
 1029   1HZ   LYS 157          1HZ       LYS 157 -10.704   6.968   0.274
 1030   2HZ   LYS 157          2HZ       LYS 157  -9.198   7.251   0.832
 1031   3HZ   LYS 157          3HZ       LYS 157 -10.366   8.380   1.017
 1032    H    VAL 158           H        VAL 158  -7.580   9.066  -6.502
 1033    HA   VAL 158           HA       VAL 158  -8.846  11.587  -6.986
 1034    HB   VAL 158           HB       VAL 158  -7.898   9.545  -9.065
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.250  11.417 -10.022
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.146  12.568  -9.204
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.543  11.499 -10.488
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.542  11.958  -7.868
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.035  10.300  -7.475
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.833  10.908  -9.141
 1041    H    HIS 159           H        HIS 159  -9.780   8.225  -7.825
 1042    HA   HIS 159           HA       HIS 159 -12.192   9.062  -9.242
 1043   1HB   HIS 159          1HB       HIS 159 -11.145   6.361  -8.283
 1044   2HB   HIS 159          2HB       HIS 159 -12.666   6.566  -9.176
 1045    HD1  HIS 159           HD1      HIS 159 -12.086   8.267 -11.575
 1046    HD2  HIS 159           HD2      HIS 159  -9.161   5.778  -9.858
 1047    HE1  HIS 159           HE1      HIS 159 -10.259   7.972 -13.333
 1048    H    ALA 160           H        ALA 160 -11.336   8.116  -5.929
 1049    HA   ALA 160           HA       ALA 160 -14.050   7.696  -5.005
 1050   1HB   ALA 160          1HB       ALA 160 -11.572   8.498  -3.418
 1051   2HB   ALA 160          2HB       ALA 160 -13.056   7.777  -2.774
 1052   3HB   ALA 160          3HB       ALA 160 -12.004   6.824  -3.841
 1053    H    GLY 161           H        GLY 161 -11.993  10.537  -5.508
 1054   1HA   GLY 161          1HA       GLY 161 -12.799  12.745  -5.739
 1055   2HA   GLY 161          2HA       GLY 161 -14.306  12.285  -4.952
 1056    H    TYR 162           H        TYR 162 -13.184  14.645  -4.253
 1057    HA   TYR 162           HA       TYR 162 -12.024  14.095  -1.542
 1058   1HB   TYR 162          1HB       TYR 162 -11.445  16.475  -3.357
 1059   2HB   TYR 162          2HB       TYR 162 -10.755  16.193  -1.751
 1060    HD1  TYR 162           HD1      TYR 162 -10.968  14.942  -5.248
 1061    HD2  TYR 162           HD2      TYR 162  -8.802  14.678  -1.529
 1062    HE1  TYR 162           HE1      TYR 162  -9.427  13.335  -6.270
 1063    HE2  TYR 162           HE2      TYR 162  -7.077  13.263  -2.659
 1064    HH   TYR 162           HH       TYR 162  -6.368  12.359  -4.733
 1065    HA   PRO 163           HA       PRO 163 -16.020  16.149  -1.053
 1066   1HB   PRO 163          1HB       PRO 163 -16.819  14.953   1.275
 1067   2HB   PRO 163          2HB       PRO 163 -16.780  14.074  -0.283
 1068   1HG   PRO 163          1HG       PRO 163 -14.683  14.043   1.906
 1069   2HG   PRO 163          2HG       PRO 163 -15.419  12.651   1.052
 1070   1HD   PRO 163          1HD       PRO 163 -13.015  13.736   0.318
 1071   2HD   PRO 163          2HD       PRO 163 -14.152  13.040  -0.884
 1072    H    CYS 164           H        CYS 164 -16.735  17.926   0.087
 1073    HA   CYS 164           HA       CYS 164 -14.794  19.339   1.720
 1074   1HB   CYS 164          1HB       CYS 164 -16.592  20.300   0.096
 1075   2HB   CYS 164          2HB       CYS 164 -17.722  20.082   1.457
 1076    H    LYS 165           H        LYS 165 -14.715  19.662   3.865
 1077    HA   LYS 165           HA       LYS 165 -16.939  18.688   5.582
 1078   1HB   LYS 165          1HB       LYS 165 -13.996  17.986   5.968
 1079   2HB   LYS 165          2HB       LYS 165 -15.222  17.717   7.189
 1080   1HG   LYS 165          1HG       LYS 165 -15.166  16.391   4.446
 1081   2HG   LYS 165          2HG       LYS 165 -14.593  15.673   5.941
 1082   1HD   LYS 165          1HD       LYS 165 -17.488  16.466   5.402
 1083   2HD   LYS 165          2HD       LYS 165 -16.812  14.839   5.285
 1084   1HE   LYS 165          1HE       LYS 165 -16.191  14.931   7.699
 1085   2HE   LYS 165          2HE       LYS 165 -16.922  16.538   7.815
 1086   1HZ   LYS 165          1HZ       LYS 165 -19.058  15.533   7.191
 1087   2HZ   LYS 165          2HZ       LYS 165 -18.378  14.050   7.099
 1088   3HZ   LYS 165          3HZ       LYS 165 -18.472  14.816   8.533
 1089    H    LYS 166           H        LYS 166 -15.407  21.269   4.537
 1090    HA   LYS 166           HA       LYS 166 -14.353  22.532   6.940
 1091   1HB   LYS 166          1HB       LYS 166 -15.405  23.666   4.333
 1092   2HB   LYS 166          2HB       LYS 166 -14.611  24.644   5.565
 1093   1HG   LYS 166          1HG       LYS 166 -13.289  22.282   4.160
 1094   2HG   LYS 166          2HG       LYS 166 -13.168  23.964   3.632
 1095   1HD   LYS 166          1HD       LYS 166 -11.957  24.644   5.540
 1096   2HD   LYS 166          2HD       LYS 166 -12.311  23.138   6.424
 1097   1HE   LYS 166          1HE       LYS 166 -11.041  21.839   4.759
 1098   2HE   LYS 166          2HE       LYS 166 -10.667  23.318   3.868
 1099   1HZ   LYS 166          1HZ       LYS 166  -9.441  24.123   5.798
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.816  22.782   6.664
 1101   3HZ   LYS 166          3HZ       LYS 166  -8.850  22.665   5.350
 1102    H    ASP 167           H        ASP 167 -17.582  21.995   5.695
 1103    HA   ASP 167           HA       ASP 167 -18.685  23.293   8.116
 1104   1HB   ASP 167          1HB       ASP 167 -18.624  25.029   6.220
 1105   2HB   ASP 167          2HB       ASP 167 -19.793  24.023   5.370
 1106    H    ASP 168           H        ASP 168 -20.551  22.309   8.846
 1107    HA   ASP 168           HA       ASP 168 -21.078  19.664   7.938
 1108   1HB   ASP 168          1HB       ASP 168 -22.912  19.686   9.580
 1109   2HB   ASP 168          2HB       ASP 168 -21.434  20.354  10.248
 1110    H    SER 169           H        SER 169 -22.451  22.749   6.939
 1111    HA   SER 169           HA       SER 169 -24.737  21.388   5.576
 1112   1HB   SER 169          1HB       SER 169 -24.092  24.337   6.035
 1113   2HB   SER 169          2HB       SER 169 -25.498  23.746   5.140
 1114    HG   SER 169           HG       SER 169 -24.926  22.988   7.828
 1115    H    CYS 170           H        CYS 170 -21.762  21.329   4.736
 1116    HA   CYS 170           HA       CYS 170 -22.053  22.452   1.978
 1117   1HB   CYS 170          1HB       CYS 170 -19.905  22.736   3.532
 1118   2HB   CYS 170          2HB       CYS 170 -19.542  21.103   3.012
 1119    H    SER 171           H        SER 171 -21.349  20.940   0.191
 1120    HA   SER 171           HA       SER 171 -21.680  18.048   0.741
 1121   1HB   SER 171          1HB       SER 171 -23.591  17.827  -0.818
 1122   2HB   SER 171          2HB       SER 171 -23.999  18.823   0.583
 1123    HG   SER 171           HG       SER 171 -24.727  19.759  -1.387
 1124    H    PHE 172           H        PHE 172 -20.011  20.408  -0.806
 1125    HA   PHE 172           HA       PHE 172 -19.860  19.505  -3.524
 1126   1HB   PHE 172          1HB       PHE 172 -19.105  21.716  -3.004
 1127   2HB   PHE 172          2HB       PHE 172 -18.037  21.136  -1.732
 1128    HD1  PHE 172           HD1      PHE 172 -15.897  20.040  -2.221
 1129    HD2  PHE 172           HD2      PHE 172 -18.419  21.462  -5.402
 1130    HE1  PHE 172           HE1      PHE 172 -14.053  19.705  -3.830
 1131    HE2  PHE 172           HE2      PHE 172 -16.494  21.336  -6.981
 1132    HZ   PHE 172           HZ       PHE 172 -14.291  20.491  -6.182
 1133    H    VAL 173           H        VAL 173 -18.606  18.000  -4.530
 1134    HA   VAL 173           HA       VAL 173 -16.393  16.736  -2.980
 1135    HB   VAL 173           HB       VAL 173 -18.297  15.266  -4.843
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.042  13.231  -4.088
 1137   2HG1  VAL 173          2HG1      VAL 173 -15.946  14.337  -4.913
 1138   3HG1  VAL 173          3HG1      VAL 173 -15.942  14.252  -3.140
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.455  15.606  -2.776
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.817  13.963  -2.687
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.013  15.292  -1.808
 1142    H    GLY 174           H        GLY 174 -14.507  17.089  -3.958
 1143   1HA   GLY 174          1HA       GLY 174 -14.501  18.104  -6.729
 1144   2HA   GLY 174          2HA       GLY 174 -13.111  17.991  -5.631
 1145    H    LYS 175           H        LYS 175 -13.835  17.071  -8.555
 1146    HA   LYS 175           HA       LYS 175 -13.439  14.227  -8.578
 1147   1HB   LYS 175          1HB       LYS 175 -12.685  16.257 -10.730
 1148   2HB   LYS 175          2HB       LYS 175 -12.902  14.528 -10.953
 1149   1HG   LYS 175          1HG       LYS 175 -15.087  16.528 -10.237
 1150   2HG   LYS 175          2HG       LYS 175 -14.818  15.755 -11.797
 1151   1HD   LYS 175          1HD       LYS 175 -15.267  13.523 -10.752
 1152   2HD   LYS 175          2HD       LYS 175 -15.633  14.343  -9.215
 1153   1HE   LYS 175          1HE       LYS 175 -17.432  15.633 -10.323
 1154   2HE   LYS 175          2HE       LYS 175 -17.075  14.831 -11.857
 1155   1HZ   LYS 175          1HZ       LYS 175 -17.684  12.711 -10.816
 1156   2HZ   LYS 175          2HZ       LYS 175 -18.015  13.453  -9.397
 1157   3HZ   LYS 175          3HZ       LYS 175 -18.928  13.761 -10.714
 1158    H    THR 176           H        THR 176 -11.254  16.854  -7.959
 1159    HA   THR 176           HA       THR 176  -9.056  14.915  -7.613
 1160    HB   THR 176           HB       THR 176  -7.562  16.905  -8.669
 1161    HG1  THR 176           HG1      THR 176  -8.791  18.162  -9.754
 1162   1HG2  THR 176          1HG2      THR 176  -7.314  14.548  -9.228
 1163   2HG2  THR 176          2HG2      THR 176  -8.783  14.610 -10.233
 1164   3HG2  THR 176          3HG2      THR 176  -7.363  15.528 -10.708
 1165    H    TRP 177           H        TRP 177  -7.287  15.782  -6.328
 1166    HA   TRP 177           HA       TRP 177  -8.235  17.030  -4.014
 1167   1HB   TRP 177          1HB       TRP 177  -6.261  15.670  -3.998
 1168   2HB   TRP 177          2HB       TRP 177  -5.452  16.703  -5.148
 1169    HD1  TRP 177           HD1      TRP 177  -3.552  17.697  -4.104
 1170    HE1  TRP 177           HE1      TRP 177  -2.933  18.938  -1.925
 1171    HE3  TRP 177           HE3      TRP 177  -7.867  16.886  -1.535
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.890  18.791   0.773
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.902  17.270   0.922
 1174    HH2  TRP 177           HH2      TRP 177  -5.904  18.142   2.086
 1175    H    THR 178           H        THR 178  -6.529  18.534  -6.811
 1176    HA   THR 178           HA       THR 178  -6.190  21.142  -5.751
 1177    HB   THR 178           HB       THR 178  -6.519  21.867  -8.198
 1178    HG1  THR 178           HG1      THR 178  -6.131  19.301  -9.059
 1179   1HG2  THR 178          1HG2      THR 178  -4.340  19.840  -7.685
 1180   2HG2  THR 178          2HG2      THR 178  -4.399  21.036  -8.990
 1181   3HG2  THR 178          3HG2      THR 178  -4.295  21.569  -7.304
 1182    H    LEU 179           H        LEU 179  -8.989  19.771  -7.563
 1183    HA   LEU 179           HA       LEU 179 -10.503  22.142  -7.663
 1184   1HB   LEU 179          1HB       LEU 179 -11.478  19.251  -7.521
 1185   2HB   LEU 179          2HB       LEU 179 -12.472  20.634  -7.970
 1186    HG   LEU 179           HG       LEU 179 -10.071  19.589  -9.494
 1187   1HD1  LEU 179          1HD1      LEU 179 -13.044  19.638 -10.167
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.739  19.012 -11.204
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.096  18.216  -9.670
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.763  21.204 -11.280
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.905  21.941 -10.136
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.150  22.005  -9.835
 1193    H    TYR 180           H        TYR 180 -10.248  19.727  -5.050
 1194    HA   TYR 180           HA       TYR 180 -12.419  20.832  -3.462
 1195   1HB   TYR 180          1HB       TYR 180 -11.887  18.637  -2.911
 1196   2HB   TYR 180          2HB       TYR 180 -10.153  18.897  -2.992
 1197    HD1  TYR 180           HD1      TYR 180 -13.148  20.015  -0.970
 1198    HD2  TYR 180           HD2      TYR 180  -8.917  19.186  -1.037
 1199    HE1  TYR 180           HE1      TYR 180 -12.991  20.526   1.466
 1200    HE2  TYR 180           HE2      TYR 180  -8.795  19.580   1.414
 1201    HH   TYR 180           HH       TYR 180  -9.950  20.077   3.308
 1202    H    LEU 181           H        LEU 181  -8.827  21.078  -3.300
 1203    HA   LEU 181           HA       LEU 181  -8.711  22.958  -1.203
 1204   1HB   LEU 181          1HB       LEU 181  -6.921  22.476  -3.616
 1205   2HB   LEU 181          2HB       LEU 181  -6.537  23.668  -2.407
 1206    HG   LEU 181           HG       LEU 181  -6.899  20.654  -1.919
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.389  20.888  -1.398
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.867  20.892  -3.097
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.458  22.424  -2.261
 1210   1HD2  LEU 181          1HD2      LEU 181  -7.485  21.743   0.133
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.853  21.121   0.335
 1212   3HD2  LEU 181          3HD2      LEU 181  -6.115  22.861   0.004
 1213    H    LYS 182           H        LYS 182  -9.066  23.528  -4.731
 1214    HA   LYS 182           HA       LYS 182  -9.032  26.401  -4.643
 1215   1HB   LYS 182          1HB       LYS 182  -8.830  24.833  -6.672
 1216   2HB   LYS 182          2HB       LYS 182 -10.591  24.704  -6.641
 1217   1HG   LYS 182          1HG       LYS 182 -10.706  27.219  -6.899
 1218   2HG   LYS 182          2HG       LYS 182  -8.932  27.247  -6.943
 1219   1HD   LYS 182          1HD       LYS 182  -9.111  25.609  -8.947
 1220   2HD   LYS 182          2HD       LYS 182 -10.845  25.943  -8.930
 1221   1HE   LYS 182          1HE       LYS 182  -9.942  27.385 -10.573
 1222   2HE   LYS 182          2HE       LYS 182 -10.272  28.422  -9.180
 1223   1HZ   LYS 182          1HZ       LYS 182  -7.895  28.292  -8.624
 1224   2HZ   LYS 182          2HZ       LYS 182  -7.610  27.289  -9.887
 1225   3HZ   LYS 182          3HZ       LYS 182  -8.047  28.830 -10.157
 1226    H    HIS 183           H        HIS 183 -11.708  24.003  -4.416
 1227    HA   HIS 183           HA       HIS 183 -13.863  25.872  -4.281
 1228   1HB   HIS 183          1HB       HIS 183 -14.407  23.596  -4.657
 1229   2HB   HIS 183          2HB       HIS 183 -13.472  23.010  -3.301
 1230    HD1  HIS 183           HD1      HIS 183 -16.898  24.632  -3.949
 1231    HD2  HIS 183           HD2      HIS 183 -14.526  23.063  -0.847
 1232    HE1  HIS 183           HE1      HIS 183 -18.409  24.451  -1.899
 1233    H    VAL 184           H        VAL 184 -11.772  24.444  -1.729
 1234    HA   VAL 184           HA       VAL 184 -13.150  25.544   0.513
 1235    HB   VAL 184           HB       VAL 184 -10.301  24.606   0.062
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.884  24.757   2.459
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.113  26.365   1.768
 1238   3HG1  VAL 184          3HG1      VAL 184 -11.437  25.609   2.699
 1239   1HG2  VAL 184          1HG2      VAL 184 -11.889  22.852   0.155
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.177  22.890   1.748
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.804  23.611   1.478
 1242    H    ALA 185           H        ALA 185 -10.404  26.815  -1.406
 1243    HA   ALA 185           HA       ALA 185  -9.910  29.059   0.237
 1244   1HB   ALA 185          1HB       ALA 185  -9.470  28.742  -2.774
 1245   2HB   ALA 185          2HB       ALA 185  -8.695  29.952  -1.728
 1246   3HB   ALA 185          3HB       ALA 185  -8.348  28.227  -1.495
 1247    H    GLU 186           H        GLU 186 -12.315  28.560  -2.340
 1248    HA   GLU 186           HA       GLU 186 -13.014  31.435  -2.456
 1249   1HB   GLU 186          1HB       GLU 186 -14.073  28.960  -3.881
 1250   2HB   GLU 186          2HB       GLU 186 -14.739  30.574  -4.124
 1251   1HG   GLU 186          1HG       GLU 186 -11.828  29.828  -4.654
 1252   2HG   GLU 186          2HG       GLU 186 -13.098  29.856  -5.871
 1253    H    CYS 187           H        CYS 187 -14.530  28.338  -1.409
 1254    HA   CYS 187           HA       CYS 187 -17.015  29.737  -0.689
 1255   1HB   CYS 187          1HB       CYS 187 -16.200  26.794  -0.601
 1256   2HB   CYS 187          2HB       CYS 187 -17.811  27.400  -0.191
 1257    HG   CYS 187           HG       CYS 187 -18.282  28.629  -2.462
 1258    H    HIS 188           H        HIS 188 -14.156  28.625   1.025
 1259    HA   HIS 188           HA       HIS 188 -15.557  29.164   3.628
 1260   1HB   HIS 188          1HB       HIS 188 -13.490  26.986   3.096
 1261   2HB   HIS 188          2HB       HIS 188 -14.228  27.356   4.659
 1262    HD1  HIS 188           HD1      HIS 188 -17.053  26.959   4.686
 1263    HD2  HIS 188           HD2      HIS 188 -14.747  25.287   1.591
 1264    HE1  HIS 188           HE1      HIS 188 -18.497  25.136   3.612
 1265    H    GLN 189           H        GLN 189 -13.209  30.233   1.525
 1266    HA   GLN 189           HA       GLN 189 -11.284  31.519   1.720
 1267   1HB   GLN 189          1HB       GLN 189 -12.743  32.461   4.240
 1268   2HB   GLN 189          2HB       GLN 189 -11.440  33.325   3.406
 1269   1HG   GLN 189          1HG       GLN 189 -12.839  33.427   1.348
 1270   2HG   GLN 189          2HG       GLN 189 -14.182  32.698   2.228
 1271   1HE2  GLN 189          1HE2      GLN 189 -13.699  35.512   0.985
 1272   2HE2  GLN 189          2HE2      GLN 189 -14.164  36.578   2.301
 1273    H    ASP 190           H        ASP 190 -10.729  28.945   2.586
 1274    HA   ASP 190           HA       ASP 190  -8.741  29.426   4.771
 1275   1HB   ASP 190          1HB       ASP 190 -10.745  28.417   5.807
 1276   2HB   ASP 190          2HB       ASP 190 -10.715  27.107   4.627
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  -8.030  29.894 -12.913
    2   2H5*    G   1          2H5*        G   1  -8.932  28.382 -12.711
    3    H4*    G   1           H4*        G   1  -8.378  28.647 -15.029
    4    H3*    G   1           H3*        G   1  -6.679  26.533 -13.684
    5    H2*    G   1           H2*        G   1  -5.908  25.957 -15.910
    6   2HO*    G   1          2HO*        G   1  -8.097  26.548 -16.897
    7    H1*    G   1           H1*        G   1  -5.354  28.523 -16.562
    8    H8     G   1           H8         G   1  -4.698  28.659 -12.876
    9    H1     G   1           H1         G   1   0.000  25.831 -16.234
   10   1H2     G   1          1H2         G   1  -0.752  25.138 -18.144
   11   2H2     G   1          2H2         G   1  -2.346  25.589 -18.720
   12   1H5*    G   2          1H5*        G   2  -8.252  24.492 -16.899
   13   2H5*    G   2          2H5*        G   2  -8.871  22.905 -16.433
   14    H4*    G   2           H4*        G   2  -7.281  22.723 -18.259
   15    H3*    G   2           H3*        G   2  -6.243  21.598 -15.644
   16    H2*    G   2           H2*        G   2  -4.423  20.698 -16.978
   17   2HO*    G   2          2HO*        G   2  -5.948  20.392 -18.921
   18    H1*    G   2           H1*        G   2  -3.978  23.044 -18.278
   19    H8     G   2           H8         G   2  -5.089  24.172 -14.849
   20    H1     G   2           H1         G   2   0.950  21.964 -14.993
   21   1H2     G   2          1H2         G   2   1.244  20.729 -16.739
   22   2H2     G   2          2H2         G   2   0.032  20.601 -18.000
   23   1H5*    G   3          1H5*        G   3  -5.736  18.442 -18.377
   24   2H5*    G   3          2H5*        G   3  -6.353  16.922 -17.722
   25    H4*    G   3           H4*        G   3  -4.026  16.669 -18.473
   26    H3*    G   3           H3*        G   3  -4.479  16.534 -15.467
   27    H2*    G   3           H2*        G   3  -2.159  15.887 -15.308
   28   2HO*    G   3          2HO*        G   3  -2.425  14.613 -17.443
   29    H1*    G   3           H1*        G   3  -1.260  17.691 -17.185
   30    H8     G   3           H8         G   3  -3.854  19.527 -15.106
   31    H1     G   3           H1         G   3   1.931  19.062 -12.315
   32   1H2     G   3          1H2         G   3   3.050  17.455 -13.211
   33   2H2     G   3          2H2         G   3   2.491  16.623 -14.648
   34   1H5*    C   4          1H5*        C   4  -2.303  13.069 -15.972
   35   2H5*    C   4          2H5*        C   4  -3.048  11.729 -15.105
   36    H4*    C   4           H4*        C   4  -0.802  11.982 -14.311
   37    H3*    C   4           H3*        C   4  -2.800  13.036 -12.276
   38    H2*    C   4           H2*        C   4  -0.940  13.261 -10.811
   39   2HO*    C   4          2HO*        C   4  -0.012  11.124 -11.635
   40    H1*    C   4           H1*        C   4   0.830  14.116 -12.800
   41   1H4     C   4          1H4         C   4  -1.249  18.993  -9.263
   42   2H4     C   4          2H4         C   4  -2.765  19.032 -10.129
   43    H5     C   4           H5         C   4  -3.304  17.506 -11.900
   44    H6     C   4           H6         C   4  -2.532  15.536 -13.128
   45   1H5*    C   5          1H5*        C   5  -1.661  11.606  -9.385
   46   2H5*    C   5          2H5*        C   5  -2.750  10.467  -8.612
   47    H4*    C   5           H4*        C   5  -2.091  12.415  -7.246
   48    H3*    C   5           H3*        C   5  -4.584  11.220  -7.115
   49    H2*    C   5           H2*        C   5  -5.608  12.816  -8.639
   50   2HO*    C   5          2HO*        C   5  -5.835  13.652  -5.948
   51    H1*    C   5           H1*        C   5  -4.199  15.014  -7.180
   52   1H4     C   5          1H4         C   5  -6.388  18.386 -12.055
   53   2H4     C   5          2H4         C   5  -6.166  17.064 -13.169
   54    H5     C   5           H5         C   5  -5.357  14.916 -12.493
   55    H6     C   5           H6         C   5  -4.671  13.555 -10.585
   56   1H5*    A   6          1H5*        A   6  -2.336  14.384  -4.892
   57   2H5*    A   6          2H5*        A   6  -1.072  13.156  -4.897
   58    H4*    A   6           H4*        A   6  -0.279  15.022  -3.866
   59    H3*    A   6           H3*        A   6  -0.697  12.817  -1.909
   60    H2*    A   6           H2*        A   6  -0.211  14.268  -0.049
   61   2HO*    A   6          2HO*        A   6   1.565  15.451  -0.626
   62    H1*    A   6           H1*        A   6  -1.393  16.552  -0.930
   63    H8     A   6           H8         A   6  -4.101  14.531  -2.148
   64   1H6     A   6          1H6         A   6  -5.922  13.612   3.713
   65   2H6     A   6          2H6         A   6  -6.299  13.301   2.035
   66    H2     A   6           H2         A   6  -1.951  15.583   3.827
   67   1H5*    U   7          1H5*        U   7   3.114  12.109   0.428
   68   2H5*    U   7          2H5*        U   7   2.134  13.461  -0.130
   69    H4*    U   7           H4*        U   7   4.029  14.247   1.145
   70    H3*    U   7           H3*        U   7   3.304  15.398  -1.281
   71    H2*    U   7           H2*        U   7   4.915  14.172  -2.521
   72   2HO*    U   7          2HO*        U   7   5.915  16.686  -1.715
   73    H1*    U   7           H1*        U   7   6.935  14.661  -0.297
   74    H3     U   7           H3         U   7  10.207  12.560  -2.528
   75    H5     U   7           H5         U   7   7.089   9.774  -2.504
   76    H6     U   7           H6         U   7   5.589  11.534  -1.684
   77   1H5*    A   8          1H5*        A   8   4.344  19.090  -1.459
   78   2H5*    A   8          2H5*        A   8   3.724  19.971  -0.058
   79    H4*    A   8           H4*        A   8   2.940  21.097  -1.954
   80    H3*    A   8           H3*        A   8   1.141  20.249  -0.086
   81    H2*    A   8           H2*        A   8   0.586  18.272  -1.386
   82   2HO*    A   8          2HO*        A   8  -1.422  19.292  -0.797
   83    H1*    A   8           H1*        A   8   0.364  20.215  -3.685
   84    H8     A   8           H8         A   8   2.357  16.935  -3.653
   85   1H6     A   8          1H6         A   8  -1.618  15.151  -8.065
   86   2H6     A   8          2H6         A   8  -0.048  14.863  -7.353
   87    H2     A   8           H2         A   8  -3.217  18.860  -6.203
   88   1H5*    C   9          1H5*        C   9  -2.073  21.732  -0.896
   89   2H5*    C   9          2H5*        C   9  -2.321  23.271  -0.067
   90    H4*    C   9           H4*        C   9  -3.928  21.717   0.716
   91    H3*    C   9           H3*        C   9  -1.849  22.366   2.778
   92    H2*    C   9           H2*        C   9  -3.029  20.902   4.293
   93   2HO*    C   9          2HO*        C   9  -5.169  21.638   3.097
   94    H1*    C   9           H1*        C   9  -3.471  18.876   2.551
   95   1H4     C   9          1H4         C   9   2.236  17.653   5.203
   96   2H4     C   9          2H4         C   9   2.977  18.105   3.680
   97    H5     C   9           H5         C   9   1.775  19.208   1.934
   98    H6     C   9           H6         C   9  -0.410  20.027   1.236
   99   1H5*    C  10          1H5*        C  10  -5.273  22.562   4.876
  100   2H5*    C  10          2H5*        C  10  -5.448  23.979   5.909
  101    H4*    C  10           H4*        C  10  -5.540  21.895   7.214
  102    H3*    C  10           H3*        C  10  -3.048  23.558   7.710
  103    H2*    C  10           H2*        C  10  -2.635  22.057   9.544
  104   2HO*    C  10          2HO*        C  10  -4.971  21.833  10.108
  105    H1*    C  10           H1*        C  10  -3.193  19.794   8.049
  106   1H4     C  10          1H4         C  10   3.041  20.373   7.299
  107   2H4     C  10          2H4         C  10   2.775  21.198   5.780
  108    H5     C  10           H5         C  10   0.614  21.953   5.052
  109    H6     C  10           H6         C  10  -1.765  22.023   5.635
  110   1H5*    U  11          1H5*        U  11  -4.339  23.868  11.670
  111   2H5*    U  11          2H5*        U  11  -3.893  25.473  12.265
  112    H4*    U  11           H4*        U  11  -2.671  23.513  13.293
  113    H3*    U  11           H3*        U  11  -1.068  25.641  11.883
  114    H2*    U  11           H2*        U  11   0.856  24.641  12.913
  115   2HO*    U  11          2HO*        U  11  -0.396  24.184  14.976
  116    H1*    U  11           H1*        U  11   0.021  22.070  12.399
  117    H3     U  11           H3         U  11   3.592  22.857   9.634
  118    H5     U  11           H5         U  11   0.404  24.786   7.723
  119    H6     U  11           H6         U  11  -0.991  24.312   9.688
  120   1H5*    C  12          1H5*        C  12   0.789  26.581  16.040
  121   2H5*    C  12          2H5*        C  12   1.755  27.917  15.408
  122    H4*    C  12           H4*        C  12   2.267  24.947  15.413
  123    H3*    C  12           H3*        C  12   3.418  27.045  16.735
  124    H2*    C  12           H2*        C  12   4.003  28.222  14.734
  125   2HO*    C  12          2HO*        C  12   6.016  27.285  16.165
  126    H1*    C  12           H1*        C  12   5.127  25.618  13.654
  127   1H4     C  12          1H4         C  12   5.954  29.553   8.715
  128   2H4     C  12          2H4         C  12   4.286  30.064   8.768
  129    H5     C  12           H5         C  12   2.727  29.285  10.418
  130    H6     C  12           H6         C  12   2.456  27.840  12.382
  131   1H5*    U  13          1H5*        U  13   4.531  22.549  17.692
  132   2H5*    U  13          2H5*        U  13   5.371  22.573  19.244
  133    H4*    U  13           H4*        U  13   6.409  20.749  18.342
  134    H3*    U  13           H3*        U  13   8.171  22.912  18.176
  135    H2*    U  13           H2*        U  13   7.500  23.420  15.919
  136   2HO*    U  13          2HO*        U  13   9.811  21.753  15.921
  137    H1*    U  13           H1*        U  13   7.700  20.417  15.408
  138    H3     U  13           H3         U  13   7.273  21.219  10.961
  139    H5     U  13           H5         U  13   4.326  23.676  12.622
  140    H6     U  13           H6         U  13   5.073  22.980  14.855
  141   1H5*    U  14          1H5*        U  14  10.902  18.109  18.748
  142   2H5*    U  14          2H5*        U  14  12.345  18.892  18.110
  143    H4*    U  14           H4*        U  14   9.628  18.658  16.774
  144    H3*    U  14           H3*        U  14  12.021  17.051  16.655
  145    H2*    U  14           H2*        U  14  13.135  18.617  15.330
  146   2HO*    U  14          2HO*        U  14  11.612  16.920  13.640
  147    H1*    U  14           H1*        U  14  10.445  19.281  14.045
  148    H3     U  14           H3         U  14  12.715  21.747  10.946
  149    H5     U  14           H5         U  14  14.303  23.090  14.576
  150    H6     U  14           H6         U  14  12.966  21.384  15.734
  151   1H5*    G  15          1H5*        G  15   7.234  14.451  15.137
  152   2H5*    G  15          2H5*        G  15   7.735  15.946  14.326
  153    H4*    G  15           H4*        G  15   5.692  16.007  16.562
  154    H3*    G  15           H3*        G  15   5.222  15.349  13.645
  155    H2*    G  15           H2*        G  15   3.013  16.304  13.977
  156   2HO*    G  15          2HO*        G  15   2.885  15.559  16.303
  157    H1*    G  15           H1*        G  15   4.031  18.540  15.108
  158    H8     G  15           H8         G  15   6.839  17.778  12.778
  159    H1     G  15           H1         G  15   1.575  19.820   9.701
  160   1H2     G  15          1H2         G  15  -0.155  19.612  10.977
  161   2H2     G  15          2H2         G  15  -0.014  19.191  12.672
  162   1H5*    G  16          1H5*        G  16   1.641  14.084  15.337
  163   2H5*    G  16          2H5*        G  16   1.216  12.464  14.770
  164    H4*    G  16           H4*        G  16  -0.622  14.019  14.423
  165    H3*    G  16           H3*        G  16   0.678  13.124  11.833
  166    H2*    G  16           H2*        G  16  -1.203  14.229  10.756
  167   2HO*    G  16          2HO*        G  16  -2.739  13.612  12.555
  168    H1*    G  16           H1*        G  16  -0.960  16.490  12.220
  169    H8     G  16           H8         G  16   2.637  15.471  11.972
  170    H1     G  16           H1         G  16   0.256  17.166   6.275
  171   1H2     G  16          1H2         G  16  -1.881  17.569   6.420
  172   2H2     G  16          2H2         G  16  -2.773  17.203   7.884
  173   1H5*    G  17          1H5*        G  17  -3.227  12.190  10.872
  174   2H5*    G  17          2H5*        G  17  -3.323  10.632  10.036
  175    H4*    G  17           H4*        G  17  -4.164  12.513   8.678
  176    H3*    G  17           H3*        G  17  -1.691  11.152   7.580
  177    H2*    G  17           H2*        G  17  -2.025  12.575   5.613
  178   2HO*    G  17          2HO*        G  17  -4.442  12.499   5.880
  179    H1*    G  17           H1*        G  17  -2.200  14.829   7.004
  180    H8     G  17           H8         G  17  -0.015  13.043   9.402
  181    H1     G  17           H1         G  17   3.049  15.008   4.110
  182   1H2     G  17          1H2         G  17   1.616  15.523   2.560
  183   2H2     G  17          2H2         G  17  -0.108  15.258   2.770
  184   1H5*    C  18          1H5*        C  18  -3.625  10.990   4.119
  185   2H5*    C  18          2H5*        C  18  -3.563   9.395   3.350
  186    H4*    C  18           H4*        C  18  -2.445  11.024   1.935
  187    H3*    C  18           H3*        C  18  -0.413   9.240   3.321
  188    H2*    C  18           H2*        C  18   1.211  10.281   1.750
  189   2HO*    C  18          2HO*        C  18   0.122  10.872  -0.128
  190    H1*    C  18           H1*        C  18   0.461  12.698   2.495
  191   1H4     C  18          1H4         C  18   4.519  11.098   7.072
  192   2H4     C  18          2H4         C  18   3.172  10.721   8.118
  193    H5     C  18           H5         C  18   0.889  10.714   7.376
  194    H6     C  18           H6         C  18  -0.556  11.017   5.439
  195   1H5*    C  19          1H5*        C  19   0.893   8.845  -0.409
  196   2H5*    C  19          2H5*        C  19   1.086   7.155  -0.908
  197    H4*    C  19           H4*        C  19   3.082   8.339  -1.422
  198    H3*    C  19           H3*        C  19   3.563   6.652   1.058
  199    H2*    C  19           H2*        C  19   5.896   7.131   0.607
  200   2HO*    C  19          2HO*        C  19   5.125   8.714  -1.652
  201    H1*    C  19           H1*        C  19   5.427   9.831   0.425
  202   1H4     C  19          1H4         C  19   6.171   8.457   6.625
  203   2H4     C  19          2H4         C  19   4.454   8.172   6.786
  204    H5     C  19           H5         C  19   2.938   8.159   4.928
  205    H6     C  19           H6         C  19   2.744   8.569   2.523
  206   1H5*    U  20          1H5*        U  20   6.460   5.318  -1.315
  207   2H5*    U  20          2H5*        U  20   6.543   3.555  -1.422
  208    H4*    U  20           H4*        U  20   8.704   4.500  -0.866
  209    H3*    U  20           H3*        U  20   7.512   3.070   1.527
  210    H2*    U  20           H2*        U  20   9.760   3.269   2.437
  211   2HO*    U  20          2HO*        U  20  10.845   3.059   0.268
  212    H1*    U  20           H1*        U  20   9.893   5.907   1.822
  213    H3     U  20           H3         U  20   8.997   5.425   6.322
  214    H5     U  20           H5         U  20   5.234   5.351   4.498
  215    H6     U  20           H6         U  20   6.352   5.310   2.309
  216   1H5*    G  21          1H5*        G  21  11.139   1.175   0.646
  217   2H5*    G  21          2H5*        G  21  11.093  -0.571   0.870
  218    H4*    G  21           H4*        G  21  12.970   0.439   2.046
  219    H3*    G  21           H3*        G  21  10.876  -0.647   3.951
  220    H2*    G  21           H2*        G  21  12.546  -0.220   5.680
  221   2HO*    G  21          2HO*        G  21  14.394  -0.695   4.082
  222    H1*    G  21           H1*        G  21  13.005   2.302   4.809
  223    H8     G  21           H8         G  21   9.354   1.753   3.950
  224    H1     G  21           H1         G  21  10.389   2.626  10.239
  225   1H2     G  21          1H2         G  21  12.482   2.345  10.691
  226   2H2     G  21          2H2         G  21  13.684   2.137   9.433
  227   1H5*    G  22          1H5*        G  22  14.503  -2.360   5.152
  228   2H5*    G  22          2H5*        G  22  14.376  -4.105   5.381
  229    H4*    G  22           H4*        G  22  15.412  -3.045   7.317
  230    H3*    G  22           H3*        G  22  12.647  -4.203   7.844
  231    H2*    G  22           H2*        G  22  12.983  -3.659  10.132
  232   2HO*    G  22          2HO*        G  22  15.274  -4.321  10.157
  233    H1*    G  22           H1*        G  22  14.131  -1.202   9.693
  234    H8     G  22           H8         G  22  11.366  -1.436   7.125
  235    H1     G  22           H1         G  22   9.209  -0.356  13.087
  236   1H2     G  22          1H2         G  22  10.749  -0.798  14.527
  237   2H2     G  22          2H2         G  22  12.375  -1.247  14.049
  238   1H5*    U  23          1H5*        U  23  12.449  -8.098  10.680
  239   2H5*    U  23          2H5*        U  23  11.481  -6.767  10.009
  240    H4*    U  23           H4*        U  23  12.920  -6.693  12.676
  241    H3*    U  23           H3*        U  23  10.001  -6.839  11.826
  242    H2*    U  23           H2*        U  23   9.509  -6.076  14.035
  243   2HO*    U  23          2HO*        U  23  11.363  -7.188  15.098
  244    H1*    U  23           H1*        U  23  11.329  -4.046  13.763
  245    H3     U  23           H3         U  23   6.851  -2.769  13.182
  246    H5     U  23           H5         U  23   8.333  -3.498   9.340
  247    H6     U  23           H6         U  23  10.409  -4.347  10.353
  248   1H5*    U  24          1H5*        U  24   9.526  -8.761  14.937
  249   2H5*    U  24          2H5*        U  24   8.824 -10.382  14.895
  250    H4*    U  24           H4*        U  24   7.464  -9.011  16.309
  251    H3*    U  24           H3*        U  24   6.172  -9.334  13.598
  252    H2*    U  24           H2*        U  24   4.180  -8.551  14.582
  253   2HO*    U  24          2HO*        U  24   4.442  -9.622  16.696
  254    H1*    U  24           H1*        U  24   5.537  -6.514  15.889
  255    H3     U  24           H3         U  24   2.970  -4.871  12.383
  256    H5     U  24           H5         U  24   6.577  -6.055  10.606
  257    H6     U  24           H6         U  24   7.292  -6.968  12.771
  258   1H5*    A  25          1H5*        A  25   4.708 -13.219  11.954
  259   2H5*    A  25          2H5*        A  25   6.413 -13.539  11.720
  260    H4*    A  25           H4*        A  25   5.512 -12.939   9.595
  261    H3*    A  25           H3*        A  25   7.662 -11.448  10.553
  262    H2*    A  25           H2*        A  25   6.203  -9.665  11.297
  263   2HO*    A  25          2HO*        A  25   7.866  -8.773  10.029
  264    H1*    A  25           H1*        A  25   4.875 -10.146   8.554
  265    H8     A  25           H8         A  25   3.348  -9.452  12.104
  266   1H6     A  25          1H6         A  25   0.364  -4.858   9.113
  267   2H6     A  25          2H6         A  25   0.362  -5.861  10.552
  268    H2     A  25           H2         A  25   3.460  -6.533   6.391
  269   1H5*    G  26          1H5*        G  26   7.855 -14.133   5.382
  270   2H5*    G  26          2H5*        G  26   7.841 -12.388   5.195
  271    H4*    G  26           H4*        G  26   5.763 -13.095   7.114
  272    H3*    G  26           H3*        G  26   6.079 -15.296   5.366
  273    H2*    G  26           H2*        G  26   5.908 -13.731   3.552
  274   2HO*    G  26          2HO*        G  26   3.440 -15.151   3.880
  275    H1*    G  26           H1*        G  26   3.458 -12.845   5.133
  276    H8     G  26           H8         G  26   5.313 -12.429   1.829
  277    H1     G  26           H1         G  26   0.594  -8.233   2.779
  278   1H2     G  26          1H2         G  26   0.343  -7.919   4.895
  279   2H2     G  26          2H2         G  26   1.021  -9.010   6.091
  280   1H5*    U  27          1H5*        U  27   4.690 -15.958   8.503
  281   2H5*    U  27          2H5*        U  27   3.982 -17.582   8.705
  282    H4*    U  27           H4*        U  27   3.609 -16.686  10.799
  283    H3*    U  27           H3*        U  27   1.119 -15.837   9.249
  284    H2*    U  27           H2*        U  27   0.408 -14.668  11.212
  285   2HO*    U  27          2HO*        U  27   1.504 -16.448  12.609
  286    H1*    U  27           H1*        U  27   2.757 -13.468  11.741
  287    H3     U  27           H3         U  27   0.180 -10.290   9.709
  288    H5     U  27           H5         U  27   2.980 -11.609   6.912
  289    H6     U  27           H6         U  27   3.293 -13.637   8.262
  290   1H5*    A  28          1H5*        A  28  -0.642 -16.326  12.834
  291   2H5*    A  28          2H5*        A  28  -1.908 -17.542  12.695
  292    H4*    A  28           H4*        A  28  -2.855 -15.521  13.616
  293    H3*    A  28           H3*        A  28  -3.718 -15.979  10.733
  294    H2*    A  28           H2*        A  28  -5.167 -14.062  11.040
  295   2HO*    A  28          2HO*        A  28  -5.574 -14.671  13.392
  296    H1*    A  28           H1*        A  28  -3.254 -12.534  12.218
  297    H8     A  28           H8         A  28  -1.061 -14.246   9.784
  298   1H6     A  28          1H6         A  28  -3.312 -10.327   5.504
  299   2H6     A  28          2H6         A  28  -2.068 -11.520   5.834
  300    H2     A  28           H2         A  28  -6.244 -10.575   8.821
  301   1H5*    C  29          1H5*        C  29  -7.272 -15.298  11.891
  302   2H5*    C  29          2H5*        C  29  -8.479 -16.483  11.374
  303    H4*    C  29           H4*        C  29  -8.947 -14.336  10.358
  304    H3*    C  29           H3*        C  29  -7.894 -16.354   8.363
  305    H2*    C  29           H2*        C  29  -8.386 -14.670   6.663
  306   2HO*    C  29          2HO*        C  29 -10.372 -13.902   7.863
  307    H1*    C  29           H1*        C  29  -7.231 -12.653   7.969
  308   1H4     C  29          1H4         C  29  -2.507 -15.368   4.651
  309   2H4     C  29          2H4         C  29  -2.013 -16.233   6.088
  310    H5     C  29           H5         C  29  -3.294 -16.271   8.106
  311    H6     C  29           H6         C  29  -5.314 -15.422   9.187
  312   1H5*    C  30          1H5*        C  30 -11.477 -15.250   6.556
  313   2H5*    C  30          2H5*        C  30 -12.341 -16.641   5.887
  314    H4*    C  30           H4*        C  30 -11.786 -14.998   4.151
  315    H3*    C  30           H3*        C  30 -10.184 -17.560   3.895
  316    H2*    C  30           H2*        C  30  -9.519 -16.671   1.732
  317   2HO*    C  30          2HO*        C  30 -11.732 -15.550   1.482
  318    H1*    C  30           H1*        C  30  -8.967 -14.198   2.768
  319   1H4     C  30          1H4         C  30  -3.741 -17.881   2.899
  320   2H4     C  30          2H4         C  30  -4.143 -18.436   4.508
  321    H5     C  30           H5         C  30  -6.171 -17.825   5.643
  322    H6     C  30           H6         C  30  -8.266 -16.572   5.423
  323   1H5*    U  31          1H5*        U  31 -12.216 -16.889   0.156
  324   2H5*    U  31          2H5*        U  31 -13.166 -18.296  -0.319
  325    H4*    U  31           H4*        U  31 -12.029 -17.370  -2.240
  326    H3*    U  31           H3*        U  31 -10.849 -20.025  -1.398
  327    H2*    U  31           H2*        U  31  -9.596 -19.946  -3.438
  328   2HO*    U  31          2HO*        U  31 -11.439 -18.909  -4.656
  329    H1*    U  31           H1*        U  31  -8.865 -17.323  -3.145
  330    H3     U  31           H3         U  31  -5.114 -19.840  -2.190
  331    H5     U  31           H5         U  31  -7.155 -19.460   1.452
  332    H6     U  31           H6         U  31  -9.082 -18.568   0.227
  333   1H5*    C  32          1H5*        C  32 -11.951 -21.065  -5.059
  334   2H5*    C  32          2H5*        C  32 -12.724 -22.651  -5.180
  335    H4*    C  32           H4*        C  32 -10.647 -22.639  -6.437
  336    H3*    C  32           H3*        C  32 -10.374 -24.263  -3.885
  337    H2*    C  32           H2*        C  32  -8.181 -24.855  -4.697
  338   2HO*    C  32          2HO*        C  32  -9.075 -24.864  -7.038
  339    H1*    C  32           H1*        C  32  -7.557 -22.310  -5.556
  340   1H4     C  32          1H4         C  32  -5.255 -23.230   0.327
  341   2H4     C  32          2H4         C  32  -6.811 -22.862   1.038
  342    H5     C  32           H5         C  32  -8.765 -22.361  -0.261
  343    H6     C  32           H6         C  32  -9.638 -22.180  -2.543
  344   1H5*    U  33          1H5*        U  33  -8.527 -26.768  -6.095
  345   2H5*    U  33          2H5*        U  33  -9.268 -28.370  -6.146
  346    H4*    U  33           H4*        U  33  -6.964 -28.647  -5.471
  347    H3*    U  33           H3*        U  33  -8.864 -28.880  -3.116
  348    H2*    U  33           H2*        U  33  -7.100 -29.408  -1.779
  349   2HO*    U  33          2HO*        U  33  -5.110 -29.830  -3.804
  350    H1*    U  33           H1*        U  33  -5.224 -27.775  -3.130
  351    H3     U  33           H3         U  33  -5.238 -26.437   1.242
  352    H5     U  33           H5         U  33  -9.116 -25.532  -0.039
  353    H6     U  33           H6         U  33  -8.558 -26.472  -2.238
  354   1H5*    U  34          1H5*        U  34  -9.166 -34.526  -2.850
  355   2H5*    U  34          2H5*        U  34  -8.437 -33.693  -1.472
  356    H4*    U  34           H4*        U  34  -7.341 -35.829  -1.909
  357    H3*    U  34           H3*        U  34  -5.893 -33.565  -1.359
  358    H2*    U  34           H2*        U  34  -5.537 -33.009  -3.668
  359   2HO*    U  34          2HO*        U  34  -3.344 -34.594  -2.748
  360    H1*    U  34           H1*        U  34  -4.898 -35.950  -4.123
  361    H3     U  34           H3         U  34  -3.810 -35.150  -8.433
  362    H5     U  34           H5         U  34  -7.114 -32.644  -7.877
  363    H6     U  34           H6         U  34  -7.224 -33.395  -5.540
  364   1H5*    C  35          1H5*        C  35  -2.452 -33.919  -0.597
  365   2H5*    C  35          2H5*        C  35  -2.150 -34.927   0.820
  366    H4*    C  35           H4*        C  35  -1.071 -32.758   1.007
  367    H3*    C  35           H3*        C  35  -2.350 -33.927   3.120
  368    H2*    C  35           H2*        C  35  -4.445 -32.852   2.679
  369   2HO*    C  35          2HO*        C  35  -2.966 -31.320   4.570
  370    H1*    C  35           H1*        C  35  -3.001 -30.211   2.281
  371   1H4     C  35          1H4         C  35  -9.132 -29.035   0.931
  372   2H4     C  35          2H4         C  35  -9.124 -30.248  -0.338
  373    H5     C  35           H5         C  35  -7.267 -31.690  -0.727
  374    H6     C  35           H6         C  35  -4.927 -32.113  -0.180
  375   1H5*    G  36          1H5*        G  36   2.229 -30.814   3.427
  376   2H5*    G  36          2H5*        G  36   0.693 -30.755   2.546
  377    H4*    G  36           H4*        G  36   3.216 -32.153   1.576
  378    H3*    G  36           H3*        G  36   1.820 -29.586   0.728
  379    H2*    G  36           H2*        G  36   2.654 -29.995  -1.452
  380   2HO*    G  36          2HO*        G  36   4.844 -30.663  -0.376
  381    H1*    G  36           H1*        G  36   2.593 -32.823  -1.168
  382    H8     G  36           H8         G  36   1.321 -33.061  -3.456
  383    H1     G  36           H1         G  36  -3.208 -28.826  -1.711
  384   1H2     G  36          1H2         G  36  -2.778 -28.005   0.213
  385   2H2     G  36          2H2         G  36  -1.338 -28.425   1.115
  386   1H5*    G  37          1H5*        G  37   4.449 -28.501  -1.143
  387   2H5*    G  37          2H5*        G  37   4.963 -26.817  -1.053
  388    H4*    G  37           H4*        G  37   3.663 -27.556  -3.134
  389    H3*    G  37           H3*        G  37   2.598 -25.210  -1.518
  390    H2*    G  37           H2*        G  37   1.107 -24.936  -3.464
  391   2HO*    G  37          2HO*        G  37   2.871 -25.859  -4.990
  392    H1*    G  37           H1*        G  37   0.377 -27.525  -3.466
  393    H8     G  37           H8         G  37   1.104 -26.538   0.171
  394    H1     G  37           H1         G  37  -4.341 -24.052  -2.162
  395   1H2     G  37          1H2         G  37  -4.472 -24.430  -4.282
  396   2H2     G  37          2H2         G  37  -3.334 -25.467  -5.116
  397   1H5*    U  38          1H5*        U  38   2.201 -23.925  -5.285
  398   2H5*    U  38          2H5*        U  38   2.954 -22.385  -5.665
  399    H4*    U  38           H4*        U  38   0.645 -22.436  -6.397
  400    H3*    U  38           H3*        U  38   1.065 -20.561  -4.089
  401    H2*    U  38           H2*        U  38  -1.113 -19.678  -4.601
  402   2HO*    U  38          2HO*        U  38  -1.024 -19.882  -6.940
  403    H1*    U  38           H1*        U  38  -2.233 -22.160  -4.705
  404    H3     U  38           H3         U  38  -3.381 -20.624  -0.532
  405    H5     U  38           H5         U  38   0.440 -22.245  -0.034
  406    H6     U  38           H6         U  38   0.598 -22.488  -2.465
  407   1H5*    G  39          1H5*        G  39   0.201 -17.989  -7.203
  408   2H5*    G  39          2H5*        G  39   1.121 -16.492  -7.071
  409    H4*    G  39           H4*        G  39  -1.220 -16.025  -7.175
  410    H3*    G  39           H3*        G  39  -0.256 -15.541  -4.351
  411    H2*    G  39           H2*        G  39  -2.471 -14.537  -4.050
  412   2HO*    G  39          2HO*        G  39  -2.573 -13.771  -6.391
  413    H1*    G  39           H1*        G  39  -3.700 -16.702  -5.085
  414    H8     G  39           H8         G  39  -0.435 -17.903  -3.459
  415    H1     G  39           H1         G  39  -5.134 -16.602   0.726
  416   1H2     G  39          1H2         G  39  -6.712 -15.511  -0.264
  417   2H2     G  39          2H2         G  39  -6.737 -15.276  -1.998
  418   1H5*    G  40          1H5*        G  40  -2.111 -12.075  -5.527
  419   2H5*    G  40          2H5*        G  40  -1.297 -10.616  -4.939
  420    H4*    G  40           H4*        G  40  -3.672 -10.577  -4.433
  421    H3*    G  40           H3*        G  40  -1.771 -10.673  -2.064
  422    H2*    G  40           H2*        G  40  -3.772 -10.406  -0.688
  423   2HO*    G  40          2HO*        G  40  -4.788  -8.963  -2.467
  424    H1*    G  40           H1*        G  40  -5.242 -12.250  -1.984
  425    H8     G  40           H8         G  40  -1.795 -13.748  -2.180
  426    H1     G  40           H1         G  40  -4.243 -13.901   3.759
  427   1H2     G  40          1H2         G  40  -6.004 -12.665   3.878
  428   2H2     G  40          2H2         G  40  -6.605 -11.770   2.497
  429   1H5*    G  41          1H5*        G  41  -4.109  -8.199  -0.458
  430   2H5*    G  41          2H5*        G  41  -3.334  -6.725   0.111
  431    H4*    G  41           H4*        G  41  -4.282  -7.831   2.019
  432    H3*    G  41           H3*        G  41  -1.279  -8.167   1.895
  433    H2*    G  41           H2*        G  41  -1.442  -9.161   4.119
  434   2HO*    G  41          2HO*        G  41  -3.245  -7.899   4.946
  435    H1*    G  41           H1*        G  41  -3.392 -10.862   3.378
  436    H8     G  41           H8         G  41  -1.501 -10.385   0.134
  437    H1     G  41           H1         G  41   1.357 -14.473   4.176
  438   1H2     G  41          1H2         G  41   0.602 -14.238   6.159
  439   2H2     G  41          2H2         G  41  -0.689 -13.124   6.565
  440   1H5*    A  42          1H5*        A  42  -0.653  -4.512   5.869
  441   2H5*    A  42          2H5*        A  42  -0.444  -5.921   6.906
  442    H4*    A  42           H4*        A  42  -3.049  -5.024   5.610
  443    H3*    A  42           H3*        A  42  -2.008  -5.290   8.450
  444    H2*    A  42           H2*        A  42  -4.275  -5.733   9.173
  445   2HO*    A  42          2HO*        A  42  -5.213  -4.268   7.408
  446    H1*    A  42           H1*        A  42  -4.664  -7.654   7.340
  447    H8     A  42           H8         A  42  -1.102  -8.328   7.524
  448   1H6     A  42          1H6         A  42  -1.909 -10.672  13.226
  449   2H6     A  42          2H6         A  42  -0.887 -10.699  11.805
  450    H2     A  42           H2         A  42  -5.522  -8.314  12.203
  451   1H5*    A  43          1H5*        A  43  -4.824  -2.890   8.939
  452   2H5*    A  43          2H5*        A  43  -4.890  -1.336   9.742
  453    H4*    A  43           H4*        A  43  -6.209  -2.902  11.015
  454    H3*    A  43           H3*        A  43  -3.539  -2.386  12.384
  455    H2*    A  43           H2*        A  43  -4.266  -3.878  14.140
  456   2HO*    A  43          2HO*        A  43  -6.581  -3.034  13.912
  457    H1*    A  43           H1*        A  43  -5.309  -5.781  12.405
  458    H8     A  43           H8         A  43  -2.294  -4.828  10.528
  459   1H6     A  43          1H6         A  43   0.968  -8.487  14.314
  460   2H6     A  43          2H6         A  43   0.936  -7.724  12.734
  461    H2     A  43           H2         A  43  -2.908  -7.587  16.295
  462   1H5*    U  44          1H5*        U  44  -5.472  -1.767  15.648
  463   2H5*    U  44          2H5*        U  44  -5.008  -0.241  16.426
  464    H4*    U  44           H4*        U  44  -4.266  -2.077  17.813
  465    H3*    U  44           H3*        U  44  -1.955  -0.814  16.300
  466    H2*    U  44           H2*        U  44  -0.533  -2.170  17.691
  467   2HO*    U  44          2HO*        U  44  -2.078  -1.939  19.605
  468    H1*    U  44           H1*        U  44  -2.028  -4.440  17.337
  469    H3     U  44           H3         U  44   1.800  -4.820  14.750
  470    H5     U  44           H5         U  44  -0.847  -2.597  12.390
  471    H6     U  44           H6         U  44  -2.362  -2.459  14.310
  472   1H5*    A  45          1H5*        A  45  -0.685  -0.520  20.181
  473   2H5*    A  45          2H5*        A  45   0.089   1.033  20.517
  474    H4*    A  45           H4*        A  45   1.601  -0.820  20.966
  475    H3*    A  45           H3*        A  45   2.455   0.775  18.516
  476    H2*    A  45           H2*        A  45   4.510  -0.471  18.705
  477   2HO*    A  45          2HO*        A  45   4.387  -0.569  21.156
  478    H1*    A  45           H1*        A  45   3.216  -2.848  18.925
  479    H8     A  45           H8         A  45   0.997  -0.633  16.751
  480   1H6     A  45          1H6         A  45   4.690  -2.235  12.001
  481   2H6     A  45          2H6         A  45   3.146  -1.529  12.441
  482    H2     A  45           H2         A  45   6.548  -3.707  15.740
  483   1H5*    C  46          1H5*        C  46   5.632   0.958  21.122
  484   2H5*    C  46          2H5*        C  46   6.330   2.576  21.208
  485    H4*    C  46           H4*        C  46   8.023   0.923  20.685
  486    H3*    C  46           H3*        C  46   7.422   2.719  18.301
  487    H2*    C  46           H2*        C  46   9.466   1.784  17.414
  488   2HO*    C  46          2HO*        C  46  10.475   1.622  19.665
  489    H1*    C  46           H1*        C  46   8.742  -0.775  18.086
  490   1H4     C  46          1H4         C  46   6.666   0.383  12.156
  491   2H4     C  46          2H4         C  46   5.120   0.912  12.783
  492    H5     C  46           H5         C  46   4.668   1.167  15.130
  493    H6     C  46           H6         C  46   5.622   0.936  17.378
  494   1H5*    C  47          1H5*        C  47  11.414   3.254  19.109
  495   2H5*    C  47          2H5*        C  47  11.924   4.937  18.983
  496    H4*    C  47           H4*        C  47  13.284   3.496  17.573
  497    H3*    C  47           H3*        C  47  11.450   5.285  15.945
  498    H2*    C  47           H2*        C  47  12.859   4.611  14.082
  499   2HO*    C  47          2HO*        C  47  14.862   4.476  15.501
  500    H1*    C  47           H1*        C  47  12.736   1.971  14.799
  501   1H4     C  47          1H4         C  47   7.865   3.038  10.820
  502   2H4     C  47          2H4         C  47   6.846   3.520  12.156
  503    H5     C  47           H5         C  47   7.633   3.710  14.417
  504    H6     C  47           H6         C  47   9.594   3.466  15.869
  505   1H5*    A  48          1H5*        A  48  15.376   6.229  14.799
  506   2H5*    A  48          2H5*        A  48  15.606   7.959  14.558
  507    H4*    A  48           H4*        A  48  16.342   6.689  12.619
  508    H3*    A  48           H3*        A  48  13.828   8.288  12.057
  509    H2*    A  48           H2*        A  48  14.299   7.751   9.722
  510   2HO*    A  48          2HO*        A  48  16.739   7.754  10.107
  511    H1*    A  48           H1*        A  48  14.617   5.116  10.275
  512    H8     A  48           H8         A  48  12.086   6.273  12.843
  513   1H6     A  48          1H6         A  48   7.805   5.794   8.353
  514   2H6     A  48          2H6         A  48   8.069   6.026  10.069
  515    H2     A  48           H2         A  48  11.810   5.443   6.466
  516   1H5*    G  49          1H5*        G  49  16.656   9.515   9.278
  517   2H5*    G  49          2H5*        G  49  16.662  11.257   9.009
  518    H4*    G  49           H4*        G  49  16.481  10.032   6.913
  519    H3*    G  49           H3*        G  49  13.926  11.517   7.615
  520    H2*    G  49           H2*        G  49  13.276  10.966   5.321
  521   2HO*    G  49          2HO*        G  49  15.673  11.076   4.596
  522    H1*    G  49           H1*        G  49  13.967   8.364   5.596
  523    H8     G  49           H8         G  49  12.799   9.279   9.074
  524    H1     G  49           H1         G  49   7.986   8.728   4.840
  525   1H2     G  49          1H2         G  49   8.758   8.855   2.828
  526   2H2     G  49          2H2         G  49  10.477   8.818   2.490
  527   1H5*    G  50          1H5*        G  50  14.775  12.644   3.804
  528   2H5*    G  50          2H5*        G  50  14.714  14.382   3.530
  529    H4*    G  50           H4*        G  50  13.357  13.155   1.893
  530    H3*    G  50           H3*        G  50  11.737  14.846   3.826
  531    H2*    G  50           H2*        G  50   9.832  14.300   2.405
  532   2HO*    G  50          2HO*        G  50  11.305  14.283   0.400
  533    H1*    G  50           H1*        G  50  10.460  11.647   2.252
  534    H8     G  50           H8         G  50  11.469  12.348   5.785
  535    H1     G  50           H1         G  50   5.092  12.110   4.958
  536   1H2     G  50          1H2         G  50   4.618  12.186   2.875
  537   2H2     G  50          2H2         G  50   5.838  12.451   1.648
  538   1H5*    U  51          1H5*        U  51  10.335  15.994   0.200
  539   2H5*    U  51          2H5*        U  51  10.570  17.701  -0.180
  540    H4*    U  51           H4*        U  51   8.266  17.044  -0.623
  541    H3*    U  51           H3*        U  51   9.021  19.242   0.969
  542    H2*    U  51           H2*        U  51   8.376  18.390   2.956
  543   2HO*    U  51          2HO*        U  51   5.659  18.898   2.252
  544    H1*    U  51           H1*        U  51   6.077  16.835   1.780
  545    H3     U  51           H3         U  51   5.093  15.374   5.874
  546    H5     U  51           H5         U  51   9.261  15.746   6.058
  547    H6     U  51           H6         U  51   9.264  16.292   3.665
  548   1H5*    G  52          1H5*        G  52   7.896  21.552  -2.974
  549   2H5*    G  52          2H5*        G  52   6.262  21.816  -3.549
  550    H4*    G  52           H4*        G  52   7.612  19.105  -3.246
  551    H3*    G  52           H3*        G  52   6.678  20.818  -5.587
  552    H2*    G  52           H2*        G  52   6.543  18.768  -6.843
  553   2HO*    G  52          2HO*        G  52   8.499  17.832  -5.678
  554    H1*    G  52           H1*        G  52   5.261  17.454  -4.805
  555    H8     G  52           H8         G  52   3.989  21.047  -4.765
  556    H1     G  52           H1         G  52   1.182  17.272  -9.147
  557   1H2     G  52          1H2         G  52   2.441  15.570  -9.568
  558   2H2     G  52          2H2         G  52   3.882  15.225  -8.634
  559   1H5*    C  53          1H5*        C  53   9.402  18.366  -7.568
  560   2H5*    C  53          2H5*        C  53  10.358  19.292  -8.730
  561    H4*    C  53           H4*        C  53   9.225  17.444  -9.815
  562    H3*    C  53           H3*        C  53   8.002  20.103 -10.631
  563    H2*    C  53           H2*        C  53   6.887  18.787 -12.332
  564   2HO*    C  53          2HO*        C  53   8.820  17.266 -12.544
  565    H1*    C  53           H1*        C  53   6.135  16.849 -10.561
  566   1H4     C  53          1H4         C  53   1.385  21.072 -10.504
  567   2H4     C  53          2H4         C  53   2.187  21.988  -9.250
  568    H5     C  53           H5         C  53   4.447  21.575  -8.556
  569    H6     C  53           H6         C  53   6.329  20.023  -8.767
  570   1H5*    C  54          1H5*        C  54   9.070  18.334 -14.248
  571   2H5*    C  54          2H5*        C  54   9.786  19.498 -15.361
  572    H4*    C  54           H4*        C  54   7.899  18.349 -16.381
  573    H3*    C  54           H3*        C  54   7.272  21.272 -15.809
  574    H2*    C  54           H2*        C  54   5.335  20.884 -17.204
  575   2HO*    C  54          2HO*        C  54   6.581  19.286 -18.618
  576    H1*    C  54           H1*        C  54   4.699  18.540 -15.944
  577   1H4     C  54          1H4         C  54   1.629  23.129 -12.774
  578   2H4     C  54          2H4         C  54   3.002  23.348 -11.718
  579    H5     C  54           H5         C  54   5.112  22.258 -12.055
  580    H6     C  54           H6         C  54   6.314  20.643 -13.453
  581   1H5*    C  55          1H5*        C  55   6.512  20.871 -19.896
  582   2H5*    C  55          2H5*        C  55   7.194  22.222 -20.803
  583    H4*    C  55           H4*        C  55   4.819  21.978 -21.280
  584    H3*    C  55           H3*        C  55   5.480  24.454 -19.658
  585    H2*    C  55           H2*        C  55   3.217  25.124 -20.034
  586   2HO*    C  55          2HO*        C  55   3.227  24.295 -22.320
  587    H1*    C  55           H1*        C  55   2.163  22.599 -19.620
  588   1H4     C  55          1H4         C  55   1.738  25.950 -14.196
  589   2H4     C  55          2H4         C  55   3.384  25.536 -13.775
  590    H5     C  55           H5         C  55   4.829  24.257 -15.202
  591    H6     C  55           H6         C  55   4.991  23.133 -17.373
  592   1H    MET 104          1H        MET 104  10.445 -15.438   3.436
  593    HA   MET 104           HA       MET 104  11.179 -12.600   2.985
  594   1HB   MET 104          1HB       MET 104  13.013 -13.718   4.358
  595   2HB   MET 104          2HB       MET 104  13.282 -14.815   3.013
  596   1HG   MET 104          1HG       MET 104  14.668 -13.344   2.106
  597   2HG   MET 104          2HG       MET 104  13.370 -12.180   1.906
  598   1HE   MET 104          1HE       MET 104  13.700  -9.879   5.057
  599   2HE   MET 104          2HE       MET 104  13.302  -9.832   3.332
  600   3HE   MET 104          3HE       MET 104  12.488 -10.998   4.408
  601    H    TYR 105           H        TYR 105  10.924 -12.104   0.896
  602    HA   TYR 105           HA       TYR 105  10.613 -14.342  -1.077
  603   1HB   TYR 105          1HB       TYR 105   9.317 -11.614  -0.792
  604   2HB   TYR 105          2HB       TYR 105   9.300 -12.467  -2.326
  605    HD1  TYR 105           HD1      TYR 105   7.739 -14.115  -2.797
  606    HD2  TYR 105           HD2      TYR 105   8.381 -13.094   1.379
  607    HE1  TYR 105           HE1      TYR 105   5.913 -15.648  -2.109
  608    HE2  TYR 105           HE2      TYR 105   6.701 -14.771   2.032
  609    HH   TYR 105           HH       TYR 105   4.835 -16.660  -0.380
  610    H    VAL 106           H        VAL 106  12.059 -14.552  -2.660
  611    HA   VAL 106           HA       VAL 106  14.108 -12.383  -2.928
  612    HB   VAL 106           HB       VAL 106  14.269 -15.365  -3.504
  613   1HG1  VAL 106          1HG1      VAL 106  16.733 -15.035  -3.537
  614   2HG1  VAL 106          2HG1      VAL 106  15.946 -14.182  -4.853
  615   3HG1  VAL 106          3HG1      VAL 106  16.498 -13.280  -3.422
  616   1HG2  VAL 106          1HG2      VAL 106  15.668 -15.485  -1.518
  617   2HG2  VAL 106          2HG2      VAL 106  15.373 -13.745  -1.193
  618   3HG2  VAL 106          3HG2      VAL 106  14.035 -14.925  -1.105
  619    H    CYS 107           H        CYS 107  14.720 -11.541  -4.852
  620    HA   CYS 107           HA       CYS 107  13.154 -12.120  -7.263
  621   1HB   CYS 107          1HB       CYS 107  13.834  -9.799  -6.684
  622   2HB   CYS 107          2HB       CYS 107  15.530 -10.284  -6.756
  623    H    HIS 108           H        HIS 108  13.723 -13.493  -8.829
  624    HA   HIS 108           HA       HIS 108  16.434 -14.733  -8.676
  625   1HB   HIS 108          1HB       HIS 108  13.825 -15.854  -9.801
  626   2HB   HIS 108          2HB       HIS 108  15.378 -16.701  -9.766
  627    HD2  HIS 108           HD2      HIS 108  12.342 -16.940  -7.962
  628    HE1  HIS 108           HE1      HIS 108  15.121 -17.058  -4.719
  629    HE2  HIS 108           HE2      HIS 108  12.707 -17.503  -5.416
  630    H    PHE 109           H        PHE 109  15.579 -12.188 -10.124
  631    HA   PHE 109           HA       PHE 109  15.760 -12.672 -12.967
  632   1HB   PHE 109          1HB       PHE 109  15.184 -10.465 -11.616
  633   2HB   PHE 109          2HB       PHE 109  16.918 -10.206 -11.608
  634    HD1  PHE 109           HD1      PHE 109  13.838 -10.213 -13.511
  635    HD2  PHE 109           HD2      PHE 109  18.112  -9.722 -13.699
  636    HE1  PHE 109           HE1      PHE 109  13.595  -9.300 -15.815
  637    HE2  PHE 109           HE2      PHE 109  17.878  -8.770 -16.023
  638    HZ   PHE 109           HZ       PHE 109  15.605  -8.553 -17.061
  639    H    GLU 110           H        GLU 110  17.647 -12.404 -14.331
  640    HA   GLU 110           HA       GLU 110  19.710 -14.125 -13.620
  641   1HB   GLU 110          1HB       GLU 110  19.730 -11.872 -15.677
  642   2HB   GLU 110          2HB       GLU 110  20.955 -13.138 -15.585
  643   1HG   GLU 110          1HG       GLU 110  17.981 -13.620 -16.079
  644   2HG   GLU 110          2HG       GLU 110  19.219 -13.536 -17.324
  645    H    ASN 111           H        ASN 111  21.127 -13.950 -11.980
  646    HA   ASN 111           HA       ASN 111  23.029 -13.246 -10.870
  647   1HB   ASN 111          1HB       ASN 111  23.513 -12.275 -13.343
  648   2HB   ASN 111          2HB       ASN 111  23.350 -10.729 -12.515
  649   1HD2  ASN 111          1HD2      ASN 111  24.693 -10.739 -10.306
  650   2HD2  ASN 111          2HD2      ASN 111  26.334 -11.379 -10.487
  651    H    CYS 112           H        CYS 112  20.114 -12.014 -10.545
  652    HA   CYS 112           HA       CYS 112  20.695  -9.468  -9.206
  653   1HB   CYS 112          1HB       CYS 112  18.648  -9.780 -10.506
  654   2HB   CYS 112          2HB       CYS 112  18.091 -11.061  -9.403
  655    H    GLY 113           H        GLY 113  18.651 -12.159  -7.949
  656   1HA   GLY 113          1HA       GLY 113  18.709 -13.352  -5.965
  657   2HA   GLY 113          2HA       GLY 113  20.408 -12.870  -5.793
  658    H    LYS 114           H        LYS 114  18.176 -10.188  -6.074
  659    HA   LYS 114           HA       LYS 114  18.753  -9.277  -3.367
  660   1HB   LYS 114          1HB       LYS 114  18.211  -7.943  -5.533
  661   2HB   LYS 114          2HB       LYS 114  16.514  -8.193  -5.102
  662   1HG   LYS 114          1HG       LYS 114  16.827  -6.951  -3.022
  663   2HG   LYS 114          2HG       LYS 114  18.599  -6.976  -3.212
  664   1HD   LYS 114          1HD       LYS 114  18.422  -5.611  -5.266
  665   2HD   LYS 114          2HD       LYS 114  16.670  -5.650  -5.121
  666   1HE   LYS 114          1HE       LYS 114  17.413  -3.527  -4.480
  667   2HE   LYS 114          2HE       LYS 114  16.732  -4.351  -3.067
  668   1HZ   LYS 114          1HZ       LYS 114  18.831  -3.216  -2.531
  669   2HZ   LYS 114          2HZ       LYS 114  19.015  -4.822  -2.329
  670   3HZ   LYS 114          3HZ       LYS 114  19.643  -4.084  -3.648
  671    H    ALA 115           H        ALA 115  17.443  -9.221  -1.536
  672    HA   ALA 115           HA       ALA 115  15.031 -10.998  -1.644
  673   1HB   ALA 115          1HB       ALA 115  16.975 -12.004  -0.524
  674   2HB   ALA 115          2HB       ALA 115  17.048 -10.632   0.615
  675   3HB   ALA 115          3HB       ALA 115  15.641 -11.726   0.603
  676    H    PHE 116           H        PHE 116  13.154 -10.363  -0.714
  677    HA   PHE 116           HA       PHE 116  13.114  -7.699   0.652
  678   1HB   PHE 116          1HB       PHE 116  10.942  -8.878  -1.132
  679   2HB   PHE 116          2HB       PHE 116  11.047  -7.260  -0.460
  680    HD1  PHE 116           HD1      PHE 116  12.546  -9.592  -2.934
  681    HD2  PHE 116           HD2      PHE 116  12.266  -5.515  -1.552
  682    HE1  PHE 116           HE1      PHE 116  14.074  -8.906  -4.735
  683    HE2  PHE 116           HE2      PHE 116  13.858  -4.826  -3.368
  684    HZ   PHE 116           HZ       PHE 116  14.775  -6.581  -4.915
  685    H    LYS 117           H        LYS 117  11.297  -7.304   2.058
  686    HA   LYS 117           HA       LYS 117  10.899  -9.397   3.943
  687   1HB   LYS 117          1HB       LYS 117  10.790  -6.870   4.290
  688   2HB   LYS 117          2HB       LYS 117   9.149  -6.900   3.626
  689   1HG   LYS 117          1HG       LYS 117   8.338  -8.229   5.428
  690   2HG   LYS 117          2HG       LYS 117   9.991  -8.722   5.847
  691   1HD   LYS 117          1HD       LYS 117  10.365  -6.226   6.456
  692   2HD   LYS 117          2HD       LYS 117   8.609  -6.050   6.312
  693   1HE   LYS 117          1HE       LYS 117   9.395  -6.462   8.650
  694   2HE   LYS 117          2HE       LYS 117   8.227  -7.658   8.061
  695   1HZ   LYS 117          1HZ       LYS 117  11.143  -8.070   8.097
  696   2HZ   LYS 117          2HZ       LYS 117  10.093  -8.658   9.256
  697   3HZ   LYS 117          3HZ       LYS 117   9.971  -9.208   7.724
  698    H    LYS 118           H        LYS 118   8.816  -8.115   1.310
  699    HA   LYS 118           HA       LYS 118   6.989 -10.468   1.656
  700   1HB   LYS 118          1HB       LYS 118   6.147  -7.509   1.668
  701   2HB   LYS 118          2HB       LYS 118   5.016  -8.863   1.568
  702   1HG   LYS 118          1HG       LYS 118   6.247  -9.816   3.632
  703   2HG   LYS 118          2HG       LYS 118   6.998  -8.218   3.776
  704   1HD   LYS 118          1HD       LYS 118   5.109  -7.262   4.675
  705   2HD   LYS 118          2HD       LYS 118   4.044  -8.429   3.867
  706   1HE   LYS 118          1HE       LYS 118   4.139  -9.011   6.328
  707   2HE   LYS 118          2HE       LYS 118   4.749 -10.214   5.308
  708   1HZ   LYS 118          1HZ       LYS 118   6.232  -9.953   7.155
  709   2HZ   LYS 118          2HZ       LYS 118   7.044  -9.438   5.879
  710   3HZ   LYS 118          3HZ       LYS 118   6.354  -8.351   6.935
  711    H    HIS 119           H        HIS 119   5.538 -10.840  -0.181
  712    HA   HIS 119           HA       HIS 119   7.097 -10.846  -2.569
  713   1HB   HIS 119          1HB       HIS 119   5.092 -11.823  -3.656
  714   2HB   HIS 119          2HB       HIS 119   5.541 -12.600  -2.164
  715    HD1  HIS 119           HD1      HIS 119   2.897  -9.777  -2.911
  716    HD2  HIS 119           HD2      HIS 119   3.604 -13.416  -0.868
  717    HE1  HIS 119           HE1      HIS 119   0.841 -10.199  -1.416
  718    HE2  HIS 119           HE2      HIS 119   1.203 -12.484  -0.350
  719    H    ASN 120           H        ASN 120   4.611  -8.573  -1.467
  720    HA   ASN 120           HA       ASN 120   4.107  -7.372  -4.041
  721   1HB   ASN 120          1HB       ASN 120   3.319  -5.411  -2.602
  722   2HB   ASN 120          2HB       ASN 120   2.502  -6.936  -2.384
  723   1HD2  ASN 120          1HD2      ASN 120   2.218  -7.714  -0.284
  724   2HD2  ASN 120          2HD2      ASN 120   3.043  -6.985   1.061
  725    H    GLN 121           H        GLN 121   6.650  -6.942  -1.580
  726    HA   GLN 121           HA       GLN 121   7.812  -4.553  -2.834
  727   1HB   GLN 121          1HB       GLN 121   9.138  -6.529  -0.973
  728   2HB   GLN 121          2HB       GLN 121   9.629  -4.860  -1.368
  729   1HG   GLN 121          1HG       GLN 121   7.583  -4.051  -0.253
  730   2HG   GLN 121          2HG       GLN 121   7.276  -5.725   0.305
  731   1HE2  GLN 121          1HE2      GLN 121   8.218  -2.987   1.649
  732   2HE2  GLN 121          2HE2      GLN 121   9.518  -3.572   2.690
  733    H    LEU 122           H        LEU 122   8.357  -8.114  -2.899
  734    HA   LEU 122           HA       LEU 122  10.617  -8.123  -4.599
  735   1HB   LEU 122          1HB       LEU 122   9.906 -10.123  -3.467
  736   2HB   LEU 122          2HB       LEU 122   8.321 -10.082  -4.209
  737    HG   LEU 122           HG       LEU 122   9.191 -10.697  -6.368
  738   1HD1  LEU 122          1HD1      LEU 122  11.416  -9.565  -6.195
  739   2HD1  LEU 122          2HD1      LEU 122  11.888 -10.785  -4.991
  740   3HD1  LEU 122          3HD1      LEU 122  11.486 -11.247  -6.675
  741   1HD2  LEU 122          1HD2      LEU 122   9.994 -12.954  -5.857
  742   2HD2  LEU 122          2HD2      LEU 122  10.373 -12.508  -4.191
  743   3HD2  LEU 122          3HD2      LEU 122   8.681 -12.527  -4.741
  744    H    LYS 123           H        LYS 123   7.108  -8.354  -5.467
  745    HA   LYS 123           HA       LYS 123   7.398  -8.168  -8.265
  746   1HB   LYS 123          1HB       LYS 123   5.179  -7.334  -6.352
  747   2HB   LYS 123          2HB       LYS 123   5.049  -7.026  -8.093
  748   1HG   LYS 123          1HG       LYS 123   5.475  -9.396  -8.588
  749   2HG   LYS 123          2HG       LYS 123   5.583  -9.766  -6.861
  750   1HD   LYS 123          1HD       LYS 123   3.245  -9.242  -6.523
  751   2HD   LYS 123          2HD       LYS 123   3.102  -8.559  -8.164
  752   1HE   LYS 123          1HE       LYS 123   3.623 -10.749  -9.158
  753   2HE   LYS 123          2HE       LYS 123   3.817 -11.465  -7.552
  754   1HZ   LYS 123          1HZ       LYS 123   1.605 -11.863  -8.565
  755   2HZ   LYS 123          2HZ       LYS 123   1.508 -11.141  -7.114
  756   3HZ   LYS 123          3HZ       LYS 123   1.267 -10.264  -8.492
  757    H    VAL 124           H        VAL 124   7.240  -5.529  -5.822
  758    HA   VAL 124           HA       VAL 124   7.238  -3.312  -7.611
  759    HB   VAL 124           HB       VAL 124   8.231  -3.743  -4.800
  760   1HG1  VAL 124          1HG1      VAL 124   8.587  -1.305  -4.537
  761   2HG1  VAL 124          2HG1      VAL 124   9.833  -2.071  -5.520
  762   3HG1  VAL 124          3HG1      VAL 124   8.545  -1.128  -6.304
  763   1HG2  VAL 124          1HG2      VAL 124   6.308  -1.711  -5.773
  764   2HG2  VAL 124          2HG2      VAL 124   5.786  -3.408  -5.646
  765   3HG2  VAL 124          3HG2      VAL 124   6.359  -2.596  -4.206
  766    H    HIS 125           H        HIS 125   9.979  -5.228  -6.278
  767    HA   HIS 125           HA       HIS 125  12.011  -3.610  -7.449
  768   1HB   HIS 125          1HB       HIS 125  12.483  -5.043  -5.603
  769   2HB   HIS 125          2HB       HIS 125  11.960  -6.488  -6.470
  770    HD1  HIS 125           HD1      HIS 125  14.860  -3.939  -6.556
  771    HD2  HIS 125           HD2      HIS 125  13.658  -7.722  -7.971
  772    HE1  HIS 125           HE1      HIS 125  16.930  -5.003  -7.579
  773    H    GLN 126           H        GLN 126  10.450  -6.679  -8.553
  774    HA   GLN 126           HA       GLN 126  12.101  -7.017 -10.858
  775   1HB   GLN 126          1HB       GLN 126   9.312  -8.051 -10.178
  776   2HB   GLN 126          2HB       GLN 126  10.194  -8.472 -11.679
  777   1HG   GLN 126          1HG       GLN 126  12.185  -9.096 -10.258
  778   2HG   GLN 126          2HG       GLN 126  11.227  -8.868  -8.804
  779   1HE2  GLN 126          1HE2      GLN 126  12.621 -11.150  -9.363
  780   2HE2  GLN 126          2HE2      GLN 126  11.463 -12.476  -9.656
  781    H    PHE 127           H        PHE 127   9.144  -5.117 -10.343
  782    HA   PHE 127           HA       PHE 127   8.481  -4.523 -13.025
  783   1HB   PHE 127          1HB       PHE 127   6.971  -3.360 -12.047
  784   2HB   PHE 127          2HB       PHE 127   7.656  -3.720 -10.517
  785    HD1  PHE 127           HD1      PHE 127   8.393  -1.010 -13.181
  786    HD2  PHE 127           HD2      PHE 127   7.443  -2.020  -9.119
  787    HE1  PHE 127           HE1      PHE 127   8.642   1.335 -12.543
  788    HE2  PHE 127           HE2      PHE 127   7.777   0.229  -8.387
  789    HZ   PHE 127           HZ       PHE 127   8.467   2.010 -10.117
  790    H    SER 128           H        SER 128  11.197  -3.409 -11.049
  791    HA   SER 128           HA       SER 128  11.957  -1.169 -12.743
  792   1HB   SER 128          1HB       SER 128  12.664  -1.569 -10.344
  793   2HB   SER 128          2HB       SER 128  13.774  -2.826 -10.943
  794    HG   SER 128           HG       SER 128  14.772  -0.745 -10.746
  795    H    HIS 129           H        HIS 129  13.029  -4.636 -12.528
  796    HA   HIS 129           HA       HIS 129  14.972  -4.481 -14.652
  797   1HB   HIS 129          1HB       HIS 129  13.322  -6.836 -13.639
  798   2HB   HIS 129          2HB       HIS 129  14.633  -6.930 -14.788
  799    HD1  HIS 129           HD1      HIS 129  17.177  -6.355 -13.767
  800    HD2  HIS 129           HD2      HIS 129  14.003  -7.593 -11.341
  801    HE1  HIS 129           HE1      HIS 129  18.206  -7.446 -11.685
  802    H    THR 130           H        THR 130  11.468  -5.175 -14.600
  803    HA   THR 130           HA       THR 130  11.357  -5.814 -17.464
  804    HB   THR 130           HB       THR 130   8.904  -5.852 -17.094
  805    HG1  THR 130           HG1      THR 130   9.615  -4.841 -14.592
  806   1HG2  THR 130          1HG2      THR 130  10.362  -7.864 -16.295
  807   2HG2  THR 130          2HG2      THR 130  10.129  -7.241 -14.648
  808   3HG2  THR 130          3HG2      THR 130   8.727  -7.708 -15.607
  809    H    GLN 131           H        GLN 131  11.227  -2.944 -15.529
  810    HA   GLN 131           HA       GLN 131  10.790  -0.744 -15.941
  811   1HB   GLN 131          1HB       GLN 131  12.371  -1.461 -18.008
  812   2HB   GLN 131          2HB       GLN 131  10.920  -1.080 -18.934
  813   1HG   GLN 131          1HG       GLN 131  11.723   1.062 -18.808
  814   2HG   GLN 131          2HG       GLN 131  10.969   1.083 -17.212
  815   1HE2  GLN 131          1HE2      GLN 131  12.851  -0.336 -15.555
  816   2HE2  GLN 131          2HE2      GLN 131  14.353   0.546 -15.658
  817    H    GLN 132           H        GLN 132   8.523  -2.681 -15.863
  818    HA   GLN 132           HA       GLN 132   6.523  -0.759 -17.001
  819   1HB   GLN 132          1HB       GLN 132   4.964  -2.563 -17.464
  820   2HB   GLN 132          2HB       GLN 132   6.425  -2.679 -18.430
  821   1HG   GLN 132          1HG       GLN 132   5.777  -4.888 -17.887
  822   2HG   GLN 132          2HG       GLN 132   7.220  -4.511 -16.966
  823   1HE2  GLN 132          1HE2      GLN 132   7.135  -4.967 -14.814
  824   2HE2  GLN 132          2HE2      GLN 132   5.651  -5.195 -13.874
  825    H    LEU 133           H        LEU 133   4.491  -0.699 -15.769
  826    HA   LEU 133           HA       LEU 133   5.193  -0.856 -12.916
  827   1HB   LEU 133          1HB       LEU 133   3.142   0.687 -14.508
  828   2HB   LEU 133          2HB       LEU 133   3.047   0.660 -12.739
  829    HG   LEU 133           HG       LEU 133   5.675   1.367 -14.203
  830   1HD1  LEU 133          1HD1      LEU 133   5.123   3.721 -13.878
  831   2HD1  LEU 133          2HD1      LEU 133   3.909   2.958 -14.920
  832   3HD1  LEU 133          3HD1      LEU 133   3.532   3.291 -13.214
  833   1HD2  LEU 133          1HD2      LEU 133   4.725   2.088 -11.440
  834   2HD2  LEU 133          2HD2      LEU 133   5.820   0.734 -11.801
  835   3HD2  LEU 133          3HD2      LEU 133   6.310   2.394 -12.158
  836    HA   PRO 134           HA       PRO 134   2.681  -4.409 -12.409
  837   1HB   PRO 134          1HB       PRO 134   2.770  -4.431  -9.582
  838   2HB   PRO 134          2HB       PRO 134   3.979  -5.144 -10.690
  839   1HG   PRO 134          1HG       PRO 134   4.192  -2.753  -8.994
  840   2HG   PRO 134          2HG       PRO 134   5.462  -3.643  -9.844
  841   1HD   PRO 134          1HD       PRO 134   4.270  -1.134 -10.563
  842   2HD   PRO 134          2HD       PRO 134   5.460  -2.088 -11.445
  843    H    TYR 135           H        TYR 135   1.867  -1.571 -10.383
  844    HA   TYR 135           HA       TYR 135  -0.770  -2.741  -9.734
  845   1HB   TYR 135          1HB       TYR 135   0.570  -0.189  -8.710
  846   2HB   TYR 135          2HB       TYR 135  -0.888  -0.917  -8.080
  847    HD1  TYR 135           HD1      TYR 135  -0.865  -3.142  -7.005
  848    HD2  TYR 135           HD2      TYR 135   2.755  -1.039  -8.043
  849    HE1  TYR 135           HE1      TYR 135   0.499  -4.769  -5.638
  850    HE2  TYR 135           HE2      TYR 135   4.086  -2.551  -6.560
  851    HH   TYR 135           HH       TYR 135   4.041  -4.553  -5.347
  852    H    GLU 136           H        GLU 136  -2.092  -2.493 -11.504
  853    HA   GLU 136           HA       GLU 136  -2.217   0.203 -12.779
  854   1HB   GLU 136          1HB       GLU 136  -3.382  -0.894 -14.598
  855   2HB   GLU 136          2HB       GLU 136  -1.864  -1.710 -14.258
  856   1HG   GLU 136          1HG       GLU 136  -3.148  -3.515 -13.053
  857   2HG   GLU 136          2HG       GLU 136  -4.652  -2.715 -13.540
  858    H    CYS 137           H        CYS 137  -4.117   1.370 -12.872
  859    HA   CYS 137           HA       CYS 137  -6.107   0.867 -10.810
  860   1HB   CYS 137          1HB       CYS 137  -5.457   3.120 -11.268
  861   2HB   CYS 137          2HB       CYS 137  -5.789   2.963 -12.971
  862    HA   PRO 138           HA       PRO 138  -8.516  -1.582 -13.670
  863   1HB   PRO 138          1HB       PRO 138 -10.068  -2.915 -11.899
  864   2HB   PRO 138          2HB       PRO 138  -8.286  -3.084 -11.854
  865   1HG   PRO 138          1HG       PRO 138 -10.018  -1.220 -10.172
  866   2HG   PRO 138          2HG       PRO 138  -8.771  -2.369  -9.598
  867   1HD   PRO 138          1HD       PRO 138  -8.265   0.314 -10.062
  868   2HD   PRO 138          2HD       PRO 138  -7.035  -0.972 -10.265
  869    H    HIS 139           H        HIS 139  -9.570   1.266 -12.316
  870    HA   HIS 139           HA       HIS 139 -12.454   0.951 -12.339
  871   1HB   HIS 139          1HB       HIS 139 -10.598   3.362 -12.333
  872   2HB   HIS 139          2HB       HIS 139 -12.343   3.536 -12.433
  873    HD2  HIS 139           HD2      HIS 139  -9.722   2.034  -9.968
  874    HE1  HIS 139           HE1      HIS 139 -13.309   2.678  -7.766
  875    HE2  HIS 139           HE2      HIS 139 -10.884   1.902  -7.605
  876    H    GLU 140           H        GLU 140 -13.987   1.767 -13.831
  877    HA   GLU 140           HA       GLU 140 -13.400   1.203 -16.569
  878   1HB   GLU 140          1HB       GLU 140 -15.738   2.692 -15.287
  879   2HB   GLU 140          2HB       GLU 140 -15.669   2.196 -16.984
  880   1HG   GLU 140          1HG       GLU 140 -15.433  -0.179 -16.284
  881   2HG   GLU 140          2HG       GLU 140 -15.566   0.307 -14.593
  882    H    GLY 141           H        GLY 141 -12.632   2.418 -18.212
  883   1HA   GLY 141          1HA       GLY 141 -12.251   4.332 -19.506
  884   2HA   GLY 141          2HA       GLY 141 -13.008   5.326 -18.249
  885    H    CYS 142           H        CYS 142 -10.693   3.365 -16.761
  886    HA   CYS 142           HA       CYS 142  -8.607   5.500 -16.969
  887   1HB   CYS 142          1HB       CYS 142  -9.966   5.133 -14.780
  888   2HB   CYS 142          2HB       CYS 142  -9.037   3.657 -14.590
  889    H    ASP 143           H        ASP 143  -6.384   4.826 -16.777
  890    HA   ASP 143           HA       ASP 143  -5.738   1.954 -16.936
  891   1HB   ASP 143          1HB       ASP 143  -6.282   2.657 -19.308
  892   2HB   ASP 143          2HB       ASP 143  -4.975   3.833 -19.217
  893    H    LYS 144           H        LYS 144  -5.209   4.574 -15.325
  894    HA   LYS 144           HA       LYS 144  -2.391   5.194 -15.563
  895   1HB   LYS 144          1HB       LYS 144  -4.238   5.380 -13.149
  896   2HB   LYS 144          2HB       LYS 144  -2.674   6.176 -13.303
  897   1HG   LYS 144          1HG       LYS 144  -4.932   6.781 -15.251
  898   2HG   LYS 144          2HG       LYS 144  -4.846   7.540 -13.661
  899   1HD   LYS 144          1HD       LYS 144  -2.730   8.580 -14.161
  900   2HD   LYS 144          2HD       LYS 144  -2.577   7.671 -15.669
  901   1HE   LYS 144          1HE       LYS 144  -3.258   9.966 -16.122
  902   2HE   LYS 144          2HE       LYS 144  -4.496   8.831 -16.643
  903   1HZ   LYS 144          1HZ       LYS 144  -4.666  10.248 -14.026
  904   2HZ   LYS 144          2HZ       LYS 144  -5.300  10.860 -15.410
  905   3HZ   LYS 144          3HZ       LYS 144  -5.848   9.434 -14.801
  906    H    ARG 145           H        ARG 145  -0.608   4.403 -14.395
  907    HA   ARG 145           HA       ARG 145  -1.054   1.920 -12.765
  908   1HB   ARG 145          1HB       ARG 145   1.243   2.181 -14.750
  909   2HB   ARG 145          2HB       ARG 145   0.624   0.747 -13.864
  910   1HG   ARG 145          1HG       ARG 145  -1.490   0.898 -15.143
  911   2HG   ARG 145          2HG       ARG 145  -0.795   2.200 -16.121
  912   1HD   ARG 145          1HD       ARG 145   0.790   0.761 -17.139
  913   2HD   ARG 145          2HD       ARG 145   0.476  -0.531 -15.970
  914    HE   ARG 145           HE       ARG 145  -1.592   0.487 -17.916
  915   1HH1  ARG 145          1HH1      ARG 145  -0.124  -2.327 -16.439
  916   2HH1  ARG 145          2HH1      ARG 145  -1.602  -3.258 -16.541
  917   1HH2  ARG 145          1HH2      ARG 145  -3.389  -0.742 -18.102
  918   2HH2  ARG 145          2HH2      ARG 145  -3.411  -2.351 -17.402
  919    H    PHE 146           H        PHE 146   0.448   1.493 -11.176
  920    HA   PHE 146           HA       PHE 146   2.192   3.814 -10.437
  921   1HB   PHE 146          1HB       PHE 146   0.389   2.243  -8.534
  922   2HB   PHE 146          2HB       PHE 146   1.294   3.683  -8.169
  923    HD1  PHE 146           HD1      PHE 146  -1.753   2.424  -9.832
  924    HD2  PHE 146           HD2      PHE 146   0.747   5.889  -9.170
  925    HE1  PHE 146           HE1      PHE 146  -3.514   3.847 -10.707
  926    HE2  PHE 146           HE2      PHE 146  -1.002   7.320 -10.207
  927    HZ   PHE 146           HZ       PHE 146  -3.093   6.300 -11.042
  928    H    SER 147           H        SER 147   3.742   3.361  -8.736
  929    HA   SER 147           HA       SER 147   5.155   0.901  -9.403
  930   1HB   SER 147          1HB       SER 147   6.832   1.978  -7.693
  931   2HB   SER 147          2HB       SER 147   6.534   2.800  -9.234
  932    HG   SER 147           HG       SER 147   5.776   4.434  -8.203
  933    H    LEU 148           H        LEU 148   3.215   2.094  -6.691
  934    HA   LEU 148           HA       LEU 148   3.803  -0.455  -5.228
  935   1HB   LEU 148          1HB       LEU 148   3.863   2.393  -4.230
  936   2HB   LEU 148          2HB       LEU 148   3.266   1.174  -3.152
  937    HG   LEU 148           HG       LEU 148   5.567   1.691  -2.670
  938   1HD1  LEU 148          1HD1      LEU 148   5.058  -1.096  -3.728
  939   2HD1  LEU 148          2HD1      LEU 148   6.518  -0.674  -2.793
  940   3HD1  LEU 148          3HD1      LEU 148   4.924  -0.513  -2.055
  941   1HD2  LEU 148          1HD2      LEU 148   6.304   2.229  -5.019
  942   2HD2  LEU 148          2HD2      LEU 148   7.419   1.237  -4.056
  943   3HD2  LEU 148          3HD2      LEU 148   6.423   0.473  -5.292
  944    HA   PRO 149           HA       PRO 149  -0.572  -0.981  -5.007
  945   1HB   PRO 149          1HB       PRO 149  -0.868  -2.152  -2.481
  946   2HB   PRO 149          2HB       PRO 149  -0.327  -2.989  -3.949
  947   1HG   PRO 149          1HG       PRO 149   1.325  -1.971  -1.661
  948   2HG   PRO 149          2HG       PRO 149   1.542  -3.449  -2.671
  949   1HD   PRO 149          1HD       PRO 149   3.022  -1.152  -3.028
  950   2HD   PRO 149          2HD       PRO 149   2.661  -2.279  -4.291
  951    H    SER 150           H        SER 150   0.977   0.496  -2.134
  952    HA   SER 150           HA       SER 150  -1.372   1.747  -1.086
  953   1HB   SER 150          1HB       SER 150   1.554   2.543  -0.870
  954   2HB   SER 150          2HB       SER 150   0.244   3.203   0.132
  955    HG   SER 150           HG       SER 150   1.350   1.441   1.142
  956    H    ARG 151           H        ARG 151   0.920   2.682  -3.636
  957    HA   ARG 151           HA       ARG 151  -0.007   5.451  -3.837
  958   1HB   ARG 151          1HB       ARG 151   1.696   3.676  -5.656
  959   2HB   ARG 151          2HB       ARG 151   1.270   5.355  -6.048
  960   1HG   ARG 151          1HG       ARG 151   2.261   6.150  -3.947
  961   2HG   ARG 151          2HG       ARG 151   2.649   4.497  -3.469
  962   1HD   ARG 151          1HD       ARG 151   4.199   4.283  -5.370
  963   2HD   ARG 151          2HD       ARG 151   3.802   5.932  -5.886
  964    HE   ARG 151           HE       ARG 151   4.588   6.160  -3.205
  965   1HH1  ARG 151          1HH1      ARG 151   6.231   4.828  -6.008
  966   2HH1  ARG 151          2HH1      ARG 151   7.769   5.483  -5.513
  967   1HH2  ARG 151          1HH2      ARG 151   6.546   7.021  -2.675
  968   2HH2  ARG 151          2HH2      ARG 151   7.947   6.679  -3.662
  969    H    LEU 152           H        LEU 152  -0.787   2.336  -5.435
  970    HA   LEU 152           HA       LEU 152  -2.667   3.430  -7.370
  971   1HB   LEU 152          1HB       LEU 152  -1.761   1.220  -7.681
  972   2HB   LEU 152          2HB       LEU 152  -2.269   0.715  -6.068
  973    HG   LEU 152           HG       LEU 152  -4.595   0.692  -6.697
  974   1HD1  LEU 152          1HD1      LEU 152  -4.552   2.598  -8.390
  975   2HD1  LEU 152          2HD1      LEU 152  -3.756   1.485  -9.514
  976   3HD1  LEU 152          3HD1      LEU 152  -5.396   1.150  -8.903
  977   1HD2  LEU 152          1HD2      LEU 152  -3.088  -1.294  -7.210
  978   2HD2  LEU 152          2HD2      LEU 152  -4.547  -1.179  -8.225
  979   3HD2  LEU 152          3HD2      LEU 152  -2.974  -0.686  -8.868
  980    H    LYS 153           H        LYS 153  -2.971   1.993  -4.056
  981    HA   LYS 153           HA       LYS 153  -5.765   2.265  -3.690
  982   1HB   LYS 153          1HB       LYS 153  -4.463   1.099  -2.041
  983   2HB   LYS 153          2HB       LYS 153  -3.404   2.466  -1.820
  984   1HG   LYS 153          1HG       LYS 153  -5.524   3.682  -0.800
  985   2HG   LYS 153          2HG       LYS 153  -6.178   2.058  -0.711
  986   1HD   LYS 153          1HD       LYS 153  -5.163   2.706   1.408
  987   2HD   LYS 153          2HD       LYS 153  -4.255   1.379   0.697
  988   1HE   LYS 153          1HE       LYS 153  -2.733   3.001   1.697
  989   2HE   LYS 153          2HE       LYS 153  -2.488   2.933  -0.040
  990   1HZ   LYS 153          1HZ       LYS 153  -3.942   5.070   1.409
  991   2HZ   LYS 153          2HZ       LYS 153  -2.482   5.213   0.677
  992   3HZ   LYS 153          3HZ       LYS 153  -3.810   4.991  -0.224
  993    H    ARG 154           H        ARG 154  -3.157   4.687  -3.236
  994    HA   ARG 154           HA       ARG 154  -4.878   6.792  -2.280
  995   1HB   ARG 154          1HB       ARG 154  -2.217   6.490  -2.344
  996   2HB   ARG 154          2HB       ARG 154  -2.379   7.352  -3.866
  997   1HG   ARG 154          1HG       ARG 154  -3.613   9.170  -2.526
  998   2HG   ARG 154          2HG       ARG 154  -3.230   8.252  -1.065
  999   1HD   ARG 154          1HD       ARG 154  -1.556  10.002  -1.377
 1000   2HD   ARG 154          2HD       ARG 154  -0.821   8.401  -1.601
 1001    HE   ARG 154           HE       ARG 154  -1.796   9.951  -3.958
 1002   1HH1  ARG 154          1HH1      ARG 154   1.158   9.332  -2.453
 1003   2HH1  ARG 154          2HH1      ARG 154   1.970   8.942  -3.915
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.754   9.945  -5.682
 1005   2HH2  ARG 154          2HH2      ARG 154   0.932   9.438  -5.801
 1006    H    HIS 155           H        HIS 155  -3.733   5.860  -5.562
 1007    HA   HIS 155           HA       HIS 155  -4.871   8.052  -6.984
 1008   1HB   HIS 155          1HB       HIS 155  -3.296   6.616  -8.084
 1009   2HB   HIS 155          2HB       HIS 155  -4.294   5.181  -7.829
 1010    HD1  HIS 155           HD1      HIS 155  -4.370   8.415  -9.967
 1011    HD2  HIS 155           HD2      HIS 155  -6.249   4.678  -9.512
 1012    HE1  HIS 155           HE1      HIS 155  -6.204   8.360 -11.693
 1013    H    GLU 156           H        GLU 156  -6.330   4.952  -5.885
 1014    HA   GLU 156           HA       GLU 156  -8.757   5.093  -7.298
 1015   1HB   GLU 156          1HB       GLU 156  -8.197   4.004  -4.491
 1016   2HB   GLU 156          2HB       GLU 156  -9.731   3.862  -5.320
 1017   1HG   GLU 156          1HG       GLU 156  -8.412   2.821  -7.289
 1018   2HG   GLU 156          2HG       GLU 156  -7.103   2.605  -6.129
 1019    H    LYS 157           H        LYS 157  -7.675   7.015  -4.516
 1020    HA   LYS 157           HA       LYS 157 -10.235   7.950  -3.595
 1021   1HB   LYS 157          1HB       LYS 157  -7.990   8.203  -2.421
 1022   2HB   LYS 157          2HB       LYS 157  -7.596   9.462  -3.595
 1023   1HG   LYS 157          1HG       LYS 157  -8.293  10.496  -1.574
 1024   2HG   LYS 157          2HG       LYS 157  -9.508  10.817  -2.804
 1025   1HD   LYS 157          1HD       LYS 157 -10.960   9.046  -1.840
 1026   2HD   LYS 157          2HD       LYS 157  -9.754   8.730  -0.587
 1027   1HE   LYS 157          1HE       LYS 157 -11.129  11.414  -1.081
 1028   2HE   LYS 157          2HE       LYS 157 -11.705  10.212   0.075
 1029   1HZ   LYS 157          1HZ       LYS 157  -9.064  11.565   0.210
 1030   2HZ   LYS 157          2HZ       LYS 157 -10.339  11.866   1.183
 1031   3HZ   LYS 157          3HZ       LYS 157  -9.584  10.425   1.264
 1032    H    VAL 158           H        VAL 158  -8.255   8.790  -6.425
 1033    HA   VAL 158           HA       VAL 158  -9.463  11.307  -7.089
 1034    HB   VAL 158           HB       VAL 158  -8.420   9.165  -9.026
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.704  11.019 -10.126
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.626  12.180  -9.290
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.978  11.073 -10.509
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.346  10.646  -9.075
 1039   2HG2  VAL 158          2HG2      VAL 158  -7.092  11.566  -7.758
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.583   9.888  -7.470
 1041    H    HIS 159           H        HIS 159 -10.439   7.925  -7.783
 1042    HA   HIS 159           HA       HIS 159 -12.757   8.735  -9.372
 1043   1HB   HIS 159          1HB       HIS 159 -11.878   6.066  -8.172
 1044   2HB   HIS 159          2HB       HIS 159 -13.325   6.275  -9.177
 1045    HD1  HIS 159           HD1      HIS 159 -12.555   7.715 -11.662
 1046    HD2  HIS 159           HD2      HIS 159  -9.759   5.413  -9.524
 1047    HE1  HIS 159           HE1      HIS 159 -10.583   7.315 -13.234
 1048    H    ALA 160           H        ALA 160 -12.096   7.895  -5.969
 1049    HA   ALA 160           HA       ALA 160 -14.880   7.676  -5.179
 1050   1HB   ALA 160          1HB       ALA 160 -13.994   7.711  -2.900
 1051   2HB   ALA 160          2HB       ALA 160 -12.971   6.664  -3.906
 1052   3HB   ALA 160          3HB       ALA 160 -12.430   8.306  -3.482
 1053    H    GLY 161           H        GLY 161 -12.564  10.364  -5.504
 1054   1HA   GLY 161          1HA       GLY 161 -13.197  12.634  -5.773
 1055   2HA   GLY 161          2HA       GLY 161 -14.765  12.285  -5.078
 1056    H    TYR 162           H        TYR 162 -13.650  14.525  -4.235
 1057    HA   TYR 162           HA       TYR 162 -12.562  13.875  -1.516
 1058   1HB   TYR 162          1HB       TYR 162 -11.928  16.227  -3.329
 1059   2HB   TYR 162          2HB       TYR 162 -11.356  16.062  -1.655
 1060    HD1  TYR 162           HD1      TYR 162 -11.249  14.649  -5.093
 1061    HD2  TYR 162           HD2      TYR 162  -9.466  14.612  -1.160
 1062    HE1  TYR 162           HE1      TYR 162  -9.622  13.022  -5.870
 1063    HE2  TYR 162           HE2      TYR 162  -7.597  13.200  -2.046
 1064    HH   TYR 162           HH       TYR 162  -7.283  12.367  -5.444
 1065    HA   PRO 163           HA       PRO 163 -16.487  16.051  -0.979
 1066   1HB   PRO 163          1HB       PRO 163 -17.362  14.765   1.275
 1067   2HB   PRO 163          2HB       PRO 163 -17.378  13.981  -0.330
 1068   1HG   PRO 163          1HG       PRO 163 -15.302  13.680   1.852
 1069   2HG   PRO 163          2HG       PRO 163 -16.106  12.395   0.894
 1070   1HD   PRO 163          1HD       PRO 163 -13.631  13.413   0.269
 1071   2HD   PRO 163          2HD       PRO 163 -14.774  12.831  -0.984
 1072    H    CYS 164           H        CYS 164 -16.985  17.863   0.176
 1073    HA   CYS 164           HA       CYS 164 -14.946  19.033   1.848
 1074   1HB   CYS 164          1HB       CYS 164 -16.728  20.162   0.295
 1075   2HB   CYS 164          2HB       CYS 164 -17.804  20.034   1.706
 1076    H    LYS 165           H        LYS 165 -14.864  19.398   4.002
 1077    HA   LYS 165           HA       LYS 165 -17.100  18.554   5.739
 1078   1HB   LYS 165          1HB       LYS 165 -15.627  17.240   7.229
 1079   2HB   LYS 165          2HB       LYS 165 -15.733  16.535   5.623
 1080   1HG   LYS 165          1HG       LYS 165 -13.499  17.473   5.039
 1081   2HG   LYS 165          2HG       LYS 165 -13.404  18.241   6.628
 1082   1HD   LYS 165          1HD       LYS 165 -12.078  16.244   6.663
 1083   2HD   LYS 165          2HD       LYS 165 -13.486  15.998   7.707
 1084   1HE   LYS 165          1HE       LYS 165 -14.608  14.724   5.881
 1085   2HE   LYS 165          2HE       LYS 165 -13.215  15.002   4.829
 1086   1HZ   LYS 165          1HZ       LYS 165 -11.859  13.733   6.414
 1087   2HZ   LYS 165          2HZ       LYS 165 -13.149  13.482   7.385
 1088   3HZ   LYS 165          3HZ       LYS 165 -13.108  12.821   5.894
 1089    H    LYS 166           H        LYS 166 -15.259  20.956   4.750
 1090    HA   LYS 166           HA       LYS 166 -14.054  22.022   7.180
 1091   1HB   LYS 166          1HB       LYS 166 -14.979  23.312   4.605
 1092   2HB   LYS 166          2HB       LYS 166 -14.103  24.190   5.856
 1093   1HG   LYS 166          1HG       LYS 166 -12.976  21.727   4.454
 1094   2HG   LYS 166          2HG       LYS 166 -12.755  23.385   3.877
 1095   1HD   LYS 166          1HD       LYS 166 -11.571  24.050   5.840
 1096   2HD   LYS 166          2HD       LYS 166 -11.896  22.495   6.651
 1097   1HE   LYS 166          1HE       LYS 166 -10.614  21.317   4.877
 1098   2HE   LYS 166          2HE       LYS 166 -10.267  22.866   4.098
 1099   1HZ   LYS 166          1HZ       LYS 166  -9.400  22.091   6.834
 1100   2HZ   LYS 166          2HZ       LYS 166  -8.436  22.147   5.521
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.075  23.529   6.127
 1102    H    ASP 167           H        ASP 167 -17.320  21.894   5.926
 1103    HA   ASP 167           HA       ASP 167 -18.276  23.276   8.365
 1104   1HB   ASP 167          1HB       ASP 167 -18.079  25.017   6.525
 1105   2HB   ASP 167          2HB       ASP 167 -19.262  24.098   5.597
 1106    H    ASP 168           H        ASP 168 -20.234  22.486   9.102
 1107    HA   ASP 168           HA       ASP 168 -20.945  19.871   8.283
 1108   1HB   ASP 168          1HB       ASP 168 -22.811  20.091   9.880
 1109   2HB   ASP 168          2HB       ASP 168 -21.299  20.671  10.552
 1110    H    SER 169           H        SER 169 -22.146  23.007   7.176
 1111    HA   SER 169           HA       SER 169 -24.466  21.707   5.813
 1112   1HB   SER 169          1HB       SER 169 -23.734  24.631   6.298
 1113   2HB   SER 169          2HB       SER 169 -25.143  24.101   5.368
 1114    HG   SER 169           HG       SER 169 -24.641  23.322   8.066
 1115    H    CYS 170           H        CYS 170 -21.494  21.569   4.963
 1116    HA   CYS 170           HA       CYS 170 -21.742  22.729   2.216
 1117   1HB   CYS 170          1HB       CYS 170 -19.562  22.765   3.834
 1118   2HB   CYS 170          2HB       CYS 170 -19.303  21.193   3.102
 1119    H    SER 171           H        SER 171 -21.283  21.250   0.378
 1120    HA   SER 171           HA       SER 171 -21.780  18.357   0.885
 1121   1HB   SER 171          1HB       SER 171 -23.731  18.339  -0.642
 1122   2HB   SER 171          2HB       SER 171 -24.025  19.336   0.787
 1123    HG   SER 171           HG       SER 171 -24.698  20.383  -1.143
 1124    H    PHE 172           H        PHE 172 -20.012  20.656  -0.706
 1125    HA   PHE 172           HA       PHE 172 -19.944  19.741  -3.417
 1126   1HB   PHE 172          1HB       PHE 172 -19.023  21.886  -2.920
 1127   2HB   PHE 172          2HB       PHE 172 -18.017  21.249  -1.631
 1128    HD1  PHE 172           HD1      PHE 172 -15.941  20.029  -2.062
 1129    HD2  PHE 172           HD2      PHE 172 -18.301  21.577  -5.309
 1130    HE1  PHE 172           HE1      PHE 172 -14.062  19.616  -3.619
 1131    HE2  PHE 172           HE2      PHE 172 -16.343  21.351  -6.835
 1132    HZ   PHE 172           HZ       PHE 172 -14.203  20.415  -5.974
 1133    H    VAL 173           H        VAL 173 -18.781  18.164  -4.456
 1134    HA   VAL 173           HA       VAL 173 -16.661  16.736  -2.910
 1135    HB   VAL 173           HB       VAL 173 -18.607  15.435  -4.850
 1136   1HG1  VAL 173          1HG1      VAL 173 -16.295  14.361  -4.855
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.393  14.218  -3.093
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.507  13.311  -4.129
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.825  15.805  -2.833
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.281  14.127  -2.740
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.444  15.400  -1.810
 1142    H    GLY 174           H        GLY 174 -14.749  17.017  -3.829
 1143   1HA   GLY 174          1HA       GLY 174 -14.610  18.087  -6.570
 1144   2HA   GLY 174          2HA       GLY 174 -13.254  17.835  -5.454
 1145    H    LYS 175           H        LYS 175 -14.136  17.023  -8.420
 1146    HA   LYS 175           HA       LYS 175 -13.915  14.179  -8.526
 1147   1HB   LYS 175          1HB       LYS 175 -14.645  15.837 -10.347
 1148   2HB   LYS 175          2HB       LYS 175 -12.928  16.098 -10.679
 1149   1HG   LYS 175          1HG       LYS 175 -12.658  13.684 -11.192
 1150   2HG   LYS 175          2HG       LYS 175 -14.362  13.403 -10.817
 1151   1HD   LYS 175          1HD       LYS 175 -13.316  15.218 -13.037
 1152   2HD   LYS 175          2HD       LYS 175 -13.852  13.544 -13.254
 1153   1HE   LYS 175          1HE       LYS 175 -16.119  14.163 -12.419
 1154   2HE   LYS 175          2HE       LYS 175 -15.596  15.846 -12.266
 1155   1HZ   LYS 175          1HZ       LYS 175 -15.678  14.317 -14.812
 1156   2HZ   LYS 175          2HZ       LYS 175 -16.744  15.466 -14.369
 1157   3HZ   LYS 175          3HZ       LYS 175 -15.193  15.870 -14.672
 1158    H    THR 176           H        THR 176 -11.522  16.587  -7.818
 1159    HA   THR 176           HA       THR 176  -9.448  14.498  -7.623
 1160    HB   THR 176           HB       THR 176  -7.889  16.458  -8.717
 1161    HG1  THR 176           HG1      THR 176  -9.105  17.738  -9.773
 1162   1HG2  THR 176          1HG2      THR 176  -9.225  14.182 -10.202
 1163   2HG2  THR 176          2HG2      THR 176  -7.826  15.077 -10.769
 1164   3HG2  THR 176          3HG2      THR 176  -7.699  14.121  -9.274
 1165    H    TRP 177           H        TRP 177  -7.511  15.282  -6.470
 1166    HA   TRP 177           HA       TRP 177  -8.236  16.533  -4.069
 1167   1HB   TRP 177          1HB       TRP 177  -6.333  15.085  -4.205
 1168   2HB   TRP 177          2HB       TRP 177  -5.555  16.092  -5.405
 1169    HD1  TRP 177           HD1      TRP 177  -3.528  17.000  -4.469
 1170    HE1  TRP 177           HE1      TRP 177  -2.729  18.181  -2.325
 1171    HE3  TRP 177           HE3      TRP 177  -7.722  16.350  -1.675
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.520  17.967   0.443
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.595  16.647   0.790
 1174    HH2  TRP 177           HH2      TRP 177  -5.483  17.375   1.854
 1175    H    THR 178           H        THR 178  -6.602  17.985  -6.948
 1176    HA   THR 178           HA       THR 178  -6.096  20.554  -5.877
 1177    HB   THR 178           HB       THR 178  -6.465  21.350  -8.271
 1178    HG1  THR 178           HG1      THR 178  -6.354  18.779  -9.215
 1179   1HG2  THR 178          1HG2      THR 178  -4.472  20.369  -9.208
 1180   2HG2  THR 178          2HG2      THR 178  -4.230  20.833  -7.515
 1181   3HG2  THR 178          3HG2      THR 178  -4.447  19.131  -7.944
 1182    H    LEU 179           H        LEU 179  -9.048  19.358  -7.578
 1183    HA   LEU 179           HA       LEU 179 -10.431  21.816  -7.577
 1184   1HB   LEU 179          1HB       LEU 179 -11.574  18.990  -7.431
 1185   2HB   LEU 179          2HB       LEU 179 -12.485  20.441  -7.842
 1186    HG   LEU 179           HG       LEU 179 -10.218  19.224  -9.439
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.963  18.807 -11.114
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.359  18.036  -9.574
 1189   3HD1  LEU 179          3HD1      LEU 179 -13.185  19.540 -10.046
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.812  20.913 -11.195
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.854  21.735 -10.014
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.092  21.643  -9.762
 1193    H    TYR 180           H        TYR 180 -10.156  19.366  -5.008
 1194    HA   TYR 180           HA       TYR 180 -12.224  20.537  -3.319
 1195   1HB   TYR 180          1HB       TYR 180 -11.750  18.304  -2.897
 1196   2HB   TYR 180          2HB       TYR 180 -10.001  18.519  -2.915
 1197    HD1  TYR 180           HD1      TYR 180 -13.013  19.791  -1.011
 1198    HD2  TYR 180           HD2      TYR 180  -8.895  18.519  -0.858
 1199    HE1  TYR 180           HE1      TYR 180 -12.973  20.189   1.439
 1200    HE2  TYR 180           HE2      TYR 180  -8.900  18.809   1.619
 1201    HH   TYR 180           HH       TYR 180 -11.818  19.903   3.385
 1202    H    LEU 181           H        LEU 181  -8.619  20.604  -3.333
 1203    HA   LEU 181           HA       LEU 181  -8.297  22.437  -1.209
 1204   1HB   LEU 181          1HB       LEU 181  -6.661  21.932  -3.730
 1205   2HB   LEU 181          2HB       LEU 181  -6.156  23.046  -2.492
 1206    HG   LEU 181           HG       LEU 181  -6.632  20.030  -2.150
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.145  21.732  -2.447
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.103  20.161  -1.642
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.612  20.244  -3.329
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.843  22.104  -0.098
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.187  20.951  -0.042
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.542  20.351   0.119
 1213    H    LYS 182           H        LYS 182  -8.790  23.086  -4.708
 1214    HA   LYS 182           HA       LYS 182  -8.598  25.955  -4.584
 1215   1HB   LYS 182          1HB       LYS 182 -10.004  24.039  -6.491
 1216   2HB   LYS 182          2HB       LYS 182 -10.046  25.787  -6.726
 1217   1HG   LYS 182          1HG       LYS 182  -7.684  25.949  -7.009
 1218   2HG   LYS 182          2HG       LYS 182  -7.407  24.308  -6.423
 1219   1HD   LYS 182          1HD       LYS 182  -8.594  23.386  -8.403
 1220   2HD   LYS 182          2HD       LYS 182  -8.830  25.035  -9.024
 1221   1HE   LYS 182          1HE       LYS 182  -6.403  25.379  -9.143
 1222   2HE   LYS 182          2HE       LYS 182  -6.110  23.819  -8.368
 1223   1HZ   LYS 182          1HZ       LYS 182  -5.832  23.643 -10.759
 1224   2HZ   LYS 182          2HZ       LYS 182  -7.134  22.749 -10.336
 1225   3HZ   LYS 182          3HZ       LYS 182  -7.325  24.196 -11.069
 1226    H    HIS 183           H        HIS 183 -11.409  23.716  -4.286
 1227    HA   HIS 183           HA       HIS 183 -13.423  25.727  -3.961
 1228   1HB   HIS 183          1HB       HIS 183 -14.117  23.487  -4.416
 1229   2HB   HIS 183          2HB       HIS 183 -13.193  22.817  -3.086
 1230    HD1  HIS 183           HD1      HIS 183 -16.507  24.687  -3.659
 1231    HD2  HIS 183           HD2      HIS 183 -14.220  22.885  -0.621
 1232    HE1  HIS 183           HE1      HIS 183 -18.000  24.591  -1.592
 1233    H    VAL 184           H        VAL 184 -11.288  24.047  -1.607
 1234    HA   VAL 184           HA       VAL 184 -12.464  25.122   0.772
 1235    HB   VAL 184           HB       VAL 184  -9.772  23.934   0.072
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.100  23.967   2.410
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.177  25.608   1.765
 1238   3HG1  VAL 184          3HG1      VAL 184 -10.492  25.012   2.822
 1239   1HG2  VAL 184          1HG2      VAL 184 -11.612  22.419   0.296
 1240   2HG2  VAL 184          2HG2      VAL 184 -10.636  22.253   1.744
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.179  23.188   1.783
 1242    H    ALA 185           H        ALA 185  -9.738  26.249  -1.263
 1243    HA   ALA 185           HA       ALA 185  -9.011  28.407   0.415
 1244   1HB   ALA 185          1HB       ALA 185  -8.708  28.121  -2.610
 1245   2HB   ALA 185          2HB       ALA 185  -7.812  29.253  -1.575
 1246   3HB   ALA 185          3HB       ALA 185  -7.577  27.505  -1.385
 1247    H    GLU 186           H        GLU 186 -11.549  28.089  -2.033
 1248    HA   GLU 186           HA       GLU 186 -12.021  31.000  -2.181
 1249   1HB   GLU 186          1HB       GLU 186 -12.119  29.480  -4.168
 1250   2HB   GLU 186          2HB       GLU 186 -13.538  28.689  -3.476
 1251   1HG   GLU 186          1HG       GLU 186 -14.830  30.760  -3.659
 1252   2HG   GLU 186          2HG       GLU 186 -13.382  31.667  -4.117
 1253    H    CYS 187           H        CYS 187 -13.431  28.154  -0.572
 1254    HA   CYS 187           HA       CYS 187 -15.873  29.749   0.134
 1255   1HB   CYS 187          1HB       CYS 187 -15.431  26.728   0.030
 1256   2HB   CYS 187          2HB       CYS 187 -16.946  27.531   0.463
 1257    HG   CYS 187           HG       CYS 187 -15.216  27.633  -2.344
 1258    H    HIS 188           H        HIS 188 -13.054  28.264   1.606
 1259    HA   HIS 188           HA       HIS 188 -14.276  28.700   4.313
 1260   1HB   HIS 188          1HB       HIS 188 -12.579  26.303   3.509
 1261   2HB   HIS 188          2HB       HIS 188 -13.245  26.620   5.118
 1262    HD1  HIS 188           HD1      HIS 188 -16.133  26.705   5.106
 1263    HD2  HIS 188           HD2      HIS 188 -14.032  24.937   1.931
 1264    HE1  HIS 188           HE1      HIS 188 -17.811  25.189   3.907
 1265    H    GLN 189           H        GLN 189 -12.064  29.920   2.337
 1266    HA   GLN 189           HA       GLN 189 -10.304  30.698   4.599
 1267   1HB   GLN 189          1HB       GLN 189  -9.187  29.805   1.913
 1268   2HB   GLN 189          2HB       GLN 189  -8.259  30.457   3.250
 1269   1HG   GLN 189          1HG       GLN 189  -8.909  28.509   4.659
 1270   2HG   GLN 189          2HG       GLN 189  -9.696  27.775   3.260
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.430  26.700   4.824
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.110  26.502   3.678
 1273    H    ASP 190           H        ASP 190  -8.784  32.562   3.809
 1274    HA   ASP 190           HA       ASP 190  -9.940  34.221   1.649
 1275   1HB   ASP 190          1HB       ASP 190 -11.326  34.750   3.665
 1276   2HB   ASP 190          2HB       ASP 190  -9.864  35.189   4.547
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  -5.717  29.890 -14.760
    2   2H5*    G   1          2H5*        G   1  -6.654  28.434 -14.389
    3    H4*    G   1           H4*        G   1  -5.905  28.406 -16.706
    4    H3*    G   1           H3*        G   1  -4.557  26.361 -14.934
    5    H2*    G   1           H2*        G   1  -3.594  25.450 -16.970
    6   2HO*    G   1          2HO*        G   1  -5.618  26.089 -18.260
    7    H1*    G   1           H1*        G   1  -2.740  27.846 -17.869
    8    H8     G   1           H8         G   1  -2.466  28.483 -14.196
    9    H1     G   1           H1         G   1   2.324  24.941 -16.586
   10   1H2     G   1          1H2         G   1   1.704  23.966 -18.429
   11   2H2     G   1          2H2         G   1   0.212  24.414 -19.234
   12   1H5*    G   2          1H5*        G   2  -5.959  24.070 -18.147
   13   2H5*    G   2          2H5*        G   2  -6.782  22.616 -17.573
   14    H4*    G   2           H4*        G   2  -5.014  22.047 -19.153
   15    H3*    G   2           H3*        G   2  -4.431  21.212 -16.301
   16    H2*    G   2           H2*        G   2  -2.559  19.983 -17.229
   17   2HO*    G   2          2HO*        G   2  -3.844  19.514 -19.304
   18    H1*    G   2           H1*        G   2  -1.706  22.062 -18.752
   19    H8     G   2           H8         G   2  -3.142  23.755 -15.684
   20    H1     G   2           H1         G   2   2.685  21.200 -14.751
   21   1H2     G   2          1H2         G   2   3.073  19.684 -16.239
   22   2H2     G   2          2H2         G   2   2.024  19.451 -17.622
   23   1H5*    G   3          1H5*        G   3  -3.952  17.663 -18.436
   24   2H5*    G   3          2H5*        G   3  -4.784  16.318 -17.645
   25    H4*    G   3           H4*        G   3  -2.404  15.804 -18.001
   26    H3*    G   3           H3*        G   3  -3.226  16.201 -15.098
   27    H2*    G   3           H2*        G   3  -1.005  15.438 -14.551
   28   2HO*    G   3          2HO*        G   3  -1.119  13.859 -16.494
   29    H1*    G   3           H1*        G   3   0.249  16.865 -16.540
   30    H8     G   3           H8         G   3  -2.447  19.129 -15.092
   31    H1     G   3           H1         G   3   2.910  18.783 -11.535
   32   1H2     G   3          1H2         G   3   4.021  17.012 -12.052
   33   2H2     G   3          2H2         G   3   3.600  16.025 -13.437
   34   1H5*    C   4          1H5*        C   4  -1.295  12.613 -14.811
   35   2H5*    C   4          2H5*        C   4  -2.200  11.458 -13.836
   36    H4*    C   4           H4*        C   4   0.002  11.808 -12.864
   37    H3*    C   4           H3*        C   4  -2.201  13.122 -11.228
   38    H2*    C   4           H2*        C   4  -0.508  13.571  -9.618
   39   2HO*    C   4          2HO*        C   4   0.478  11.337 -10.040
   40    H1*    C   4           H1*        C   4   1.485  14.107 -11.525
   41   1H4     C   4          1H4         C   4  -0.775  19.428  -8.827
   42   2H4     C   4          2H4         C   4  -2.220  19.367  -9.807
   43    H5     C   4           H5         C   4  -2.651  17.627 -11.404
   44    H6     C   4           H6         C   4  -1.805  15.523 -12.331
   45   1H5*    C   5          1H5*        C   5  -1.245  12.103  -8.056
   46   2H5*    C   5          2H5*        C   5  -2.375  11.008  -7.259
   47    H4*    C   5           H4*        C   5  -1.921  13.116  -6.057
   48    H3*    C   5           H3*        C   5  -4.363  11.804  -6.061
   49    H2*    C   5           H2*        C   5  -5.154  13.119  -7.951
   50   2HO*    C   5          2HO*        C   5  -6.605  13.444  -5.968
   51    H1*    C   5           H1*        C   5  -4.167  15.526  -6.483
   52   1H4     C   5          1H4         C   5  -5.702  18.568 -11.801
   53   2H4     C   5          2H4         C   5  -5.384  17.168 -12.788
   54    H5     C   5           H5         C   5  -4.719  15.052 -11.879
   55    H6     C   5           H6         C   5  -4.247  13.832  -9.805
   56   1H5*    A   6          1H5*        A   6  -2.371  15.241  -4.087
   57   2H5*    A   6          2H5*        A   6  -1.114  14.020  -3.879
   58    H4*    A   6           H4*        A   6  -0.442  16.067  -3.037
   59    H3*    A   6           H3*        A   6  -0.748  13.883  -1.060
   60    H2*    A   6           H2*        A   6  -0.398  15.360   0.809
   61   2HO*    A   6          2HO*        A   6   1.334  16.623   0.294
   62    H1*    A   6           H1*        A   6  -1.681  17.581  -0.115
   63    H8     A   6           H8         A   6  -4.188  15.379  -1.436
   64   1H6     A   6          1H6         A   6  -6.287  14.503   4.333
   65   2H6     A   6          2H6         A   6  -6.576  14.175   2.642
   66    H2     A   6           H2         A   6  -2.373  16.565   4.616
   67   1H5*    U   7          1H5*        U   7   3.020  13.245   1.087
   68   2H5*    U   7          2H5*        U   7   2.007  14.581   0.560
   69    H4*    U   7           H4*        U   7   3.786  15.391   1.920
   70    H3*    U   7           H3*        U   7   3.153  16.588  -0.505
   71    H2*    U   7           H2*        U   7   4.910  15.511  -1.686
   72   2HO*    U   7          2HO*        U   7   5.717  17.996  -0.659
   73    H1*    U   7           H1*        U   7   6.773  15.931   0.677
   74    H3     U   7           H3         U   7  10.184  14.012  -1.506
   75    H5     U   7           H5         U   7   7.197  11.086  -1.514
   76    H6     U   7           H6         U   7   5.595  12.785  -0.775
   77   1H5*    A   8          1H5*        A   8   3.975  20.265  -0.543
   78   2H5*    A   8          2H5*        A   8   3.237  21.131   0.807
   79    H4*    A   8           H4*        A   8   2.511  22.198  -1.146
   80    H3*    A   8           H3*        A   8   0.647  21.285   0.621
   81    H2*    A   8           H2*        A   8   0.250  19.276  -0.661
   82   2HO*    A   8          2HO*        A   8  -1.824  20.311  -0.217
   83    H1*    A   8           H1*        A   8   0.066  21.127  -3.032
   84    H8     A   8           H8         A   8   2.237  17.967  -2.719
   85   1H6     A   8          1H6         A   8  -1.368  15.721  -7.228
   86   2H6     A   8          2H6         A   8   0.176  15.568  -6.426
   87    H2     A   8           H2         A   8  -3.263  19.431  -5.688
   88   1H5*    C   9          1H5*        C   9  -2.584  22.700  -0.267
   89   2H5*    C   9          2H5*        C   9  -2.861  24.229   0.578
   90    H4*    C   9           H4*        C   9  -4.434  22.622   1.362
   91    H3*    C   9           H3*        C   9  -2.347  23.251   3.430
   92    H2*    C   9           H2*        C   9  -3.585  21.792   4.917
   93   2HO*    C   9          2HO*        C   9  -5.695  22.552   3.710
   94    H1*    C   9           H1*        C   9  -3.964  19.789   3.092
   95   1H4     C   9          1H4         C   9   1.631  18.526   5.977
   96   2H4     C   9          2H4         C   9   2.443  19.070   4.523
   97    H5     C   9           H5         C   9   1.323  20.285   2.796
   98    H6     C   9           H6         C   9  -0.844  21.058   1.992
   99   1H5*    C  10          1H5*        C  10  -5.801  23.509   5.490
  100   2H5*    C  10          2H5*        C  10  -5.960  24.941   6.509
  101    H4*    C  10           H4*        C  10  -6.149  22.881   7.829
  102    H3*    C  10           H3*        C  10  -3.618  24.462   8.368
  103    H2*    C  10           H2*        C  10  -3.278  22.962  10.212
  104   2HO*    C  10          2HO*        C  10  -5.645  22.846  10.734
  105    H1*    C  10           H1*        C  10  -3.921  20.705   8.758
  106   1H4     C  10          1H4         C  10   2.363  21.082   8.157
  107   2H4     C  10          2H4         C  10   2.169  21.955   6.653
  108    H5     C  10           H5         C  10   0.055  22.785   5.876
  109    H6     C  10           H6         C  10  -2.340  22.898   6.382
  110   1H5*    U  11          1H5*        U  11  -4.994  24.818  12.311
  111   2H5*    U  11          2H5*        U  11  -4.490  26.405  12.911
  112    H4*    U  11           H4*        U  11  -3.384  24.393  13.974
  113    H3*    U  11           H3*        U  11  -1.653  26.444  12.599
  114    H2*    U  11           H2*        U  11   0.194  25.371  13.698
  115   2HO*    U  11          2HO*        U  11  -1.122  24.973  15.724
  116    H1*    U  11           H1*        U  11  -0.727  22.837  13.152
  117    H3     U  11           H3         U  11   2.948  23.503  10.491
  118    H5     U  11           H5         U  11  -0.107  25.569   8.509
  119    H6     U  11           H6         U  11  -1.577  25.127  10.424
  120   1H5*    C  12          1H5*        C  12   0.148  27.381  16.765
  121   2H5*    C  12          2H5*        C  12   1.169  28.672  16.128
  122    H4*    C  12           H4*        C  12   1.582  25.689  16.201
  123    H3*    C  12           H3*        C  12   2.779  27.778  17.492
  124    H2*    C  12           H2*        C  12   3.422  28.889  15.464
  125   2HO*    C  12          2HO*        C  12   5.390  27.922  16.951
  126    H1*    C  12           H1*        C  12   4.489  26.219  14.483
  127   1H4     C  12          1H4         C  12   5.523  29.930   9.412
  128   2H4     C  12          2H4         C  12   3.868  30.489   9.411
  129    H5     C  12           H5         C  12   2.259  29.823  11.064
  130    H6     C  12           H6         C  12   1.915  28.478  13.085
  131   1H5*    U  13          1H5*        U  13   3.749  23.269  18.560
  132   2H5*    U  13          2H5*        U  13   4.566  23.303  20.125
  133    H4*    U  13           H4*        U  13   5.568  21.433  19.274
  134    H3*    U  13           H3*        U  13   7.394  23.536  19.098
  135    H2*    U  13           H2*        U  13   6.760  24.033  16.823
  136   2HO*    U  13          2HO*        U  13   9.025  22.304  16.869
  137    H1*    U  13           H1*        U  13   6.894  21.020  16.358
  138    H3     U  13           H3         U  13   6.553  21.773  11.895
  139    H5     U  13           H5         U  13   3.624  24.300  13.475
  140    H6     U  13           H6         U  13   4.325  23.622  15.729
  141   1H5*    U  14          1H5*        U  14   9.983  18.662  19.765
  142   2H5*    U  14          2H5*        U  14  11.450  19.395  19.118
  143    H4*    U  14           H4*        U  14   8.733  19.211  17.774
  144    H3*    U  14           H3*        U  14  11.069  17.530  17.695
  145    H2*    U  14           H2*        U  14  12.248  19.044  16.364
  146   2HO*    U  14          2HO*        U  14  10.698  17.358  14.686
  147    H1*    U  14           H1*        U  14   9.593  19.760  15.033
  148    H3     U  14           H3         U  14  11.969  22.103  11.915
  149    H5     U  14           H5         U  14  13.550  23.472  15.540
  150    H6     U  14           H6         U  14  12.154  21.824  16.712
  151   1H5*    G  15          1H5*        G  15   6.284  15.021  16.061
  152   2H5*    G  15          2H5*        G  15   6.835  16.509  15.273
  153    H4*    G  15           H4*        G  15   4.689  16.587  17.408
  154    H3*    G  15           H3*        G  15   4.350  15.956  14.469
  155    H2*    G  15           H2*        G  15   2.131  16.914  14.715
  156   2HO*    G  15          2HO*        G  15   1.894  16.147  17.025
  157    H1*    G  15           H1*        G  15   3.112  19.131  15.928
  158    H8     G  15           H8         G  15   5.991  18.384  13.675
  159    H1     G  15           H1         G  15   0.843  20.513  10.466
  160   1H2     G  15          1H2         G  15  -0.926  20.318  11.687
  161   2H2     G  15          2H2         G  15  -0.845  19.860  13.377
  162   1H5*    G  16          1H5*        G  16   0.691  14.685  15.987
  163   2H5*    G  16          2H5*        G  16   0.290  13.073  15.380
  164    H4*    G  16           H4*        G  16  -1.529  14.628  14.973
  165    H3*    G  16           H3*        G  16  -0.106  13.781  12.434
  166    H2*    G  16           H2*        G  16  -1.954  14.869  11.291
  167   2HO*    G  16          2HO*        G  16  -3.554  14.209  13.022
  168    H1*    G  16           H1*        G  16  -1.812  17.115  12.801
  169    H8     G  16           H8         G  16   1.807  16.137  12.659
  170    H1     G  16           H1         G  16  -0.391  17.987   6.933
  171   1H2     G  16          1H2         G  16  -2.534  18.356   7.012
  172   2H2     G  16          2H2         G  16  -3.475  17.936   8.429
  173   1H5*    G  17          1H5*        G  17  -3.912  12.825  11.278
  174   2H5*    G  17          2H5*        G  17  -3.953  11.275  10.428
  175    H4*    G  17           H4*        G  17  -4.751  13.128   9.038
  176    H3*    G  17           H3*        G  17  -2.177  11.869   8.053
  177    H2*    G  17           H2*        G  17  -2.525  13.291   6.064
  178   2HO*    G  17          2HO*        G  17  -4.934  13.091   6.292
  179    H1*    G  17           H1*        G  17  -2.784  15.532   7.476
  180    H8     G  17           H8         G  17  -0.672  13.718   9.942
  181    H1     G  17           H1         G  17   2.604  15.914   4.873
  182   1H2     G  17          1H2         G  17   1.238  16.494   3.289
  183   2H2     G  17          2H2         G  17  -0.489  16.186   3.400
  184   1H5*    C  18          1H5*        C  18  -4.018  11.583   4.563
  185   2H5*    C  18          2H5*        C  18  -3.911   9.979   3.813
  186    H4*    C  18           H4*        C  18  -2.876  11.574   2.352
  187    H3*    C  18           H3*        C  18  -0.719   9.990   3.784
  188    H2*    C  18           H2*        C  18   0.848  11.111   2.229
  189   2HO*    C  18          2HO*        C  18  -0.238  11.558   0.325
  190    H1*    C  18           H1*        C  18  -0.044  13.456   2.828
  191   1H4     C  18          1H4         C  18   3.990  11.927   7.545
  192   2H4     C  18          2H4         C  18   2.637  11.463   8.545
  193    H5     C  18           H5         C  18   0.368  11.474   7.778
  194    H6     C  18           H6         C  18  -1.061  11.840   5.839
  195   1H5*    C  19          1H5*        C  19   0.654   9.800   0.119
  196   2H5*    C  19          2H5*        C  19   1.094   8.156  -0.370
  197    H4*    C  19           H4*        C  19   2.914   9.698  -0.795
  198    H3*    C  19           H3*        C  19   3.460   7.774   1.491
  199    H2*    C  19           H2*        C  19   5.769   8.456   1.191
  200   2HO*    C  19          2HO*        C  19   5.478   8.707  -1.221
  201    H1*    C  19           H1*        C  19   5.143  11.116   1.188
  202   1H4     C  19          1H4         C  19   5.926   9.334   7.283
  203   2H4     C  19          2H4         C  19   4.229   8.930   7.406
  204    H5     C  19           H5         C  19   2.726   8.983   5.542
  205    H6     C  19           H6         C  19   2.523   9.541   3.166
  206   1H5*    U  20          1H5*        U  20   6.478   6.895  -1.117
  207   2H5*    U  20          2H5*        U  20   6.631   5.153  -1.370
  208    H4*    U  20           H4*        U  20   8.751   6.128  -0.701
  209    H3*    U  20           H3*        U  20   7.559   4.413   1.498
  210    H2*    U  20           H2*        U  20   9.785   4.555   2.466
  211   2HO*    U  20          2HO*        U  20  10.891   4.606   0.291
  212    H1*    U  20           H1*        U  20   9.881   7.248   2.135
  213    H3     U  20           H3         U  20   8.964   6.333   6.557
  214    H5     U  20           H5         U  20   5.216   6.372   4.702
  215    H6     U  20           H6         U  20   6.351   6.509   2.527
  216   1H5*    G  21          1H5*        G  21  11.247   2.694   0.463
  217   2H5*    G  21          2H5*        G  21  11.222   0.932   0.518
  218    H4*    G  21           H4*        G  21  13.051   1.840   1.838
  219    H3*    G  21           H3*        G  21  10.910   0.591   3.578
  220    H2*    G  21           H2*        G  21  12.576   0.805   5.357
  221   2HO*    G  21          2HO*        G  21  14.437   0.512   3.721
  222    H1*    G  21           H1*        G  21  13.031   3.407   4.763
  223    H8     G  21           H8         G  21   9.390   2.908   3.814
  224    H1     G  21           H1         G  21  10.359   3.153  10.169
  225   1H2     G  21          1H2         G  21  12.453   2.861  10.610
  226   2H2     G  21          2H2         G  21  13.669   2.809   9.350
  227   1H5*    G  22          1H5*        G  22  14.452  -1.212   4.616
  228   2H5*    G  22          2H5*        G  22  14.355  -2.967   4.693
  229    H4*    G  22           H4*        G  22  15.406  -2.054   6.695
  230    H3*    G  22           H3*        G  22  12.691  -3.322   7.167
  231    H2*    G  22           H2*        G  22  13.038  -2.960   9.502
  232   2HO*    G  22          2HO*        G  22  15.350  -3.530   9.457
  233    H1*    G  22           H1*        G  22  14.061  -0.431   9.247
  234    H8     G  22           H8         G  22  11.334  -0.549   6.646
  235    H1     G  22           H1         G  22   9.086  -0.084  12.657
  236   1H2     G  22          1H2         G  22  10.621  -0.630  14.067
  237   2H2     G  22          2H2         G  22  12.269  -0.963  13.570
  238   1H5*    U  23          1H5*        U  23  12.673  -7.461   9.705
  239   2H5*    U  23          2H5*        U  23  11.635  -6.119   9.169
  240    H4*    U  23           H4*        U  23  13.135  -6.212  11.803
  241    H3*    U  23           H3*        U  23  10.220  -6.500  10.987
  242    H2*    U  23           H2*        U  23   9.674  -5.882  13.216
  243   2HO*    U  23          2HO*        U  23  11.611  -6.926  14.220
  244    H1*    U  23           H1*        U  23  11.338  -3.715  13.091
  245    H3     U  23           H3         U  23   6.806  -2.694  12.458
  246    H5     U  23           H5         U  23   8.446  -3.055   8.629
  247    H6     U  23           H6         U  23  10.529  -3.871   9.651
  248   1H5*    U  24          1H5*        U  24   9.857  -8.473  13.982
  249   2H5*    U  24          2H5*        U  24   9.216 -10.115  13.917
  250    H4*    U  24           H4*        U  24   7.824  -8.783  15.342
  251    H3*    U  24           H3*        U  24   6.512  -9.225  12.667
  252    H2*    U  24           H2*        U  24   4.507  -8.435  13.615
  253   2HO*    U  24          2HO*        U  24   4.791  -9.427  15.771
  254    H1*    U  24           H1*        U  24   5.798  -6.319  14.853
  255    H3     U  24           H3         U  24   3.281  -4.815  11.263
  256    H5     U  24           H5         U  24   6.905  -6.064   9.570
  257    H6     U  24           H6         U  24   7.600  -6.892  11.775
  258   1H5*    A  25          1H5*        A  25   5.119 -13.258  11.268
  259   2H5*    A  25          2H5*        A  25   6.833 -13.534  11.027
  260    H4*    A  25           H4*        A  25   5.880 -13.082   8.890
  261    H3*    A  25           H3*        A  25   8.011 -11.466   9.703
  262    H2*    A  25           H2*        A  25   6.500  -9.684  10.389
  263   2HO*    A  25          2HO*        A  25   8.113  -8.763   9.053
  264    H1*    A  25           H1*        A  25   5.213 -10.418   7.693
  265    H8     A  25           H8         A  25   3.672  -9.405  11.160
  266   1H6     A  25          1H6         A  25   0.810  -4.974   7.825
  267   2H6     A  25          2H6         A  25   0.764  -5.874   9.330
  268    H2     A  25           H2         A  25   3.830  -6.960   5.228
  269   1H5*    G  26          1H5*        G  26   8.057 -14.410   4.608
  270   2H5*    G  26          2H5*        G  26   7.971 -12.677   4.360
  271    H4*    G  26           H4*        G  26   6.025 -13.396   6.389
  272    H3*    G  26           H3*        G  26   6.311 -15.649   4.737
  273    H2*    G  26           H2*        G  26   6.139 -14.195   2.857
  274   2HO*    G  26          2HO*        G  26   3.674 -15.596   3.248
  275    H1*    G  26           H1*        G  26   3.615 -13.215   4.265
  276    H8     G  26           H8         G  26   5.708 -12.993   1.111
  277    H1     G  26           H1         G  26   1.136  -8.532   1.585
  278   1H2     G  26          1H2         G  26   0.621  -8.264   3.665
  279   2H2     G  26          2H2         G  26   1.136  -9.386   4.912
  280   1H5*    U  27          1H5*        U  27   4.950 -16.127   7.930
  281   2H5*    U  27          2H5*        U  27   4.198 -17.702   8.268
  282    H4*    U  27           H4*        U  27   3.920 -16.624  10.293
  283    H3*    U  27           H3*        U  27   1.394 -15.880   8.750
  284    H2*    U  27           H2*        U  27   0.760 -14.534  10.640
  285   2HO*    U  27          2HO*        U  27   1.912 -16.204  12.135
  286    H1*    U  27           H1*        U  27   3.131 -13.311  10.961
  287    H3     U  27           H3         U  27   0.418 -10.382   8.682
  288    H5     U  27           H5         U  27   3.172 -11.934   5.968
  289    H6     U  27           H6         U  27   3.585 -13.787   7.521
  290   1H5*    A  28          1H5*        A  28  -0.193 -16.012  12.470
  291   2H5*    A  28          2H5*        A  28  -1.465 -17.228  12.519
  292    H4*    A  28           H4*        A  28  -2.352 -15.116  13.302
  293    H3*    A  28           H3*        A  28  -3.387 -15.875  10.541
  294    H2*    A  28           H2*        A  28  -4.801 -13.914  10.700
  295   2HO*    A  28          2HO*        A  28  -5.085 -14.254  13.124
  296    H1*    A  28           H1*        A  28  -2.828 -12.284  11.607
  297    H8     A  28           H8         A  28  -0.772 -14.275   9.262
  298   1H6     A  28          1H6         A  28  -3.083 -10.614   4.789
  299   2H6     A  28          2H6         A  28  -1.836 -11.789   5.167
  300    H2     A  28           H2         A  28  -5.950 -10.639   8.167
  301   1H5*    C  29          1H5*        C  29  -6.910 -15.053  11.883
  302   2H5*    C  29          2H5*        C  29  -8.134 -16.285  11.540
  303    H4*    C  29           H4*        C  29  -8.653 -14.245  10.335
  304    H3*    C  29           H3*        C  29  -7.681 -16.452   8.508
  305    H2*    C  29           H2*        C  29  -8.229 -14.945   6.670
  306   2HO*    C  29          2HO*        C  29 -10.178 -14.060   7.859
  307    H1*    C  29           H1*        C  29  -7.046 -12.802   7.738
  308   1H4     C  29          1H4         C  29  -2.340 -15.636   4.534
  309   2H4     C  29          2H4         C  29  -1.833 -16.441   6.000
  310    H5     C  29           H5         C  29  -3.102 -16.410   8.025
  311    H6     C  29           H6         C  29  -5.111 -15.518   9.089
  312   1H5*    C  30          1H5*        C  30 -11.325 -15.516   6.739
  313   2H5*    C  30          2H5*        C  30 -12.202 -16.965   6.223
  314    H4*    C  30           H4*        C  30 -11.701 -15.491   4.326
  315    H3*    C  30           H3*        C  30 -10.082 -18.051   4.270
  316    H2*    C  30           H2*        C  30  -9.445 -17.358   2.031
  317   2HO*    C  30          2HO*        C  30 -11.679 -16.289   1.710
  318    H1*    C  30           H1*        C  30  -8.925 -14.785   2.822
  319   1H4     C  30          1H4         C  30  -3.622 -18.333   3.175
  320   2H4     C  30          2H4         C  30  -4.012 -18.809   4.813
  321    H5     C  30           H5         C  30  -6.042 -18.164   5.923
  322    H6     C  30           H6         C  30  -8.164 -16.971   5.637
  323   1H5*    U  31          1H5*        U  31 -12.188 -17.735   0.520
  324   2H5*    U  31          2H5*        U  31 -13.126 -19.192   0.193
  325    H4*    U  31           H4*        U  31 -12.037 -18.430  -1.824
  326    H3*    U  31           H3*        U  31 -10.810 -20.983  -0.768
  327    H2*    U  31           H2*        U  31  -9.594 -21.078  -2.830
  328   2HO*    U  31          2HO*        U  31 -11.475 -20.179  -4.102
  329    H1*    U  31           H1*        U  31  -8.894 -18.431  -2.795
  330    H3     U  31           H3         U  31  -5.082 -20.778  -1.689
  331    H5     U  31           H5         U  31  -7.055 -20.083   1.944
  332    H6     U  31           H6         U  31  -9.029 -19.359   0.683
  333   1H5*    C  32          1H5*        C  32 -11.965 -22.373  -4.296
  334   2H5*    C  32          2H5*        C  32 -12.720 -23.970  -4.253
  335    H4*    C  32           H4*        C  32 -10.661 -24.055  -5.543
  336    H3*    C  32           H3*        C  32 -10.329 -25.425  -2.855
  337    H2*    C  32           H2*        C  32  -8.142 -26.069  -3.643
  338   2HO*    C  32          2HO*        C  32  -9.074 -26.312  -5.956
  339    H1*    C  32           H1*        C  32  -7.564 -23.611  -4.752
  340   1H4     C  32          1H4         C  32  -5.143 -23.916   1.144
  341   2H4     C  32          2H4         C  32  -6.687 -23.490   1.846
  342    H5     C  32           H5         C  32  -8.673 -23.145   0.542
  343    H6     C  32           H6         C  32  -9.593 -23.211  -1.728
  344   1H5*    U  33          1H5*        U  33  -8.490 -28.115  -4.854
  345   2H5*    U  33          2H5*        U  33  -9.209 -29.722  -4.736
  346    H4*    U  33           H4*        U  33  -6.890 -29.909  -4.081
  347    H3*    U  33           H3*        U  33  -8.744 -29.929  -1.677
  348    H2*    U  33           H2*        U  33  -6.951 -30.303  -0.329
  349   2HO*    U  33          2HO*        U  33  -4.990 -30.903  -2.340
  350    H1*    U  33           H1*        U  33  -5.118 -28.791  -1.867
  351    H3     U  33           H3         U  33  -5.079 -27.028   2.351
  352    H5     U  33           H5         U  33  -8.985 -26.290   1.052
  353    H6     U  33           H6         U  33  -8.452 -27.441  -1.051
  354   1H5*    U  34          1H5*        U  34  -8.964 -35.527  -0.850
  355   2H5*    U  34          2H5*        U  34  -8.223 -34.554   0.425
  356    H4*    U  34           H4*        U  34  -7.103 -36.708   0.176
  357    H3*    U  34           H3*        U  34  -5.678 -34.384   0.476
  358    H2*    U  34           H2*        U  34  -5.372 -34.049  -1.882
  359   2HO*    U  34          2HO*        U  34  -3.140 -35.508  -0.855
  360    H1*    U  34           H1*        U  34  -4.700 -37.013  -2.062
  361    H3     U  34           H3         U  34  -3.701 -36.624  -6.450
  362    H5     U  34           H5         U  34  -7.027 -34.114  -6.076
  363    H6     U  34           H6         U  34  -7.087 -34.638  -3.677
  364   1H5*    C  35          1H5*        C  35  -2.217 -34.616   1.200
  365   2H5*    C  35          2H5*        C  35  -1.874 -35.476   2.702
  366    H4*    C  35           H4*        C  35  -0.825 -33.286   2.657
  367    H3*    C  35           H3*        C  35  -2.050 -34.257   4.899
  368    H2*    C  35           H2*        C  35  -4.168 -33.256   4.393
  369   2HO*    C  35          2HO*        C  35  -2.679 -31.523   6.095
  370    H1*    C  35           H1*        C  35  -2.768 -30.649   3.709
  371   1H4     C  35          1H4         C  35  -8.937 -29.685   2.370
  372   2H4     C  35          2H4         C  35  -8.935 -31.018   1.228
  373    H5     C  35           H5         C  35  -7.067 -32.471   0.949
  374    H6     C  35           H6         C  35  -4.713 -32.810   1.488
  375   1H5*    G  36          1H5*        G  36   2.491 -31.073   4.811
  376   2H5*    G  36          2H5*        G  36   0.939 -31.121   3.956
  377    H4*    G  36           H4*        G  36   3.464 -32.579   3.080
  378    H3*    G  36           H3*        G  36   2.021 -30.122   2.011
  379    H2*    G  36           H2*        G  36   2.820 -30.737  -0.134
  380   2HO*    G  36          2HO*        G  36   5.037 -31.267   0.961
  381    H1*    G  36           H1*        G  36   2.803 -33.522   0.430
  382    H8     G  36           H8         G  36   1.492 -34.003  -1.797
  383    H1     G  36           H1         G  36  -3.066 -29.673  -0.392
  384   1H2     G  36          1H2         G  36  -2.612 -28.660   1.433
  385   2H2     G  36          2H2         G  36  -1.148 -28.968   2.341
  386   1H5*    G  37          1H5*        G  37   4.603 -29.193  -0.008
  387   2H5*    G  37          2H5*        G  37   5.095 -27.502  -0.095
  388    H4*    G  37           H4*        G  37   3.767 -28.461  -2.065
  389    H3*    G  37           H3*        G  37   2.700 -25.976  -0.672
  390    H2*    G  37           H2*        G  37   1.161 -25.924  -2.599
  391   2HO*    G  37          2HO*        G  37   2.910 -26.974  -4.061
  392    H1*    G  37           H1*        G  37   0.474 -28.511  -2.326
  393    H8     G  37           H8         G  37   1.261 -27.152   1.177
  394    H1     G  37           H1         G  37  -4.270 -24.989  -1.271
  395   1H2     G  37          1H2         G  37  -4.444 -25.587  -3.339
  396   2H2     G  37          2H2         G  37  -3.309 -26.690  -4.088
  397   1H5*    U  38          1H5*        U  38   2.207 -25.092  -4.540
  398   2H5*    U  38          2H5*        U  38   2.917 -23.583  -5.093
  399    H4*    U  38           H4*        U  38   0.591 -23.758  -5.756
  400    H3*    U  38           H3*        U  38   1.020 -21.645  -3.665
  401    H2*    U  38           H2*        U  38  -1.191 -20.866  -4.212
  402   2HO*    U  38          2HO*        U  38  -1.153 -21.317  -6.518
  403    H1*    U  38           H1*        U  38  -2.252 -23.364  -4.020
  404    H3     U  38           H3         U  38  -3.323 -21.424   0.000
  405    H5     U  38           H5         U  38   0.541 -22.921   0.556
  406    H6     U  38           H6         U  38   0.645 -23.403  -1.842
  407   1H5*    G  39          1H5*        G  39  -0.002 -19.435  -6.993
  408   2H5*    G  39          2H5*        G  39   0.869 -17.904  -7.036
  409    H4*    G  39           H4*        G  39  -1.500 -17.547  -7.117
  410    H3*    G  39           H3*        G  39  -0.442 -16.687  -4.418
  411    H2*    G  39           H2*        G  39  -2.685 -15.739  -4.138
  412   2HO*    G  39          2HO*        G  39  -2.900 -15.265  -6.552
  413    H1*    G  39           H1*        G  39  -3.874 -18.048  -4.861
  414    H8     G  39           H8         G  39  -0.529 -18.992  -3.247
  415    H1     G  39           H1         G  39  -5.062 -17.240   0.956
  416   1H2     G  39          1H2         G  39  -6.690 -16.277  -0.085
  417   2H2     G  39          2H2         G  39  -6.791 -16.250  -1.832
  418   1H5*    G  40          1H5*        G  40  -2.483 -13.433  -5.943
  419   2H5*    G  40          2H5*        G  40  -1.695 -11.883  -5.600
  420    H4*    G  40           H4*        G  40  -4.041 -11.860  -4.941
  421    H3*    G  40           H3*        G  40  -1.990 -11.599  -2.712
  422    H2*    G  40           H2*        G  40  -3.909 -11.252  -1.241
  423   2HO*    G  40          2HO*        G  40  -5.090 -10.053  -3.090
  424    H1*    G  40           H1*        G  40  -5.390 -13.275  -2.226
  425    H8     G  40           H8         G  40  -1.895 -14.663  -2.444
  426    H1     G  40           H1         G  40  -4.080 -14.294   3.587
  427   1H2     G  40          1H2         G  40  -5.858 -13.076   3.666
  428   2H2     G  40          2H2         G  40  -6.544 -12.342   2.232
  429   1H5*    G  41          1H5*        G  41  -4.294  -9.036  -1.194
  430   2H5*    G  41          2H5*        G  41  -3.511  -7.497  -0.841
  431    H4*    G  41           H4*        G  41  -4.260  -8.432   1.241
  432    H3*    G  41           H3*        G  41  -1.266  -8.756   0.913
  433    H2*    G  41           H2*        G  41  -1.272  -9.498   3.245
  434   2HO*    G  41          2HO*        G  41  -3.061  -8.205   4.043
  435    H1*    G  41           H1*        G  41  -3.213 -11.308   2.790
  436    H8     G  41           H8         G  41  -1.532 -11.065  -0.590
  437    H1     G  41           H1         G  41   1.651 -14.742   3.606
  438   1H2     G  41          1H2         G  41   0.870 -14.490   5.583
  439   2H2     G  41          2H2         G  41  -0.456 -13.406   5.956
  440   1H5*    A  42          1H5*        A  42  -0.249  -4.793   4.502
  441   2H5*    A  42          2H5*        A  42  -0.075  -6.146   5.625
  442    H4*    A  42           H4*        A  42  -2.658  -5.183   4.340
  443    H3*    A  42           H3*        A  42  -1.609  -5.338   7.174
  444    H2*    A  42           H2*        A  42  -3.872  -5.686   7.934
  445   2HO*    A  42          2HO*        A  42  -4.791  -4.267   6.126
  446    H1*    A  42           H1*        A  42  -4.358  -7.678   6.218
  447    H8     A  42           H8         A  42  -0.825  -8.474   6.319
  448   1H6     A  42          1H6         A  42  -1.477 -10.377  12.211
  449   2H6     A  42          2H6         A  42  -0.484 -10.496  10.776
  450    H2     A  42           H2         A  42  -5.122  -8.108  11.109
  451   1H5*    A  43          1H5*        A  43  -4.344  -2.791   7.542
  452   2H5*    A  43          2H5*        A  43  -4.339  -1.213   8.289
  453    H4*    A  43           H4*        A  43  -5.755  -2.665   9.583
  454    H3*    A  43           H3*        A  43  -3.104  -2.235  11.014
  455    H2*    A  43           H2*        A  43  -3.959  -3.644  12.792
  456   2HO*    A  43          2HO*        A  43  -6.238  -2.723  12.420
  457    H1*    A  43           H1*        A  43  -4.973  -5.563  11.102
  458    H8     A  43           H8         A  43  -1.911  -4.718   9.230
  459   1H6     A  43          1H6         A  43   1.247  -8.255  13.222
  460   2H6     A  43          2H6         A  43   1.247  -7.566  11.609
  461    H2     A  43           H2         A  43  -2.668  -7.269  15.078
  462   1H5*    U  44          1H5*        U  44  -5.200  -1.624  14.172
  463   2H5*    U  44          2H5*        U  44  -4.771  -0.137  15.032
  464    H4*    U  44           H4*        U  44  -4.204  -2.049  16.408
  465    H3*    U  44           H3*        U  44  -1.768  -0.696  15.216
  466    H2*    U  44           H2*        U  44  -0.456  -2.156  16.607
  467   2HO*    U  44          2HO*        U  44  -2.142  -2.048  18.405
  468    H1*    U  44           H1*        U  44  -1.886  -4.407  16.010
  469    H3     U  44           H3         U  44   2.081  -4.688  13.643
  470    H5     U  44           H5         U  44  -0.484  -2.476  11.185
  471    H6     U  44           H6         U  44  -2.062  -2.331  13.051
  472   1H5*    A  45          1H5*        A  45  -0.924  -0.632  19.279
  473   2H5*    A  45          2H5*        A  45  -0.156   0.882  19.770
  474    H4*    A  45           H4*        A  45   1.294  -1.033  20.212
  475    H3*    A  45           H3*        A  45   2.326   0.731  17.963
  476    H2*    A  45           H2*        A  45   4.349  -0.579  18.135
  477   2HO*    A  45          2HO*        A  45   4.058  -0.870  20.573
  478    H1*    A  45           H1*        A  45   3.016  -2.946  18.105
  479    H8     A  45           H8         A  45   0.960  -0.504  16.005
  480   1H6     A  45          1H6         A  45   4.755  -1.972  11.298
  481   2H6     A  45          2H6         A  45   3.235  -1.216  11.733
  482    H2     A  45           H2         A  45   6.459  -3.675  15.014
  483   1H5*    C  46          1H5*        C  46   5.400   0.575  20.715
  484   2H5*    C  46          2H5*        C  46   6.128   2.161  20.976
  485    H4*    C  46           H4*        C  46   7.809   0.527  20.353
  486    H3*    C  46           H3*        C  46   7.307   2.563  18.151
  487    H2*    C  46           H2*        C  46   9.346   1.682  17.202
  488   2HO*    C  46          2HO*        C  46  10.318   1.286  19.435
  489    H1*    C  46           H1*        C  46   8.578  -0.920  17.604
  490   1H4     C  46          1H4         C  46   6.574   0.734  11.779
  491   2H4     C  46          2H4         C  46   5.047   1.274  12.437
  492    H5     C  46           H5         C  46   4.595   1.392  14.792
  493    H6     C  46           H6         C  46   5.526   0.968  17.020
  494   1H5*    C  47          1H5*        C  47  11.310   2.969  19.078
  495   2H5*    C  47          2H5*        C  47  11.813   4.661  19.123
  496    H4*    C  47           H4*        C  47  13.189   3.379  17.581
  497    H3*    C  47           H3*        C  47  11.336   5.307  16.145
  498    H2*    C  47           H2*        C  47  12.759   4.851  14.225
  499   2HO*    C  47          2HO*        C  47  14.765   4.616  15.603
  500    H1*    C  47           H1*        C  47  12.688   2.148  14.671
  501   1H4     C  47          1H4         C  47   7.837   3.479  10.755
  502   2H4     C  47          2H4         C  47   6.798   3.838  12.116
  503    H5     C  47           H5         C  47   7.565   3.863  14.392
  504    H6     C  47           H6         C  47   9.517   3.526  15.838
  505   1H5*    A  48          1H5*        A  48  15.268   6.455  15.134
  506   2H5*    A  48          2H5*        A  48  15.440   8.209  15.068
  507    H4*    A  48           H4*        A  48  16.216   7.165  13.013
  508    H3*    A  48           H3*        A  48  13.648   8.725  12.614
  509    H2*    A  48           H2*        A  48  14.140   8.448  10.237
  510   2HO*    A  48          2HO*        A  48  16.582   8.488  10.641
  511    H1*    A  48           H1*        A  48  14.548   5.783  10.520
  512    H8     A  48           H8         A  48  11.970   6.619  13.173
  513   1H6     A  48          1H6         A  48   7.724   6.468   8.628
  514   2H6     A  48          2H6         A  48   7.973   6.535  10.360
  515    H2     A  48           H2         A  48  11.745   6.376   6.745
  516   1H5*    G  49          1H5*        G  49  16.393  10.304   9.979
  517   2H5*    G  49          2H5*        G  49  16.353  12.060   9.857
  518    H4*    G  49           H4*        G  49  16.191  11.002   7.667
  519    H3*    G  49           H3*        G  49  13.601  12.376   8.483
  520    H2*    G  49           H2*        G  49  12.957  11.971   6.157
  521   2HO*    G  49          2HO*        G  49  15.358  12.180   5.444
  522    H1*    G  49           H1*        G  49  13.705   9.375   6.242
  523    H8     G  49           H8         G  49  12.545  10.004   9.780
  524    H1     G  49           H1         G  49   7.715   9.746   5.543
  525   1H2     G  49          1H2         G  49   8.477  10.036   3.544
  526   2H2     G  49          2H2         G  49  10.194  10.028   3.197
  527   1H5*    G  50          1H5*        G  50  14.321  13.730   4.743
  528   2H5*    G  50          2H5*        G  50  14.259  15.482   4.584
  529    H4*    G  50           H4*        G  50  12.869  14.368   2.900
  530    H3*    G  50           H3*        G  50  11.277  15.922   4.972
  531    H2*    G  50           H2*        G  50   9.370  15.507   3.486
  532   2HO*    G  50          2HO*        G  50  10.895  15.600   1.505
  533    H1*    G  50           H1*        G  50   9.989  12.869   3.143
  534    H8     G  50           H8         G  50  10.942  13.265   6.732
  535    H1     G  50           H1         G  50   4.571  13.105   5.785
  536   1H2     G  50          1H2         G  50   4.136  13.295   3.695
  537   2H2     G  50          2H2         G  50   5.373  13.687   2.517
  538   1H5*    U  51          1H5*        U  51   9.993  17.262   1.390
  539   2H5*    U  51          2H5*        U  51  10.216  18.983   1.077
  540    H4*    U  51           H4*        U  51   7.948  18.293   0.518
  541    H3*    U  51           H3*        U  51   8.582  20.461   2.209
  542    H2*    U  51           H2*        U  51   7.844  19.550   4.142
  543   2HO*    U  51          2HO*        U  51   5.174  20.038   3.258
  544    H1*    U  51           H1*        U  51   5.654  17.982   2.796
  545    H3     U  51           H3         U  51   4.496  16.330   6.780
  546    H5     U  51           H5         U  51   8.646  16.753   7.180
  547    H6     U  51           H6         U  51   8.750  17.425   4.820
  548   1H5*    G  52          1H5*        G  52   7.720  22.435  -1.931
  549   2H5*    G  52          2H5*        G  52   6.123  22.665  -2.632
  550    H4*    G  52           H4*        G  52   7.294  19.965  -1.846
  551    H3*    G  52           H3*        G  52   6.809  21.340  -4.514
  552    H2*    G  52           H2*        G  52   6.632  19.132  -5.455
  553   2HO*    G  52          2HO*        G  52   7.049  17.893  -2.921
  554    H1*    G  52           H1*        G  52   4.980  18.269  -3.447
  555    H8     G  52           H8         G  52   3.938  21.851  -3.954
  556    H1     G  52           H1         G  52   1.557  17.746  -8.288
  557   1H2     G  52          1H2         G  52   2.790  15.970  -8.373
  558   2H2     G  52          2H2         G  52   4.100  15.690  -7.247
  559   1H5*    C  53          1H5*        C  53   9.495  18.375  -5.632
  560   2H5*    C  53          2H5*        C  53  10.722  18.995  -6.746
  561    H4*    C  53           H4*        C  53   9.592  17.077  -7.702
  562    H3*    C  53           H3*        C  53   8.792  19.635  -9.126
  563    H2*    C  53           H2*        C  53   7.804  18.139 -10.760
  564   2HO*    C  53          2HO*        C  53   9.572  16.457 -10.415
  565    H1*    C  53           H1*        C  53   6.595  16.602  -8.856
  566   1H4     C  53          1H4         C  53   2.265  21.058 -10.102
  567   2H4     C  53          2H4         C  53   2.956  22.100  -8.878
  568    H5     C  53           H5         C  53   5.057  21.661  -7.809
  569    H6     C  53           H6         C  53   6.829  19.993  -7.535
  570   1H5*    C  54          1H5*        C  54  10.204  17.164 -12.214
  571   2H5*    C  54          2H5*        C  54  11.178  18.073 -13.373
  572    H4*    C  54           H4*        C  54   9.354  16.901 -14.483
  573    H3*    C  54           H3*        C  54   8.948  19.912 -14.477
  574    H2*    C  54           H2*        C  54   7.186  19.451 -16.073
  575   2HO*    C  54          2HO*        C  54   8.454  17.547 -17.017
  576    H1*    C  54           H1*        C  54   6.149  17.413 -14.583
  577   1H4     C  54          1H4         C  54   3.132  22.642 -12.588
  578   2H4     C  54          2H4         C  54   4.368  22.917 -11.382
  579    H5     C  54           H5         C  54   6.396  21.646 -11.259
  580    H6     C  54           H6         C  54   7.626  19.769 -12.237
  581   1H5*    C  55          1H5*        C  55   8.682  18.898 -18.533
  582   2H5*    C  55          2H5*        C  55   9.607  20.034 -19.520
  583    H4*    C  55           H4*        C  55   7.303  19.892 -20.298
  584    H3*    C  55           H3*        C  55   7.990  22.541 -18.995
  585    H2*    C  55           H2*        C  55   5.876  23.321 -19.781
  586   2HO*    C  55          2HO*        C  55   6.074  22.136 -21.893
  587    H1*    C  55           H1*        C  55   4.518  21.000 -19.135
  588   1H4     C  55          1H4         C  55   3.796  25.180 -14.361
  589   2H4     C  55          2H4         C  55   5.328  24.700 -13.670
  590    H5     C  55           H5         C  55   6.785  23.090 -14.684
  591    H6     C  55           H6         C  55   7.098  21.642 -16.633
  592   1H    MET 104          1H        MET 104  10.733 -16.013   2.483
  593    HA   MET 104           HA       MET 104  11.528 -13.206   1.962
  594   1HB   MET 104          1HB       MET 104  13.433 -14.422   3.175
  595   2HB   MET 104          2HB       MET 104  13.559 -15.477   1.777
  596   1HG   MET 104          1HG       MET 104  14.937 -14.011   0.853
  597   2HG   MET 104          2HG       MET 104  13.633 -12.842   0.712
  598   1HE   MET 104          1HE       MET 104  13.672 -10.492   2.099
  599   2HE   MET 104          2HE       MET 104  12.886 -11.616   3.244
  600   3HE   MET 104          3HE       MET 104  14.145 -10.506   3.804
  601    H    TYR 105           H        TYR 105  11.122 -12.699  -0.102
  602    HA   TYR 105           HA       TYR 105  10.562 -14.927  -2.032
  603   1HB   TYR 105          1HB       TYR 105   9.375 -12.164  -1.635
  604   2HB   TYR 105          2HB       TYR 105   9.210 -13.003  -3.171
  605    HD1  TYR 105           HD1      TYR 105   7.614 -14.651  -3.518
  606    HD2  TYR 105           HD2      TYR 105   8.558 -13.630   0.602
  607    HE1  TYR 105           HE1      TYR 105   5.888 -16.229  -2.699
  608    HE2  TYR 105           HE2      TYR 105   6.969 -15.342   1.380
  609    HH   TYR 105           HH       TYR 105   4.968 -17.268  -0.894
  610    H    VAL 106           H        VAL 106  11.904 -15.208  -3.686
  611    HA   VAL 106           HA       VAL 106  13.978 -13.099  -4.149
  612    HB   VAL 106           HB       VAL 106  14.017 -16.089  -4.699
  613   1HG1  VAL 106          1HG1      VAL 106  15.636 -14.958  -6.156
  614   2HG1  VAL 106          2HG1      VAL 106  16.317 -14.087  -4.764
  615   3HG1  VAL 106          3HG1      VAL 106  16.475 -15.849  -4.897
  616   1HG2  VAL 106          1HG2      VAL 106  13.954 -15.637  -2.291
  617   2HG2  VAL 106          2HG2      VAL 106  15.534 -16.254  -2.809
  618   3HG2  VAL 106          3HG2      VAL 106  15.327 -14.503  -2.476
  619    H    CYS 107           H        CYS 107  14.464 -12.301  -6.131
  620    HA   CYS 107           HA       CYS 107  12.718 -12.881  -8.414
  621   1HB   CYS 107          1HB       CYS 107  13.538 -10.576  -7.942
  622   2HB   CYS 107          2HB       CYS 107  15.200 -11.139  -8.135
  623    H    HIS 108           H        HIS 108  13.125 -14.293  -9.999
  624    HA   HIS 108           HA       HIS 108  15.781 -15.661  -9.993
  625   1HB   HIS 108          1HB       HIS 108  13.050 -16.684 -10.905
  626   2HB   HIS 108          2HB       HIS 108  14.563 -17.600 -10.967
  627    HD2  HIS 108           HD2      HIS 108  11.666 -17.674  -8.936
  628    HE1  HIS 108           HE1      HIS 108  14.683 -17.872  -5.916
  629    HE2  HIS 108           HE2      HIS 108  12.204 -18.218  -6.415
  630    H    PHE 109           H        PHE 109  14.927 -13.112 -11.445
  631    HA   PHE 109           HA       PHE 109  14.895 -13.672 -14.280
  632   1HB   PHE 109          1HB       PHE 109  14.499 -11.410 -12.943
  633   2HB   PHE 109          2HB       PHE 109  16.236 -11.218 -13.075
  634    HD1  PHE 109           HD1      PHE 109  13.020 -11.160 -14.739
  635    HD2  PHE 109           HD2      PHE 109  17.281 -10.829 -15.259
  636    HE1  PHE 109           HE1      PHE 109  12.634 -10.295 -17.044
  637    HE2  PHE 109           HE2      PHE 109  16.905  -9.934 -17.587
  638    HZ   PHE 109           HZ       PHE 109  14.572  -9.662 -18.461
  639    H    GLU 110           H        GLU 110  16.699 -13.492 -15.774
  640    HA   GLU 110           HA       GLU 110  18.741 -15.282 -15.160
  641   1HB   GLU 110          1HB       GLU 110  17.999 -14.619 -17.444
  642   2HB   GLU 110          2HB       GLU 110  18.842 -13.076 -17.275
  643   1HG   GLU 110          1HG       GLU 110  21.002 -14.286 -17.044
  644   2HG   GLU 110          2HG       GLU 110  20.153 -15.831 -17.122
  645    H    ASN 111           H        ASN 111  20.283 -15.118 -13.634
  646    HA   ASN 111           HA       ASN 111  22.274 -14.450 -12.666
  647   1HB   ASN 111          1HB       ASN 111  22.803 -13.691 -15.105
  648   2HB   ASN 111          2HB       ASN 111  22.428 -12.059 -14.554
  649   1HD2  ASN 111          1HD2      ASN 111  24.505 -11.192 -14.717
  650   2HD2  ASN 111          2HD2      ASN 111  25.843 -11.785 -13.742
  651    H    CYS 112           H        CYS 112  19.441 -13.144 -12.146
  652    HA   CYS 112           HA       CYS 112  20.173 -10.553 -10.955
  653   1HB   CYS 112          1HB       CYS 112  18.033 -10.851 -12.092
  654   2HB   CYS 112          2HB       CYS 112  17.524 -12.081 -10.907
  655    H    GLY 113           H        GLY 113  18.201 -13.200  -9.484
  656   1HA   GLY 113          1HA       GLY 113  18.372 -14.317  -7.469
  657   2HA   GLY 113          2HA       GLY 113  20.082 -13.854  -7.438
  658    H    LYS 114           H        LYS 114  17.932 -11.114  -7.624
  659    HA   LYS 114           HA       LYS 114  18.698 -10.176  -4.984
  660   1HB   LYS 114          1HB       LYS 114  18.040  -8.875  -7.134
  661   2HB   LYS 114          2HB       LYS 114  16.372  -9.070  -6.581
  662   1HG   LYS 114          1HG       LYS 114  16.854  -7.788  -4.563
  663   2HG   LYS 114          2HG       LYS 114  18.609  -7.878  -4.857
  664   1HD   LYS 114          1HD       LYS 114  18.362  -6.550  -6.924
  665   2HD   LYS 114          2HD       LYS 114  16.619  -6.531  -6.685
  666   1HE   LYS 114          1HE       LYS 114  17.453  -4.420  -6.128
  667   2HE   LYS 114          2HE       LYS 114  16.834  -5.193  -4.661
  668   1HZ   LYS 114          1HZ       LYS 114  19.714  -5.023  -5.415
  669   2HZ   LYS 114          2HZ       LYS 114  18.990  -4.112  -4.273
  670   3HZ   LYS 114          3HZ       LYS 114  19.145  -5.717  -4.048
  671    H    ALA 115           H        ALA 115  17.505 -10.022  -3.073
  672    HA   ALA 115           HA       ALA 115  15.063 -11.758  -2.966
  673   1HB   ALA 115          1HB       ALA 115  17.048 -12.813  -1.982
  674   2HB   ALA 115          2HB       ALA 115  17.260 -11.427  -0.876
  675   3HB   ALA 115          3HB       ALA 115  15.818 -12.471  -0.759
  676    H    PHE 116           H        PHE 116  13.287 -11.057  -1.907
  677    HA   PHE 116           HA       PHE 116  13.432  -8.372  -0.591
  678   1HB   PHE 116          1HB       PHE 116  11.094  -9.479  -2.200
  679   2HB   PHE 116          2HB       PHE 116  11.314  -7.867  -1.561
  680    HD1  PHE 116           HD1      PHE 116  12.553  -6.183  -2.769
  681    HD2  PHE 116           HD2      PHE 116  12.521 -10.283  -4.106
  682    HE1  PHE 116           HE1      PHE 116  13.992  -5.586  -4.735
  683    HE2  PHE 116           HE2      PHE 116  13.924  -9.691  -6.037
  684    HZ   PHE 116           HZ       PHE 116  14.693  -7.398  -6.328
  685    H    LYS 117           H        LYS 117  11.874  -7.917   1.021
  686    HA   LYS 117           HA       LYS 117  11.371  -9.976   2.885
  687   1HB   LYS 117          1HB       LYS 117  11.429  -7.504   3.307
  688   2HB   LYS 117          2HB       LYS 117   9.838  -7.343   2.559
  689   1HG   LYS 117          1HG       LYS 117   8.801  -8.673   4.304
  690   2HG   LYS 117          2HG       LYS 117  10.411  -9.130   4.922
  691   1HD   LYS 117          1HD       LYS 117  10.701  -6.526   5.280
  692   2HD   LYS 117          2HD       LYS 117   8.945  -6.481   5.084
  693   1HE   LYS 117          1HE       LYS 117   9.223  -6.776   7.412
  694   2HE   LYS 117          2HE       LYS 117   8.901  -8.422   6.815
  695   1HZ   LYS 117          1HZ       LYS 117  11.596  -7.342   7.304
  696   2HZ   LYS 117          2HZ       LYS 117  10.741  -8.327   8.358
  697   3HZ   LYS 117          3HZ       LYS 117  11.215  -8.899   6.899
  698    H    LYS 118           H        LYS 118   9.218  -8.525   0.392
  699    HA   LYS 118           HA       LYS 118   7.264 -10.759   0.859
  700   1HB   LYS 118          1HB       LYS 118   6.581  -7.771   0.647
  701   2HB   LYS 118          2HB       LYS 118   5.420  -9.077   0.822
  702   1HG   LYS 118          1HG       LYS 118   7.119  -9.669   2.864
  703   2HG   LYS 118          2HG       LYS 118   7.364  -7.933   2.803
  704   1HD   LYS 118          1HD       LYS 118   5.301  -7.570   3.815
  705   2HD   LYS 118          2HD       LYS 118   4.560  -8.952   2.999
  706   1HE   LYS 118          1HE       LYS 118   4.748  -9.748   5.294
  707   2HE   LYS 118          2HE       LYS 118   6.054 -10.470   4.368
  708   1HZ   LYS 118          1HZ       LYS 118   6.194  -8.586   6.514
  709   2HZ   LYS 118          2HZ       LYS 118   7.271  -9.750   6.056
  710   3HZ   LYS 118          3HZ       LYS 118   7.253  -8.304   5.284
  711    H    HIS 119           H        HIS 119   5.790 -11.181  -0.891
  712    HA   HIS 119           HA       HIS 119   7.153 -11.226  -3.391
  713   1HB   HIS 119          1HB       HIS 119   5.077 -12.173  -4.308
  714   2HB   HIS 119          2HB       HIS 119   5.625 -12.948  -2.855
  715    HD1  HIS 119           HD1      HIS 119   2.827 -10.231  -3.514
  716    HD2  HIS 119           HD2      HIS 119   3.806 -13.812  -1.491
  717    HE1  HIS 119           HE1      HIS 119   0.668 -11.018  -2.308
  718    HE2  HIS 119           HE2      HIS 119   1.288 -13.164  -1.099
  719    H    ASN 120           H        ASN 120   4.804  -8.914  -2.080
  720    HA   ASN 120           HA       ASN 120   4.107  -7.665  -4.572
  721   1HB   ASN 120          1HB       ASN 120   3.899  -6.964  -1.648
  722   2HB   ASN 120          2HB       ASN 120   3.892  -5.613  -2.783
  723   1HD2  ASN 120          1HD2      ASN 120   1.799  -7.914  -1.341
  724   2HD2  ASN 120          2HD2      ASN 120   0.538  -7.818  -2.564
  725    H    GLN 121           H        GLN 121   6.909  -7.285  -2.368
  726    HA   GLN 121           HA       GLN 121   8.009  -4.970  -3.806
  727   1HB   GLN 121          1HB       GLN 121   9.507  -6.902  -2.045
  728   2HB   GLN 121          2HB       GLN 121   9.917  -5.226  -2.506
  729   1HG   GLN 121          1HG       GLN 121   8.087  -4.405  -1.117
  730   2HG   GLN 121          2HG       GLN 121   7.777  -6.071  -0.555
  731   1HE2  GLN 121          1HE2      GLN 121   9.083  -3.368   0.667
  732   2HE2  GLN 121          2HE2      GLN 121  10.457  -4.053   1.516
  733    H    LEU 122           H        LEU 122   8.429  -8.548  -3.823
  734    HA   LEU 122           HA       LEU 122  10.531  -8.687  -5.712
  735   1HB   LEU 122          1HB       LEU 122   9.810 -10.623  -4.452
  736   2HB   LEU 122          2HB       LEU 122   8.193 -10.542  -5.116
  737    HG   LEU 122           HG       LEU 122   8.911 -11.264  -7.286
  738   1HD1  LEU 122          1HD1      LEU 122  11.185 -10.211  -7.265
  739   2HD1  LEU 122          2HD1      LEU 122  11.674 -11.429  -6.060
  740   3HD1  LEU 122          3HD1      LEU 122  11.156 -11.909  -7.704
  741   1HD2  LEU 122          1HD2      LEU 122  10.150 -13.040  -5.106
  742   2HD2  LEU 122          2HD2      LEU 122   8.433 -13.017  -5.564
  743   3HD2  LEU 122          3HD2      LEU 122   9.668 -13.535  -6.728
  744    H    LYS 123           H        LYS 123   6.950  -8.794  -6.282
  745    HA   LYS 123           HA       LYS 123   6.952  -8.671  -9.088
  746   1HB   LYS 123          1HB       LYS 123   5.053  -7.439  -7.044
  747   2HB   LYS 123          2HB       LYS 123   4.750  -7.390  -8.782
  748   1HG   LYS 123          1HG       LYS 123   4.721  -9.827  -8.921
  749   2HG   LYS 123          2HG       LYS 123   5.130  -9.971  -7.207
  750   1HD   LYS 123          1HD       LYS 123   3.021  -8.708  -6.639
  751   2HD   LYS 123          2HD       LYS 123   2.599  -8.712  -8.366
  752   1HE   LYS 123          1HE       LYS 123   2.686 -11.212  -8.350
  753   2HE   LYS 123          2HE       LYS 123   3.085 -11.179  -6.630
  754   1HZ   LYS 123          1HZ       LYS 123   0.543 -10.256  -7.852
  755   2HZ   LYS 123          2HZ       LYS 123   0.771 -11.552  -6.865
  756   3HZ   LYS 123          3HZ       LYS 123   0.915 -10.036  -6.269
  757    H    VAL 124           H        VAL 124   7.141  -5.946  -6.738
  758    HA   VAL 124           HA       VAL 124   7.152  -3.809  -8.597
  759    HB   VAL 124           HB       VAL 124   8.341  -4.183  -5.849
  760   1HG1  VAL 124          1HG1      VAL 124   8.562  -1.629  -7.474
  761   2HG1  VAL 124          2HG1      VAL 124   8.762  -1.747  -5.712
  762   3HG1  VAL 124          3HG1      VAL 124   9.902  -2.566  -6.773
  763   1HG2  VAL 124          1HG2      VAL 124   5.834  -3.855  -6.545
  764   2HG2  VAL 124          2HG2      VAL 124   6.504  -3.013  -5.171
  765   3HG2  VAL 124          3HG2      VAL 124   6.366  -2.169  -6.763
  766    H    HIS 125           H        HIS 125   9.890  -5.810  -7.385
  767    HA   HIS 125           HA       HIS 125  11.913  -4.328  -8.737
  768   1HB   HIS 125          1HB       HIS 125  12.437  -5.742  -6.882
  769   2HB   HIS 125          2HB       HIS 125  11.791  -7.176  -7.679
  770    HD1  HIS 125           HD1      HIS 125  14.790  -4.769  -8.014
  771    HD2  HIS 125           HD2      HIS 125  13.326  -8.516  -9.267
  772    HE1  HIS 125           HE1      HIS 125  16.733  -5.943  -9.160
  773    H    GLN 126           H        GLN 126  10.129  -7.339  -9.646
  774    HA   GLN 126           HA       GLN 126  11.600  -7.815 -12.048
  775   1HB   GLN 126          1HB       GLN 126   8.828  -8.709 -11.138
  776   2HB   GLN 126          2HB       GLN 126   9.576  -9.205 -12.689
  777   1HG   GLN 126          1HG       GLN 126  11.640  -9.884 -11.405
  778   2HG   GLN 126          2HG       GLN 126  10.811  -9.567  -9.889
  779   1HE2  GLN 126          1HE2      GLN 126  12.050 -11.925 -10.469
  780   2HE2  GLN 126          2HE2      GLN 126  10.816 -13.205 -10.627
  781    H    PHE 127           H        PHE 127   8.770  -5.772 -11.382
  782    HA   PHE 127           HA       PHE 127   7.937  -5.224 -14.026
  783   1HB   PHE 127          1HB       PHE 127   6.552  -3.961 -12.974
  784   2HB   PHE 127          2HB       PHE 127   7.334  -4.319 -11.491
  785    HD1  PHE 127           HD1      PHE 127   7.301  -2.575 -10.138
  786    HD2  PHE 127           HD2      PHE 127   7.991  -1.718 -14.286
  787    HE1  PHE 127           HE1      PHE 127   7.782  -0.331  -9.496
  788    HE2  PHE 127           HE2      PHE 127   8.388   0.627 -13.738
  789    HZ   PHE 127           HZ       PHE 127   8.429   1.373 -11.326
  790    H    SER 128           H        SER 128  10.837  -4.177 -12.289
  791    HA   SER 128           HA       SER 128  11.566  -2.021 -14.101
  792   1HB   SER 128          1HB       SER 128  12.433  -2.386 -11.752
  793   2HB   SER 128          2HB       SER 128  13.435  -3.714 -12.388
  794    HG   SER 128           HG       SER 128  14.547  -1.682 -12.337
  795    H    HIS 129           H        HIS 129  12.503  -5.526 -13.863
  796    HA   HIS 129           HA       HIS 129  14.284  -5.510 -16.129
  797   1HB   HIS 129          1HB       HIS 129  12.622  -7.767 -14.930
  798   2HB   HIS 129          2HB       HIS 129  13.844  -7.945 -16.164
  799    HD1  HIS 129           HD1      HIS 129  16.474  -7.440 -15.337
  800    HD2  HIS 129           HD2      HIS 129  13.434  -8.491 -12.664
  801    HE1  HIS 129           HE1      HIS 129  17.606  -8.509 -13.298
  802    H    THR 130           H        THR 130  10.769  -6.052 -15.796
  803    HA   THR 130           HA       THR 130  10.415  -6.772 -18.620
  804    HB   THR 130           HB       THR 130   7.996  -6.680 -18.067
  805    HG1  THR 130           HG1      THR 130   8.943  -5.630 -15.663
  806   1HG2  THR 130          1HG2      THR 130   9.343  -8.056 -15.678
  807   2HG2  THR 130          2HG2      THR 130   7.855  -8.488 -16.518
  808   3HG2  THR 130          3HG2      THR 130   9.429  -8.736 -17.318
  809    H    GLN 131           H        GLN 131  10.553  -3.841 -16.778
  810    HA   GLN 131           HA       GLN 131  10.172  -1.639 -17.228
  811   1HB   GLN 131          1HB       GLN 131  11.570  -2.484 -19.379
  812   2HB   GLN 131          2HB       GLN 131  10.073  -2.061 -20.210
  813   1HG   GLN 131          1HG       GLN 131  10.971   0.044 -20.202
  814   2HG   GLN 131          2HG       GLN 131  10.343   0.140 -18.556
  815   1HE2  GLN 131          1HE2      GLN 131  12.280  -1.315 -17.000
  816   2HE2  GLN 131          2HE2      GLN 131  13.807  -0.508 -17.241
  817    H    GLN 132           H        GLN 132   7.846  -3.458 -16.907
  818    HA   GLN 132           HA       GLN 132   5.847  -1.501 -17.983
  819   1HB   GLN 132          1HB       GLN 132   4.184  -3.247 -18.249
  820   2HB   GLN 132          2HB       GLN 132   5.557  -3.464 -19.321
  821   1HG   GLN 132          1HG       GLN 132   4.857  -5.619 -18.649
  822   2HG   GLN 132          2HG       GLN 132   6.380  -5.279 -17.852
  823   1HE2  GLN 132          1HE2      GLN 132   6.443  -5.657 -15.690
  824   2HE2  GLN 132          2HE2      GLN 132   5.024  -5.784 -14.632
  825    H    LEU 133           H        LEU 133   3.920  -1.301 -16.606
  826    HA   LEU 133           HA       LEU 133   4.838  -1.377 -13.810
  827   1HB   LEU 133          1HB       LEU 133   2.747   0.211 -15.307
  828   2HB   LEU 133          2HB       LEU 133   2.795   0.262 -13.538
  829    HG   LEU 133           HG       LEU 133   5.330   0.766 -15.232
  830   1HD1  LEU 133          1HD1      LEU 133   3.364   2.832 -14.159
  831   2HD1  LEU 133          2HD1      LEU 133   4.916   3.159 -14.958
  832   3HD1  LEU 133          3HD1      LEU 133   3.593   2.420 -15.876
  833   1HD2  LEU 133          1HD2      LEU 133   6.189   1.823 -13.298
  834   2HD2  LEU 133          2HD2      LEU 133   4.654   1.651 -12.441
  835   3HD2  LEU 133          3HD2      LEU 133   5.631   0.214 -12.826
  836    HA   PRO 134           HA       PRO 134   2.177  -4.754 -12.947
  837   1HB   PRO 134          1HB       PRO 134   2.489  -4.648 -10.137
  838   2HB   PRO 134          2HB       PRO 134   3.559  -5.492 -11.294
  839   1HG   PRO 134          1HG       PRO 134   4.059  -3.048  -9.741
  840   2HG   PRO 134          2HG       PRO 134   5.196  -4.051 -10.654
  841   1HD   PRO 134          1HD       PRO 134   4.094  -1.501 -11.388
  842   2HD   PRO 134          2HD       PRO 134   5.153  -2.565 -12.314
  843    H    TYR 135           H        TYR 135   1.693  -1.780 -11.017
  844    HA   TYR 135           HA       TYR 135  -0.942  -2.757 -10.093
  845   1HB   TYR 135          1HB       TYR 135   0.636  -0.258  -9.302
  846   2HB   TYR 135          2HB       TYR 135  -0.804  -0.861  -8.517
  847    HD1  TYR 135           HD1      TYR 135  -0.814  -3.065  -7.370
  848    HD2  TYR 135           HD2      TYR 135   2.822  -1.196  -8.759
  849    HE1  TYR 135           HE1      TYR 135   0.555  -4.696  -6.031
  850    HE2  TYR 135           HE2      TYR 135   4.176  -2.729  -7.318
  851    HH   TYR 135           HH       TYR 135   2.621  -5.390  -5.462
  852    H    GLU 136           H        GLU 136  -2.383  -2.497 -11.781
  853    HA   GLU 136           HA       GLU 136  -2.473   0.173 -13.110
  854   1HB   GLU 136          1HB       GLU 136  -3.818  -0.897 -14.815
  855   2HB   GLU 136          2HB       GLU 136  -2.292  -1.750 -14.586
  856   1HG   GLU 136          1HG       GLU 136  -3.520  -3.499 -13.266
  857   2HG   GLU 136          2HG       GLU 136  -5.038  -2.679 -13.671
  858    H    CYS 137           H        CYS 137  -4.293   1.445 -13.057
  859    HA   CYS 137           HA       CYS 137  -6.145   1.065 -10.853
  860   1HB   CYS 137          1HB       CYS 137  -5.405   3.276 -11.411
  861   2HB   CYS 137          2HB       CYS 137  -5.915   3.117 -13.075
  862    HA   PRO 138           HA       PRO 138  -8.875  -1.295 -13.490
  863   1HB   PRO 138          1HB       PRO 138 -10.302  -2.586 -11.585
  864   2HB   PRO 138          2HB       PRO 138  -8.531  -2.810 -11.700
  865   1HG   PRO 138          1HG       PRO 138 -10.043  -0.897  -9.868
  866   2HG   PRO 138          2HG       PRO 138  -8.789  -2.092  -9.414
  867   1HD   PRO 138          1HD       PRO 138  -8.233   0.573  -9.914
  868   2HD   PRO 138          2HD       PRO 138  -7.076  -0.750 -10.228
  869    H    HIS 139           H        HIS 139  -9.697   1.594 -12.084
  870    HA   HIS 139           HA       HIS 139 -12.580   1.360 -11.816
  871   1HB   HIS 139          1HB       HIS 139 -10.659   3.717 -11.971
  872   2HB   HIS 139          2HB       HIS 139 -12.401   3.934 -11.873
  873    HD2  HIS 139           HD2      HIS 139  -9.553   2.332  -9.754
  874    HE1  HIS 139           HE1      HIS 139 -12.876   2.891  -7.153
  875    HE2  HIS 139           HE2      HIS 139 -10.459   2.077  -7.297
  876    H    GLU 140           H        GLU 140 -14.219   2.191 -13.161
  877    HA   GLU 140           HA       GLU 140 -13.874   1.719 -15.958
  878   1HB   GLU 140          1HB       GLU 140 -16.020   1.511 -14.695
  879   2HB   GLU 140          2HB       GLU 140 -16.093   3.269 -14.537
  880   1HG   GLU 140          1HG       GLU 140 -16.214   3.493 -17.005
  881   2HG   GLU 140          2HG       GLU 140 -16.033   1.747 -17.184
  882    H    GLY 141           H        GLY 141 -13.187   2.988 -17.594
  883   1HA   GLY 141          1HA       GLY 141 -12.960   4.973 -18.842
  884   2HA   GLY 141          2HA       GLY 141 -13.498   5.917 -17.442
  885    H    CYS 142           H        CYS 142 -11.135   3.820 -16.307
  886    HA   CYS 142           HA       CYS 142  -8.953   5.811 -16.779
  887   1HB   CYS 142          1HB       CYS 142 -10.059   5.581 -14.448
  888   2HB   CYS 142          2HB       CYS 142  -9.240   4.036 -14.326
  889    H    ASP 143           H        ASP 143  -6.797   4.994 -16.914
  890    HA   ASP 143           HA       ASP 143  -6.398   2.064 -17.126
  891   1HB   ASP 143          1HB       ASP 143  -7.149   2.980 -19.406
  892   2HB   ASP 143          2HB       ASP 143  -5.651   3.905 -19.441
  893    H    LYS 144           H        LYS 144  -5.465   4.604 -15.548
  894    HA   LYS 144           HA       LYS 144  -2.650   4.986 -16.142
  895   1HB   LYS 144          1HB       LYS 144  -4.239   5.435 -13.573
  896   2HB   LYS 144          2HB       LYS 144  -2.594   5.998 -13.848
  897   1HG   LYS 144          1HG       LYS 144  -4.337   6.891 -16.032
  898   2HG   LYS 144          2HG       LYS 144  -5.038   7.333 -14.478
  899   1HD   LYS 144          1HD       LYS 144  -2.130   7.933 -15.054
  900   2HD   LYS 144          2HD       LYS 144  -3.398   8.971 -15.703
  901   1HE   LYS 144          1HE       LYS 144  -3.385   8.257 -12.759
  902   2HE   LYS 144          2HE       LYS 144  -2.329   9.527 -13.371
  903   1HZ   LYS 144          1HZ       LYS 144  -4.430  10.424 -12.636
  904   2HZ   LYS 144          2HZ       LYS 144  -4.285  10.696 -14.246
  905   3HZ   LYS 144          3HZ       LYS 144  -5.276   9.503 -13.715
  906    H    ARG 145           H        ARG 145  -0.812   4.158 -15.039
  907    HA   ARG 145           HA       ARG 145  -1.261   1.778 -13.273
  908   1HB   ARG 145          1HB       ARG 145   0.826   1.778 -15.503
  909   2HB   ARG 145          2HB       ARG 145   0.318   0.462 -14.397
  910   1HG   ARG 145          1HG       ARG 145  -1.976   0.601 -15.411
  911   2HG   ARG 145          2HG       ARG 145  -1.312   1.658 -16.658
  912   1HD   ARG 145          1HD       ARG 145   0.056  -0.101 -17.553
  913   2HD   ARG 145          2HD       ARG 145  -0.164  -1.101 -16.110
  914    HE   ARG 145           HE       ARG 145  -2.186  -1.885 -16.910
  915   1HH1  ARG 145          1HH1      ARG 145  -1.519   0.966 -18.870
  916   2HH1  ARG 145          2HH1      ARG 145  -3.122   0.910 -19.571
  917   1HH2  ARG 145          1HH2      ARG 145  -4.045  -1.897 -17.804
  918   2HH2  ARG 145          2HH2      ARG 145  -4.556  -0.617 -18.924
  919    H    PHE 146           H        PHE 146   0.386   1.322 -11.822
  920    HA   PHE 146           HA       PHE 146   2.279   3.589 -11.355
  921   1HB   PHE 146          1HB       PHE 146   0.552   2.218  -9.235
  922   2HB   PHE 146          2HB       PHE 146   1.592   3.608  -9.028
  923    HD1  PHE 146           HD1      PHE 146   1.033   5.817 -10.096
  924    HD2  PHE 146           HD2      PHE 146  -1.638   2.439 -10.319
  925    HE1  PHE 146           HE1      PHE 146  -0.800   7.299 -10.896
  926    HE2  PHE 146           HE2      PHE 146  -3.470   3.917 -10.962
  927    HZ   PHE 146           HZ       PHE 146  -3.039   6.347 -11.366
  928    H    SER 147           H        SER 147   3.921   3.115  -9.695
  929    HA   SER 147           HA       SER 147   5.151   0.548 -10.404
  930   1HB   SER 147          1HB       SER 147   7.113   1.610  -9.111
  931   2HB   SER 147          2HB       SER 147   6.537   2.504 -10.537
  932    HG   SER 147           HG       SER 147   6.851   3.858  -8.704
  933    H    LEU 148           H        LEU 148   3.441   1.889  -7.652
  934    HA   LEU 148           HA       LEU 148   4.088  -0.577  -6.108
  935   1HB   LEU 148          1HB       LEU 148   4.464   2.297  -5.255
  936   2HB   LEU 148          2HB       LEU 148   3.987   1.124  -4.041
  937    HG   LEU 148           HG       LEU 148   6.452   0.778  -5.797
  938   1HD1  LEU 148          1HD1      LEU 148   7.737   1.400  -3.786
  939   2HD1  LEU 148          2HD1      LEU 148   6.718   2.743  -4.351
  940   3HD1  LEU 148          3HD1      LEU 148   6.228   1.787  -2.934
  941   1HD2  LEU 148          1HD2      LEU 148   5.668  -0.602  -3.182
  942   2HD2  LEU 148          2HD2      LEU 148   5.437  -1.302  -4.798
  943   3HD2  LEU 148          3HD2      LEU 148   7.076  -0.967  -4.188
  944    HA   PRO 149           HA       PRO 149  -0.235  -0.794  -5.414
  945   1HB   PRO 149          1HB       PRO 149  -0.351  -1.930  -2.865
  946   2HB   PRO 149          2HB       PRO 149   0.022  -2.805  -4.362
  947   1HG   PRO 149          1HG       PRO 149   1.914  -1.835  -2.244
  948   2HG   PRO 149          2HG       PRO 149   1.968  -3.339  -3.235
  949   1HD   PRO 149          1HD       PRO 149   3.518  -1.125  -3.774
  950   2HD   PRO 149          2HD       PRO 149   2.990  -2.255  -4.977
  951    H    SER 150           H        SER 150   1.693   0.662  -2.784
  952    HA   SER 150           HA       SER 150  -0.437   2.045  -1.452
  953   1HB   SER 150          1HB       SER 150   1.463   3.568  -0.689
  954   2HB   SER 150          2HB       SER 150   1.669   1.843  -0.340
  955    HG   SER 150           HG       SER 150   3.290   3.428  -1.698
  956    H    ARG 151           H        ARG 151   1.589   2.853  -4.285
  957    HA   ARG 151           HA       ARG 151   0.695   5.605  -4.506
  958   1HB   ARG 151          1HB       ARG 151   2.642   3.961  -5.734
  959   2HB   ARG 151          2HB       ARG 151   1.555   4.373  -7.039
  960   1HG   ARG 151          1HG       ARG 151   2.674   6.511  -5.181
  961   2HG   ARG 151          2HG       ARG 151   3.622   5.857  -6.506
  962   1HD   ARG 151          1HD       ARG 151   2.618   7.934  -7.194
  963   2HD   ARG 151          2HD       ARG 151   1.986   6.593  -8.154
  964    HE   ARG 151           HE       ARG 151   0.211   7.042  -5.976
  965   1HH1  ARG 151          1HH1      ARG 151   1.029   8.683  -9.007
  966   2HH1  ARG 151          2HH1      ARG 151  -0.652   9.206  -9.162
  967   1HH2  ARG 151          1HH2      ARG 151  -1.798   7.823  -6.361
  968   2HH2  ARG 151          2HH2      ARG 151  -2.061   8.822  -7.790
  969    H    LEU 152           H        LEU 152  -0.309   2.495  -6.017
  970    HA   LEU 152           HA       LEU 152  -2.377   3.598  -7.709
  971   1HB   LEU 152          1HB       LEU 152  -1.532   1.365  -8.089
  972   2HB   LEU 152          2HB       LEU 152  -1.913   0.878  -6.431
  973    HG   LEU 152           HG       LEU 152  -4.297   0.945  -6.870
  974   1HD1  LEU 152          1HD1      LEU 152  -3.655   1.656  -9.757
  975   2HD1  LEU 152          2HD1      LEU 152  -5.253   1.391  -9.015
  976   3HD1  LEU 152          3HD1      LEU 152  -4.323   2.816  -8.595
  977   1HD2  LEU 152          1HD2      LEU 152  -2.933  -1.110  -7.454
  978   2HD2  LEU 152          2HD2      LEU 152  -4.461  -0.943  -8.354
  979   3HD2  LEU 152          3HD2      LEU 152  -2.926  -0.540  -9.133
  980    H    LYS 153           H        LYS 153  -2.411   2.168  -4.376
  981    HA   LYS 153           HA       LYS 153  -5.195   2.426  -3.894
  982   1HB   LYS 153          1HB       LYS 153  -2.756   2.370  -2.092
  983   2HB   LYS 153          2HB       LYS 153  -4.348   2.642  -1.393
  984   1HG   LYS 153          1HG       LYS 153  -3.832   0.295  -3.253
  985   2HG   LYS 153          2HG       LYS 153  -3.505   0.200  -1.520
  986   1HD   LYS 153          1HD       LYS 153  -5.775   0.563  -0.923
  987   2HD   LYS 153          2HD       LYS 153  -6.246   1.071  -2.542
  988   1HE   LYS 153          1HE       LYS 153  -5.281  -1.739  -1.860
  989   2HE   LYS 153          2HE       LYS 153  -6.978  -1.242  -1.885
  990   1HZ   LYS 153          1HZ       LYS 153  -6.443  -2.188  -4.003
  991   2HZ   LYS 153          2HZ       LYS 153  -6.665  -0.580  -4.238
  992   3HZ   LYS 153          3HZ       LYS 153  -5.154  -1.209  -4.219
  993    H    ARG 154           H        ARG 154  -2.561   4.824  -3.513
  994    HA   ARG 154           HA       ARG 154  -4.292   6.881  -2.395
  995   1HB   ARG 154          1HB       ARG 154  -1.834   6.845  -2.105
  996   2HB   ARG 154          2HB       ARG 154  -1.603   7.152  -3.835
  997   1HG   ARG 154          1HG       ARG 154  -2.542   9.318  -3.674
  998   2HG   ARG 154          2HG       ARG 154  -3.292   9.009  -2.105
  999   1HD   ARG 154          1HD       ARG 154  -1.327  10.524  -1.872
 1000   2HD   ARG 154          2HD       ARG 154  -1.184   9.061  -0.960
 1001    HE   ARG 154           HE       ARG 154   0.506   8.243  -2.391
 1002   1HH1  ARG 154          1HH1      ARG 154  -0.627  11.269  -3.751
 1003   2HH1  ARG 154          2HH1      ARG 154   1.034  11.826  -3.910
 1004   1HH2  ARG 154          1HH2      ARG 154   2.522   8.877  -3.177
 1005   2HH2  ARG 154          2HH2      ARG 154   2.641  10.401  -4.014
 1006    H    HIS 155           H        HIS 155  -3.359   5.882  -5.703
 1007    HA   HIS 155           HA       HIS 155  -4.493   8.153  -7.086
 1008   1HB   HIS 155          1HB       HIS 155  -2.962   6.623  -8.264
 1009   2HB   HIS 155          2HB       HIS 155  -4.055   5.271  -8.015
 1010    HD1  HIS 155           HD1      HIS 155  -4.146   8.692  -9.789
 1011    HD2  HIS 155           HD2      HIS 155  -6.013   4.922  -9.681
 1012    HE1  HIS 155           HE1      HIS 155  -5.970   8.766 -11.565
 1013    H    GLU 156           H        GLU 156  -5.850   5.006  -5.996
 1014    HA   GLU 156           HA       GLU 156  -8.361   5.176  -7.259
 1015   1HB   GLU 156          1HB       GLU 156  -7.544   3.927  -4.588
 1016   2HB   GLU 156          2HB       GLU 156  -9.167   3.808  -5.260
 1017   1HG   GLU 156          1HG       GLU 156  -8.099   2.889  -7.402
 1018   2HG   GLU 156          2HG       GLU 156  -6.616   2.701  -6.474
 1019    H    LYS 157           H        LYS 157  -7.159   6.901  -4.393
 1020    HA   LYS 157           HA       LYS 157  -9.676   7.754  -3.291
 1021   1HB   LYS 157          1HB       LYS 157  -7.047   9.291  -3.267
 1022   2HB   LYS 157          2HB       LYS 157  -8.389   9.473  -2.162
 1023   1HG   LYS 157          1HG       LYS 157  -6.549   7.072  -2.366
 1024   2HG   LYS 157          2HG       LYS 157  -6.581   8.275  -1.083
 1025   1HD   LYS 157          1HD       LYS 157  -8.860   7.522  -0.432
 1026   2HD   LYS 157          2HD       LYS 157  -8.818   6.294  -1.720
 1027   1HE   LYS 157          1HE       LYS 157  -6.809   5.273  -0.711
 1028   2HE   LYS 157          2HE       LYS 157  -6.824   6.488   0.576
 1029   1HZ   LYS 157          1HZ       LYS 157  -9.001   5.630   1.269
 1030   2HZ   LYS 157          2HZ       LYS 157  -8.985   4.504   0.084
 1031   3HZ   LYS 157          3HZ       LYS 157  -7.894   4.433   1.297
 1032    H    VAL 158           H        VAL 158  -7.813   8.806  -6.120
 1033    HA   VAL 158           HA       VAL 158  -9.009  11.375  -6.506
 1034    HB   VAL 158           HB       VAL 158  -8.066   9.395  -8.642
 1035   1HG1  VAL 158          1HG1      VAL 158  -7.667  11.378 -10.016
 1036   2HG1  VAL 158          2HG1      VAL 158  -9.383  11.273  -9.591
 1037   3HG1  VAL 158          3HG1      VAL 158  -8.312  12.414  -8.720
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.653  11.783  -7.439
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.215  10.106  -7.006
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.977  10.695  -8.676
 1041    H    HIS 159           H        HIS 159 -10.014   8.085  -7.521
 1042    HA   HIS 159           HA       HIS 159 -12.401   9.010  -8.916
 1043   1HB   HIS 159          1HB       HIS 159 -11.482   6.255  -7.971
 1044   2HB   HIS 159          2HB       HIS 159 -12.965   6.542  -8.895
 1045    HD1  HIS 159           HD1      HIS 159 -12.266   8.218 -11.273
 1046    HD2  HIS 159           HD2      HIS 159  -9.463   5.647  -9.473
 1047    HE1  HIS 159           HE1      HIS 159 -10.382   7.889 -12.968
 1048    H    ALA 160           H        ALA 160 -11.611   7.999  -5.605
 1049    HA   ALA 160           HA       ALA 160 -14.349   7.677  -4.710
 1050   1HB   ALA 160          1HB       ALA 160 -11.868   8.370  -3.074
 1051   2HB   ALA 160          2HB       ALA 160 -13.381   7.679  -2.472
 1052   3HB   ALA 160          3HB       ALA 160 -12.339   6.717  -3.538
 1053    H    GLY 161           H        GLY 161 -12.209  10.438  -5.229
 1054   1HA   GLY 161          1HA       GLY 161 -12.938  12.664  -5.463
 1055   2HA   GLY 161          2HA       GLY 161 -14.459  12.256  -4.673
 1056    H    TYR 162           H        TYR 162 -13.329  14.589  -3.983
 1057    HA   TYR 162           HA       TYR 162 -12.163  14.050  -1.273
 1058   1HB   TYR 162          1HB       TYR 162 -11.590  16.411  -3.113
 1059   2HB   TYR 162          2HB       TYR 162 -10.909  16.167  -1.498
 1060    HD1  TYR 162           HD1      TYR 162  -8.941  14.686  -1.236
 1061    HD2  TYR 162           HD2      TYR 162 -11.095  14.846  -4.970
 1062    HE1  TYR 162           HE1      TYR 162  -7.213  13.242  -2.321
 1063    HE2  TYR 162           HE2      TYR 162  -9.551  13.215  -5.946
 1064    HH   TYR 162           HH       TYR 162  -6.494  12.307  -4.356
 1065    HA   PRO 163           HA       PRO 163 -16.150  16.110  -0.808
 1066   1HB   PRO 163          1HB       PRO 163 -17.000  14.879   1.481
 1067   2HB   PRO 163          2HB       PRO 163 -16.919  14.018  -0.085
 1068   1HG   PRO 163          1HG       PRO 163 -14.877  13.976   2.157
 1069   2HG   PRO 163          2HG       PRO 163 -15.583  12.587   1.274
 1070   1HD   PRO 163          1HD       PRO 163 -13.166  13.702   0.609
 1071   2HD   PRO 163          2HD       PRO 163 -14.266  12.996  -0.620
 1072    H    CYS 164           H        CYS 164 -16.893  17.863   0.354
 1073    HA   CYS 164           HA       CYS 164 -14.978  19.252   2.038
 1074   1HB   CYS 164          1HB       CYS 164 -16.782  20.198   0.374
 1075   2HB   CYS 164          2HB       CYS 164 -17.883  20.042   1.763
 1076    H    LYS 165           H        LYS 165 -14.978  19.607   4.186
 1077    HA   LYS 165           HA       LYS 165 -17.276  18.732   5.830
 1078   1HB   LYS 165          1HB       LYS 165 -15.369  16.894   5.635
 1079   2HB   LYS 165          2HB       LYS 165 -14.479  17.945   6.718
 1080   1HG   LYS 165          1HG       LYS 165 -15.541  16.225   7.997
 1081   2HG   LYS 165          2HG       LYS 165 -16.378  17.724   8.388
 1082   1HD   LYS 165          1HD       LYS 165 -18.245  17.088   6.874
 1083   2HD   LYS 165          2HD       LYS 165 -17.363  15.620   6.403
 1084   1HE   LYS 165          1HE       LYS 165 -17.404  14.859   8.774
 1085   2HE   LYS 165          2HE       LYS 165 -18.286  16.323   9.229
 1086   1HZ   LYS 165          1HZ       LYS 165 -19.285  14.246   7.348
 1087   2HZ   LYS 165          2HZ       LYS 165 -19.791  14.443   8.886
 1088   3HZ   LYS 165          3HZ       LYS 165 -20.103  15.593   7.774
 1089    H    LYS 166           H        LYS 166 -15.546  21.195   4.850
 1090    HA   LYS 166           HA       LYS 166 -14.459  22.405   7.261
 1091   1HB   LYS 166          1HB       LYS 166 -15.450  23.568   4.648
 1092   2HB   LYS 166          2HB       LYS 166 -14.651  24.532   5.885
 1093   1HG   LYS 166          1HG       LYS 166 -13.341  22.123   4.556
 1094   2HG   LYS 166          2HG       LYS 166 -13.237  23.770   3.927
 1095   1HD   LYS 166          1HD       LYS 166 -12.110  24.577   5.872
 1096   2HD   LYS 166          2HD       LYS 166 -12.328  23.028   6.728
 1097   1HE   LYS 166          1HE       LYS 166 -10.964  21.883   5.007
 1098   2HE   LYS 166          2HE       LYS 166 -10.740  23.413   4.156
 1099   1HZ   LYS 166          1HZ       LYS 166  -8.851  22.897   5.593
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.579  24.261   6.131
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.800  22.843   6.919
 1102    H    ASP 167           H        ASP 167 -17.699  22.055   5.957
 1103    HA   ASP 167           HA       ASP 167 -18.779  23.371   8.380
 1104   1HB   ASP 167          1HB       ASP 167 -18.619  25.132   6.539
 1105   2HB   ASP 167          2HB       ASP 167 -19.768  24.171   5.607
 1106    H    ASP 168           H        ASP 168 -20.728  22.487   9.054
 1107    HA   ASP 168           HA       ASP 168 -21.280  19.847   8.121
 1108   1HB   ASP 168          1HB       ASP 168 -23.012  19.800   9.796
 1109   2HB   ASP 168          2HB       ASP 168 -21.604  20.604  10.453
 1110    H    SER 169           H        SER 169 -22.601  22.967   7.140
 1111    HA   SER 169           HA       SER 169 -24.904  21.666   5.758
 1112   1HB   SER 169          1HB       SER 169 -24.127  24.601   6.076
 1113   2HB   SER 169          2HB       SER 169 -25.575  24.013   5.248
 1114    HG   SER 169           HG       SER 169 -25.975  24.614   7.435
 1115    H    CYS 170           H        CYS 170 -21.905  21.473   4.973
 1116    HA   CYS 170           HA       CYS 170 -22.129  22.514   2.177
 1117   1HB   CYS 170          1HB       CYS 170 -20.029  22.865   3.801
 1118   2HB   CYS 170          2HB       CYS 170 -19.623  21.239   3.289
 1119    H    SER 171           H        SER 171 -21.430  20.967   0.446
 1120    HA   SER 171           HA       SER 171 -21.640  18.087   1.086
 1121   1HB   SER 171          1HB       SER 171 -24.011  19.063   0.895
 1122   2HB   SER 171          2HB       SER 171 -23.666  19.331  -0.816
 1123    HG   SER 171           HG       SER 171 -23.233  17.053  -0.965
 1124    H    PHE 172           H        PHE 172 -20.056  20.428  -0.526
 1125    HA   PHE 172           HA       PHE 172 -19.943  19.525  -3.244
 1126   1HB   PHE 172          1HB       PHE 172 -19.152  21.726  -2.732
 1127   2HB   PHE 172          2HB       PHE 172 -18.085  21.132  -1.467
 1128    HD1  PHE 172           HD1      PHE 172 -15.957  20.021  -1.964
 1129    HD2  PHE 172           HD2      PHE 172 -18.480  21.467  -5.136
 1130    HE1  PHE 172           HE1      PHE 172 -14.124  19.656  -3.583
 1131    HE2  PHE 172           HE2      PHE 172 -16.567  21.294  -6.729
 1132    HZ   PHE 172           HZ       PHE 172 -14.374  20.421  -5.942
 1133    H    VAL 173           H        VAL 173 -18.704  18.012  -4.274
 1134    HA   VAL 173           HA       VAL 173 -16.495  16.717  -2.739
 1135    HB   VAL 173           HB       VAL 173 -18.406  15.280  -4.619
 1136   1HG1  VAL 173          1HG1      VAL 173 -16.070  14.323  -4.674
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.084  14.228  -2.903
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.188  13.227  -3.863
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.586  15.620  -2.561
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.975  13.966  -2.493
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.157  15.266  -1.585
 1142    H    GLY 174           H        GLY 174 -14.598  17.001  -3.723
 1143   1HA   GLY 174          1HA       GLY 174 -14.582  18.019  -6.505
 1144   2HA   GLY 174          2HA       GLY 174 -13.198  17.913  -5.403
 1145    H    LYS 175           H        LYS 175 -13.898  16.972  -8.320
 1146    HA   LYS 175           HA       LYS 175 -13.533  14.128  -8.333
 1147   1HB   LYS 175          1HB       LYS 175 -14.321  15.630 -10.239
 1148   2HB   LYS 175          2HB       LYS 175 -12.632  16.085 -10.494
 1149   1HG   LYS 175          1HG       LYS 175 -12.054  13.737 -10.988
 1150   2HG   LYS 175          2HG       LYS 175 -13.717  13.235 -10.617
 1151   1HD   LYS 175          1HD       LYS 175 -14.547  14.623 -12.497
 1152   2HD   LYS 175          2HD       LYS 175 -12.883  15.145 -12.852
 1153   1HE   LYS 175          1HE       LYS 175 -12.235  12.776 -13.255
 1154   2HE   LYS 175          2HE       LYS 175 -13.890  12.261 -12.906
 1155   1HZ   LYS 175          1HZ       LYS 175 -14.630  13.582 -14.822
 1156   2HZ   LYS 175          2HZ       LYS 175 -13.095  14.048 -15.146
 1157   3HZ   LYS 175          3HZ       LYS 175 -13.521  12.480 -15.294
 1158    H    THR 176           H        THR 176 -11.309  16.736  -7.700
 1159    HA   THR 176           HA       THR 176  -9.138  14.775  -7.299
 1160    HB   THR 176           HB       THR 176  -7.606  16.723  -8.394
 1161    HG1  THR 176           HG1      THR 176  -8.819  17.967  -9.512
 1162   1HG2  THR 176          1HG2      THR 176  -8.836  14.404  -9.911
 1163   2HG2  THR 176          2HG2      THR 176  -7.395  15.297 -10.385
 1164   3HG2  THR 176          3HG2      THR 176  -7.380  14.347  -8.883
 1165    H    TRP 177           H        TRP 177  -7.341  15.672  -6.049
 1166    HA   TRP 177           HA       TRP 177  -8.279  16.975  -3.760
 1167   1HB   TRP 177          1HB       TRP 177  -6.310  15.618  -3.698
 1168   2HB   TRP 177          2HB       TRP 177  -5.501  16.603  -4.897
 1169    HD1  TRP 177           HD1      TRP 177  -3.605  17.665  -3.896
 1170    HE1  TRP 177           HE1      TRP 177  -2.992  19.005  -1.772
 1171    HE3  TRP 177           HE3      TRP 177  -7.913  16.933  -1.285
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.946  18.970   0.923
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.952  17.447   1.145
 1174    HH2  TRP 177           HH2      TRP 177  -5.960  18.380   2.269
 1175    H    THR 178           H        THR 178  -6.575  18.405  -6.601
 1176    HA   THR 178           HA       THR 178  -6.226  21.035  -5.613
 1177    HB   THR 178           HB       THR 178  -6.583  21.690  -8.090
 1178    HG1  THR 178           HG1      THR 178  -6.157  19.103  -8.857
 1179   1HG2  THR 178          1HG2      THR 178  -4.395  19.689  -7.498
 1180   2HG2  THR 178          2HG2      THR 178  -4.452  20.838  -8.846
 1181   3HG2  THR 178          3HG2      THR 178  -4.351  21.433  -7.181
 1182    H    LEU 179           H        LEU 179  -9.047  19.650  -7.391
 1183    HA   LEU 179           HA       LEU 179 -10.558  22.022  -7.510
 1184   1HB   LEU 179          1HB       LEU 179 -11.543  19.138  -7.320
 1185   2HB   LEU 179          2HB       LEU 179 -12.527  20.518  -7.794
 1186    HG   LEU 179           HG       LEU 179 -10.128  19.426  -9.296
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.163  18.069  -9.451
 1188   2HD1  LEU 179          2HD1      LEU 179 -13.096  19.489  -9.977
 1189   3HD1  LEU 179          3HD1      LEU 179 -11.796  18.832 -11.000
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.183  21.836  -9.680
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.802  21.017 -11.109
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.940  21.783  -9.981
 1193    H    TYR 180           H        TYR 180 -10.287  19.642  -4.868
 1194    HA   TYR 180           HA       TYR 180 -12.441  20.765  -3.274
 1195   1HB   TYR 180          1HB       TYR 180 -11.872  18.567  -2.750
 1196   2HB   TYR 180          2HB       TYR 180 -10.138  18.874  -2.749
 1197    HD1  TYR 180           HD1      TYR 180  -9.020  19.222  -0.721
 1198    HD2  TYR 180           HD2      TYR 180 -13.268  19.923  -0.912
 1199    HE1  TYR 180           HE1      TYR 180  -9.063  19.623   1.741
 1200    HE2  TYR 180           HE2      TYR 180 -13.272  20.464   1.514
 1201    HH   TYR 180           HH       TYR 180 -12.102  20.395   3.467
 1202    H    LEU 181           H        LEU 181  -8.847  21.020  -3.160
 1203    HA   LEU 181           HA       LEU 181  -8.695  22.928  -1.093
 1204   1HB   LEU 181          1HB       LEU 181  -6.952  22.402  -3.530
 1205   2HB   LEU 181          2HB       LEU 181  -6.560  23.641  -2.371
 1206    HG   LEU 181           HG       LEU 181  -6.863  20.643  -1.782
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.471  22.470  -2.166
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.363  20.962  -1.258
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.838  20.905  -2.958
 1210   1HD2  LEU 181          1HD2      LEU 181  -7.481  21.767   0.247
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.835  21.200   0.458
 1212   3HD2  LEU 181          3HD2      LEU 181  -6.145  22.923   0.084
 1213    H    LYS 182           H        LYS 182  -9.155  23.454  -4.615
 1214    HA   LYS 182           HA       LYS 182  -9.143  26.330  -4.575
 1215   1HB   LYS 182          1HB       LYS 182 -10.333  24.236  -6.428
 1216   2HB   LYS 182          2HB       LYS 182 -10.667  25.953  -6.674
 1217   1HG   LYS 182          1HG       LYS 182  -8.339  26.480  -6.935
 1218   2HG   LYS 182          2HG       LYS 182  -7.837  24.832  -6.524
 1219   1HD   LYS 182          1HD       LYS 182  -8.808  23.912  -8.503
 1220   2HD   LYS 182          2HD       LYS 182  -9.697  25.390  -8.876
 1221   1HE   LYS 182          1HE       LYS 182  -6.649  25.209  -8.864
 1222   2HE   LYS 182          2HE       LYS 182  -7.648  24.942 -10.298
 1223   1HZ   LYS 182          1HZ       LYS 182  -6.939  27.234 -10.270
 1224   2HZ   LYS 182          2HZ       LYS 182  -8.540  27.205 -10.014
 1225   3HZ   LYS 182          3HZ       LYS 182  -7.521  27.477  -8.763
 1226    H    HIS 183           H        HIS 183 -11.822  23.936  -4.239
 1227    HA   HIS 183           HA       HIS 183 -13.944  25.838  -3.988
 1228   1HB   HIS 183          1HB       HIS 183 -14.515  23.560  -4.390
 1229   2HB   HIS 183          2HB       HIS 183 -13.576  22.959  -3.044
 1230    HD1  HIS 183           HD1      HIS 183 -16.940  24.739  -3.657
 1231    HD2  HIS 183           HD2      HIS 183 -14.636  22.992  -0.598
 1232    HE1  HIS 183           HE1      HIS 183 -18.444  24.616  -1.600
 1233    H    VAL 184           H        VAL 184 -11.773  24.330  -1.553
 1234    HA   VAL 184           HA       VAL 184 -13.014  25.433   0.774
 1235    HB   VAL 184           HB       VAL 184 -10.251  24.382   0.137
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.623  24.515   2.488
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.787  26.131   1.801
 1238   3HG1  VAL 184          3HG1      VAL 184 -11.082  25.485   2.845
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.650  23.535   1.810
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.968  22.741   0.382
 1241   3HG2  VAL 184          3HG2      VAL 184 -11.046  22.715   1.871
 1242    H    ALA 185           H        ALA 185 -10.331  26.636  -1.279
 1243    HA   ALA 185           HA       ALA 185  -9.699  28.861   0.338
 1244   1HB   ALA 185          1HB       ALA 185  -9.428  28.549  -2.689
 1245   2HB   ALA 185          2HB       ALA 185  -8.568  29.728  -1.678
 1246   3HB   ALA 185          3HB       ALA 185  -8.251  27.994  -1.477
 1247    H    GLU 186           H        GLU 186 -12.237  28.417  -2.109
 1248    HA   GLU 186           HA       GLU 186 -12.844  31.306  -2.240
 1249   1HB   GLU 186          1HB       GLU 186 -14.014  28.843  -3.587
 1250   2HB   GLU 186          2HB       GLU 186 -14.677  30.455  -3.820
 1251   1HG   GLU 186          1HG       GLU 186 -11.789  29.708  -4.454
 1252   2HG   GLU 186          2HG       GLU 186 -13.101  29.692  -5.622
 1253    H    CYS 187           H        CYS 187 -14.178  28.365  -0.718
 1254    HA   CYS 187           HA       CYS 187 -16.661  29.861   0.018
 1255   1HB   CYS 187          1HB       CYS 187 -16.042  26.873  -0.122
 1256   2HB   CYS 187          2HB       CYS 187 -17.577  27.550   0.435
 1257    HG   CYS 187           HG       CYS 187 -18.105  28.941  -1.736
 1258    H    HIS 188           H        HIS 188 -13.783  28.497   1.497
 1259    HA   HIS 188           HA       HIS 188 -14.965  29.008   4.203
 1260   1HB   HIS 188          1HB       HIS 188 -13.250  26.595   3.506
 1261   2HB   HIS 188          2HB       HIS 188 -13.972  26.957   5.076
 1262    HD1  HIS 188           HD1      HIS 188 -16.830  26.879   5.032
 1263    HD2  HIS 188           HD2      HIS 188 -14.614  25.156   1.908
 1264    HE1  HIS 188           HE1      HIS 188 -18.399  25.219   3.879
 1265    H    GLN 189           H        GLN 189 -12.917  30.326   2.244
 1266    HA   GLN 189           HA       GLN 189 -11.015  31.073   4.365
 1267   1HB   GLN 189          1HB       GLN 189 -10.249  29.031   2.616
 1268   2HB   GLN 189          2HB       GLN 189  -9.555  30.460   1.855
 1269   1HG   GLN 189          1HG       GLN 189  -8.333  30.991   3.931
 1270   2HG   GLN 189          2HG       GLN 189  -9.188  29.703   4.786
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.307  28.508   5.357
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.326  27.676   4.159
 1273    H    ASP 190           H        ASP 190  -9.319  32.714   3.255
 1274    HA   ASP 190           HA       ASP 190 -10.570  34.356   1.135
 1275   1HB   ASP 190          1HB       ASP 190 -11.667  35.201   3.170
 1276   2HB   ASP 190          2HB       ASP 190 -10.105  35.379   3.970
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  -6.313  30.170 -13.822
    2   2H5*    G   1          2H5*        G   1  -7.250  28.674 -13.663
    3    H4*    G   1           H4*        G   1  -6.334  28.822 -15.889
    4    H3*    G   1           H3*        G   1  -4.917  26.754 -14.188
    5    H2*    G   1           H2*        G   1  -3.939  25.999 -16.283
    6   2HO*    G   1          2HO*        G   1  -5.951  26.616 -17.566
    7    H1*    G   1           H1*        G   1  -3.178  28.499 -16.976
    8    H8     G   1           H8         G   1  -2.962  28.756 -13.238
    9    H1     G   1           H1         G   1   1.954  25.582 -15.911
   10   1H2     G   1          1H2         G   1   1.377  24.805 -17.854
   11   2H2     G   1          2H2         G   1  -0.113  25.302 -18.632
   12   1H5*    G   2          1H5*        G   2  -6.219  24.619 -17.478
   13   2H5*    G   2          2H5*        G   2  -6.982  23.097 -17.007
   14    H4*    G   2           H4*        G   2  -5.232  22.722 -18.662
   15    H3*    G   2           H3*        G   2  -4.564  21.676 -15.899
   16    H2*    G   2           H2*        G   2  -2.674  20.585 -16.960
   17   2HO*    G   2          2HO*        G   2  -3.977  20.247 -19.045
   18    H1*    G   2           H1*        G   2  -1.917  22.818 -18.312
   19    H8     G   2           H8         G   2  -3.331  24.241 -15.115
   20    H1     G   2           H1         G   2   2.516  21.654 -14.418
   21   1H2     G   2          1H2         G   2   2.907  20.264 -16.023
   22   2H2     G   2          2H2         G   2   1.845  20.128 -17.410
   23   1H5*    G   3          1H5*        G   3  -3.997  18.315 -18.315
   24   2H5*    G   3          2H5*        G   3  -4.806  16.901 -17.628
   25    H4*    G   3           H4*        G   3  -2.432  16.432 -18.030
   26    H3*    G   3           H3*        G   3  -3.239  16.629 -15.105
   27    H2*    G   3           H2*        G   3  -1.036  15.777 -14.623
   28   2HO*    G   3          2HO*        G   3  -1.148  14.321 -16.622
   29    H1*    G   3           H1*        G   3   0.231  17.351 -16.491
   30    H8     G   3           H8         G   3  -2.458  19.516 -14.887
   31    H1     G   3           H1         G   3   2.949  18.964 -11.436
   32   1H2     G   3          1H2         G   3   4.052  17.223 -12.068
   33   2H2     G   3          2H2         G   3   3.596  16.302 -13.488
   34   1H5*    C   4          1H5*        C   4  -1.551  12.798 -15.143
   35   2H5*    C   4          2H5*        C   4  -2.522  11.657 -14.206
   36    H4*    C   4           H4*        C   4  -0.269  11.781 -13.298
   37    H3*    C   4           H3*        C   4  -2.325  13.101 -11.495
   38    H2*    C   4           H2*        C   4  -0.557  13.354  -9.914
   39   2HO*    C   4          2HO*        C   4   0.316  11.120 -10.516
   40    H1*    C   4           H1*        C   4   1.391  13.992 -11.803
   41   1H4     C   4          1H4         C   4  -0.772  19.270  -8.954
   42   2H4     C   4          2H4         C   4  -2.208  19.271  -9.949
   43    H5     C   4           H5         C   4  -2.685  17.565 -11.569
   44    H6     C   4           H6         C   4  -1.882  15.469 -12.543
   45   1H5*    C   5          1H5*        C   5  -1.347  11.836  -8.400
   46   2H5*    C   5          2H5*        C   5  -2.508  10.762  -7.620
   47    H4*    C   5           H4*        C   5  -1.916  12.815  -6.357
   48    H3*    C   5           H3*        C   5  -4.391  11.605  -6.290
   49    H2*    C   5           H2*        C   5  -5.199  12.977  -8.123
   50   2HO*    C   5          2HO*        C   5  -6.600  13.309  -6.116
   51    H1*    C   5           H1*        C   5  -4.118  15.339  -6.647
   52   1H4     C   5          1H4         C   5  -5.669  18.474 -11.911
   53   2H4     C   5          2H4         C   5  -5.396  17.075 -12.918
   54    H5     C   5           H5         C   5  -4.747  14.947 -12.037
   55    H6     C   5           H6         C   5  -4.315  13.687  -9.984
   56   1H5*    A   6          1H5*        A   6  -2.282  14.982  -4.252
   57   2H5*    A   6          2H5*        A   6  -1.014  13.765  -4.088
   58    H4*    A   6           H4*        A   6  -0.351  15.774  -3.200
   59    H3*    A   6           H3*        A   6  -0.589  13.614  -1.206
   60    H2*    A   6           H2*        A   6  -0.304  15.094   0.656
   61   2HO*    A   6          2HO*        A   6   1.418  16.382   0.168
   62    H1*    A   6           H1*        A   6  -1.602  17.307  -0.281
   63    H8     A   6           H8         A   6  -4.102  15.120  -1.606
   64   1H6     A   6          1H6         A   6  -6.194  14.180   4.156
   65   2H6     A   6          2H6         A   6  -6.486  13.872   2.461
   66    H2     A   6           H2         A   6  -2.286  16.251   4.456
   67   1H5*    U   7          1H5*        U   7   3.167  13.071   1.049
   68   2H5*    U   7          2H5*        U   7   2.144  14.391   0.498
   69    H4*    U   7           H4*        U   7   3.894  15.231   1.882
   70    H3*    U   7           H3*        U   7   3.269  16.403  -0.557
   71    H2*    U   7           H2*        U   7   5.065  15.323  -1.697
   72   2HO*    U   7          2HO*        U   7   5.813  17.857  -0.729
   73    H1*    U   7           H1*        U   7   6.865  15.858   0.694
   74    H3     U   7           H3         U   7  10.418  14.039  -1.333
   75    H5     U   7           H5         U   7   7.534  11.015  -1.446
   76    H6     U   7           H6         U   7   5.849  12.662  -0.779
   77   1H5*    A   8          1H5*        A   8   4.037  20.054  -0.614
   78   2H5*    A   8          2H5*        A   8   3.283  20.928   0.720
   79    H4*    A   8           H4*        A   8   2.568  21.975  -1.247
   80    H3*    A   8           H3*        A   8   0.700  21.062   0.522
   81    H2*    A   8           H2*        A   8   0.322  19.045  -0.756
   82   2HO*    A   8          2HO*        A   8  -1.760  20.039  -0.318
   83    H1*    A   8           H1*        A   8   0.140  20.900  -3.126
   84    H8     A   8           H8         A   8   2.291  17.724  -2.818
   85   1H6     A   8          1H6         A   8  -1.316  15.519  -7.353
   86   2H6     A   8          2H6         A   8   0.222  15.346  -6.541
   87    H2     A   8           H2         A   8  -3.176  19.248  -5.817
   88   1H5*    C   9          1H5*        C   9  -2.524  22.441  -0.394
   89   2H5*    C   9          2H5*        C   9  -2.822  23.975   0.436
   90    H4*    C   9           H4*        C   9  -4.392  22.371   1.209
   91    H3*    C   9           H3*        C   9  -2.352  23.017   3.310
   92    H2*    C   9           H2*        C   9  -3.589  21.537   4.772
   93   2HO*    C   9          2HO*        C   9  -5.685  22.288   3.514
   94    H1*    C   9           H1*        C   9  -3.939  19.534   2.957
   95   1H4     C   9          1H4         C   9   1.641  18.333   5.892
   96   2H4     C   9          2H4         C   9   2.461  18.872   4.440
   97    H5     C   9           H5         C   9   1.343  20.053   2.691
   98    H6     C   9           H6         C   9  -0.822  20.813   1.869
   99   1H5*    C  10          1H5*        C  10  -5.857  23.245   5.281
  100   2H5*    C  10          2H5*        C  10  -6.054  24.659   6.318
  101    H4*    C  10           H4*        C  10  -6.247  22.574   7.600
  102    H3*    C  10           H3*        C  10  -3.746  24.172   8.229
  103    H2*    C  10           H2*        C  10  -3.442  22.640  10.053
  104   2HO*    C  10          2HO*        C  10  -5.819  22.481  10.508
  105    H1*    C  10           H1*        C  10  -4.001  20.405   8.530
  106   1H4     C  10          1H4         C  10   2.293  20.961   8.117
  107   2H4     C  10          2H4         C  10   2.117  21.859   6.626
  108    H5     C  10           H5         C  10   0.003  22.638   5.799
  109    H6     C  10           H6         C  10  -2.409  22.674   6.234
  110   1H5*    U  11          1H5*        U  11  -5.228  24.366  12.097
  111   2H5*    U  11          2H5*        U  11  -4.819  25.937  12.798
  112    H4*    U  11           H4*        U  11  -3.672  23.915  13.804
  113    H3*    U  11           H3*        U  11  -1.976  26.111  12.626
  114    H2*    U  11           H2*        U  11  -0.133  25.043  13.722
  115   2HO*    U  11          2HO*        U  11  -1.468  24.477  15.679
  116    H1*    U  11           H1*        U  11  -0.926  22.511  13.005
  117    H3     U  11           H3         U  11   2.808  23.405  10.511
  118    H5     U  11           H5         U  11  -0.234  25.499   8.536
  119    H6     U  11           H6         U  11  -1.753  24.927  10.378
  120   1H5*    C  12          1H5*        C  12  -0.375  26.821  16.817
  121   2H5*    C  12          2H5*        C  12   0.505  28.296  16.443
  122    H4*    C  12           H4*        C  12   1.381  25.516  16.498
  123    H3*    C  12           H3*        C  12   2.470  27.892  17.270
  124    H2*    C  12           H2*        C  12   2.582  28.687  14.959
  125   2HO*    C  12          2HO*        C  12   4.982  28.015  16.167
  126    H1*    C  12           H1*        C  12   3.932  26.022  14.382
  127   1H4     C  12          1H4         C  12   4.009  28.439   8.501
  128   2H4     C  12          2H4         C  12   2.301  28.789   8.563
  129    H5     C  12           H5         C  12   0.954  28.421  10.517
  130    H6     C  12           H6         C  12   0.984  27.629  12.837
  131   1H5*    U  13          1H5*        U  13   3.799  23.674  18.517
  132   2H5*    U  13          2H5*        U  13   4.675  23.893  20.032
  133    H4*    U  13           H4*        U  13   5.619  21.916  19.400
  134    H3*    U  13           H3*        U  13   7.476  23.928  18.925
  135    H2*    U  13           H2*        U  13   6.748  24.208  16.629
  136   2HO*    U  13          2HO*        U  13   8.995  22.455  16.760
  137    H1*    U  13           H1*        U  13   6.859  21.165  16.474
  138    H3     U  13           H3         U  13   6.367  21.505  11.970
  139    H5     U  13           H5         U  13   3.426  24.095  13.417
  140    H6     U  13           H6         U  13   4.213  23.641  15.698
  141   1H5*    U  14          1H5*        U  14   9.954  19.043  19.933
  142   2H5*    U  14          2H5*        U  14  11.407  19.664  19.152
  143    H4*    U  14           H4*        U  14   8.623  19.444  17.961
  144    H3*    U  14           H3*        U  14  10.875  17.673  17.937
  145    H2*    U  14           H2*        U  14  12.088  19.061  16.490
  146   2HO*    U  14          2HO*        U  14  10.485  17.291  14.951
  147    H1*    U  14           H1*        U  14   9.443  19.728  15.119
  148    H3     U  14           H3         U  14  11.850  21.744  11.803
  149    H5     U  14           H5         U  14  13.490  23.371  15.290
  150    H6     U  14           H6         U  14  12.063  21.863  16.605
  151   1H5*    G  15          1H5*        G  15   6.146  15.030  16.385
  152   2H5*    G  15          2H5*        G  15   6.697  16.463  15.499
  153    H4*    G  15           H4*        G  15   4.415  16.612  17.489
  154    H3*    G  15           H3*        G  15   4.284  15.879  14.554
  155    H2*    G  15           H2*        G  15   2.019  16.765  14.659
  156   2HO*    G  15          2HO*        G  15   1.690  16.045  16.972
  157    H1*    G  15           H1*        G  15   2.871  19.032  15.883
  158    H8     G  15           H8         G  15   5.837  18.308  13.718
  159    H1     G  15           H1         G  15   0.737  20.312  10.353
  160   1H2     G  15          1H2         G  15  -1.061  20.080  11.526
  161   2H2     G  15          2H2         G  15  -1.014  19.641  13.222
  162   1H5*    G  16          1H5*        G  16   0.583  14.531  15.937
  163   2H5*    G  16          2H5*        G  16   0.247  12.904  15.339
  164    H4*    G  16           H4*        G  16  -1.598  14.402  14.856
  165    H3*    G  16           H3*        G  16  -0.085  13.579  12.362
  166    H2*    G  16           H2*        G  16  -1.946  14.597  11.171
  167   2HO*    G  16          2HO*        G  16  -3.560  13.900  12.874
  168    H1*    G  16           H1*        G  16  -1.902  16.856  12.668
  169    H8     G  16           H8         G  16   1.746  15.980  12.591
  170    H1     G  16           H1         G  16  -0.409  17.758   6.824
  171   1H2     G  16          1H2         G  16  -2.563  18.073   6.871
  172   2H2     G  16          2H2         G  16  -3.515  17.621   8.271
  173   1H5*    G  17          1H5*        G  17  -3.848  12.497  11.132
  174   2H5*    G  17          2H5*        G  17  -3.819  10.942  10.290
  175    H4*    G  17           H4*        G  17  -4.653  12.764   8.875
  176    H3*    G  17           H3*        G  17  -2.021  11.585   7.945
  177    H2*    G  17           H2*        G  17  -2.370  12.984   5.946
  178   2HO*    G  17          2HO*        G  17  -4.776  12.717   6.113
  179    H1*    G  17           H1*        G  17  -2.732  15.223   7.341
  180    H8     G  17           H8         G  17  -0.612  13.485   9.854
  181    H1     G  17           H1         G  17   2.689  15.736   4.826
  182   1H2     G  17          1H2         G  17   1.332  16.275   3.217
  183   2H2     G  17          2H2         G  17  -0.387  15.918   3.302
  184   1H5*    C  18          1H5*        C  18  -3.764  11.215   4.420
  185   2H5*    C  18          2H5*        C  18  -3.581   9.613   3.683
  186    H4*    C  18           H4*        C  18  -2.563  11.248   2.248
  187    H3*    C  18           H3*        C  18  -0.394   9.741   3.733
  188    H2*    C  18           H2*        C  18   1.174  10.916   2.190
  189   2HO*    C  18          2HO*        C  18   0.093  11.347   0.270
  190    H1*    C  18           H1*        C  18   0.193  13.222   2.809
  191   1H4     C  18          1H4         C  18   4.146  11.826   7.615
  192   2H4     C  18          2H4         C  18   2.780  11.337   8.585
  193    H5     C  18           H5         C  18   0.535  11.269   7.758
  194    H6     C  18           H6         C  18  -0.849  11.577   5.778
  195   1H5*    C  19          1H5*        C  19   1.108   9.543   0.089
  196   2H5*    C  19          2H5*        C  19   1.589   7.895  -0.368
  197    H4*    C  19           H4*        C  19   3.395   9.464  -0.764
  198    H3*    C  19           H3*        C  19   3.915   7.573   1.556
  199    H2*    C  19           H2*        C  19   6.202   8.347   1.360
  200   2HO*    C  19          2HO*        C  19   5.917   8.574  -1.091
  201    H1*    C  19           H1*        C  19   5.502  10.983   1.275
  202   1H4     C  19          1H4         C  19   6.121   9.282   7.420
  203   2H4     C  19          2H4         C  19   4.438   8.814   7.482
  204    H5     C  19           H5         C  19   2.997   8.819   5.569
  205    H6     C  19           H6         C  19   2.858   9.366   3.187
  206   1H5*    U  20          1H5*        U  20   7.088   6.899  -0.836
  207   2H5*    U  20          2H5*        U  20   7.391   5.171  -1.062
  208    H4*    U  20           H4*        U  20   9.375   6.285  -0.266
  209    H3*    U  20           H3*        U  20   8.128   4.472   1.823
  210    H2*    U  20           H2*        U  20  10.286   4.692   2.919
  211   2HO*    U  20          2HO*        U  20  11.550   4.820   0.854
  212    H1*    U  20           H1*        U  20  10.272   7.399   2.618
  213    H3     U  20           H3         U  20   9.203   6.389   6.982
  214    H5     U  20           H5         U  20   5.548   6.240   4.957
  215    H6     U  20           H6         U  20   6.772   6.460   2.836
  216   1H5*    G  21          1H5*        G  21  11.931   2.906   0.974
  217   2H5*    G  21          2H5*        G  21  11.948   1.142   1.010
  218    H4*    G  21           H4*        G  21  13.650   2.075   2.469
  219    H3*    G  21           H3*        G  21  11.408   0.774   4.055
  220    H2*    G  21           H2*        G  21  12.970   0.962   5.915
  221   2HO*    G  21          2HO*        G  21  14.933   0.709   4.399
  222    H1*    G  21           H1*        G  21  13.435   3.579   5.387
  223    H8     G  21           H8         G  21   9.849   3.022   4.256
  224    H1     G  21           H1         G  21  10.514   3.233  10.651
  225   1H2     G  21          1H2         G  21  12.593   2.996  11.187
  226   2H2     G  21          2H2         G  21  13.866   2.973   9.984
  227   1H5*    G  22          1H5*        G  22  14.844  -1.030   5.262
  228   2H5*    G  22          2H5*        G  22  14.726  -2.785   5.327
  229    H4*    G  22           H4*        G  22  15.630  -1.902   7.397
  230    H3*    G  22           H3*        G  22  12.842  -3.047   7.707
  231    H2*    G  22           H2*        G  22  13.192  -2.845  10.071
  232   2HO*    G  22          2HO*        G  22  15.486  -3.449  10.042
  233    H1*    G  22           H1*        G  22  14.200  -0.311   9.894
  234    H8     G  22           H8         G  22  11.583  -0.368   7.174
  235    H1     G  22           H1         G  22   9.098  -0.019  13.106
  236   1H2     G  22          1H2         G  22  10.587  -0.554  14.569
  237   2H2     G  22          2H2         G  22  12.253  -0.880  14.128
  238   1H5*    U  23          1H5*        U  23  12.538  -7.295  10.014
  239   2H5*    U  23          2H5*        U  23  11.627  -5.818   9.624
  240    H4*    U  23           H4*        U  23  13.146  -6.214  12.205
  241    H3*    U  23           H3*        U  23  10.228  -6.384  11.372
  242    H2*    U  23           H2*        U  23   9.656  -5.897  13.618
  243   2HO*    U  23          2HO*        U  23  11.583  -7.009  14.586
  244    H1*    U  23           H1*        U  23  11.296  -3.735  13.635
  245    H3     U  23           H3         U  23   6.784  -2.752  12.820
  246    H5     U  23           H5         U  23   8.610  -2.922   9.065
  247    H6     U  23           H6         U  23  10.668  -3.709  10.158
  248   1H5*    U  24          1H5*        U  24   9.894  -8.560  14.268
  249   2H5*    U  24          2H5*        U  24   9.252 -10.199  14.106
  250    H4*    U  24           H4*        U  24   7.851  -8.934  15.621
  251    H3*    U  24           H3*        U  24   6.579  -9.316  12.911
  252    H2*    U  24           H2*        U  24   4.559  -8.518  13.809
  253   2HO*    U  24          2HO*        U  24   4.774  -9.559  15.950
  254    H1*    U  24           H1*        U  24   5.805  -6.433  15.144
  255    H3     U  24           H3         U  24   3.408  -4.838  11.517
  256    H5     U  24           H5         U  24   7.020  -6.179   9.867
  257    H6     U  24           H6         U  24   7.681  -6.995  12.090
  258   1H5*    A  25          1H5*        A  25   5.241 -13.372  11.515
  259   2H5*    A  25          2H5*        A  25   6.963 -13.650  11.325
  260    H4*    A  25           H4*        A  25   6.060 -13.226   9.160
  261    H3*    A  25           H3*        A  25   8.182 -11.575   9.974
  262    H2*    A  25           H2*        A  25   6.639  -9.781  10.583
  263   2HO*    A  25          2HO*        A  25   8.229  -8.862   9.250
  264    H1*    A  25           H1*        A  25   5.417 -10.632   7.904
  265    H8     A  25           H8         A  25   3.832  -9.460  11.303
  266   1H6     A  25          1H6         A  25   1.071  -5.155   7.737
  267   2H6     A  25          2H6         A  25   0.976  -5.991   9.276
  268    H2     A  25           H2         A  25   4.108  -7.320   5.271
  269   1H5*    G  26          1H5*        G  26   8.156 -14.557   4.815
  270   2H5*    G  26          2H5*        G  26   8.164 -12.820   4.601
  271    H4*    G  26           H4*        G  26   6.125 -13.475   6.548
  272    H3*    G  26           H3*        G  26   6.373 -15.719   4.873
  273    H2*    G  26           H2*        G  26   6.202 -14.257   3.012
  274   2HO*    G  26          2HO*        G  26   3.714 -15.597   3.461
  275    H1*    G  26           H1*        G  26   3.748 -13.204   4.480
  276    H8     G  26           H8         G  26   5.753 -13.055   1.260
  277    H1     G  26           H1         G  26   1.314  -8.467   1.833
  278   1H2     G  26          1H2         G  26   0.733  -8.279   3.907
  279   2H2     G  26          2H2         G  26   1.198  -9.458   5.123
  280   1H5*    U  27          1H5*        U  27   5.023 -16.193   8.120
  281   2H5*    U  27          2H5*        U  27   4.255 -17.765   8.422
  282    H4*    U  27           H4*        U  27   4.000 -16.749  10.482
  283    H3*    U  27           H3*        U  27   1.478 -15.937   8.977
  284    H2*    U  27           H2*        U  27   0.859 -14.619  10.884
  285   2HO*    U  27          2HO*        U  27   1.992 -16.325  12.357
  286    H1*    U  27           H1*        U  27   3.234 -13.412  11.229
  287    H3     U  27           H3         U  27   0.531 -10.475   8.925
  288    H5     U  27           H5         U  27   3.148 -12.159   6.158
  289    H6     U  27           H6         U  27   3.654 -13.924   7.777
  290   1H5*    A  28          1H5*        A  28  -0.138 -16.076  12.649
  291   2H5*    A  28          2H5*        A  28  -1.423 -17.281  12.680
  292    H4*    A  28           H4*        A  28  -2.302 -15.166  13.448
  293    H3*    A  28           H3*        A  28  -3.290 -15.897  10.662
  294    H2*    A  28           H2*        A  28  -4.710 -13.941  10.831
  295   2HO*    A  28          2HO*        A  28  -5.026 -14.309  13.244
  296    H1*    A  28           H1*        A  28  -2.738 -12.328  11.783
  297    H8     A  28           H8         A  28  -0.661 -14.285   9.431
  298   1H6     A  28          1H6         A  28  -2.962 -10.604   4.966
  299   2H6     A  28          2H6         A  28  -1.717 -11.782   5.343
  300    H2     A  28           H2         A  28  -5.835 -10.641   8.339
  301   1H5*    C  29          1H5*        C  29  -6.831 -15.105  11.960
  302   2H5*    C  29          2H5*        C  29  -8.048 -16.335  11.586
  303    H4*    C  29           H4*        C  29  -8.563 -14.277  10.410
  304    H3*    C  29           H3*        C  29  -7.560 -16.448   8.556
  305    H2*    C  29           H2*        C  29  -8.113 -14.916   6.739
  306   2HO*    C  29          2HO*        C  29 -10.073 -14.063   7.927
  307    H1*    C  29           H1*        C  29  -6.941 -12.791   7.846
  308   1H4     C  29          1H4         C  29  -2.262 -15.651   4.604
  309   2H4     C  29          2H4         C  29  -1.742 -16.445   6.072
  310    H5     C  29           H5         C  29  -2.995 -16.401   8.107
  311    H6     C  29           H6         C  29  -4.992 -15.496   9.183
  312   1H5*    C  30          1H5*        C  30 -11.197 -15.550   6.772
  313   2H5*    C  30          2H5*        C  30 -12.058 -17.006   6.249
  314    H4*    C  30           H4*        C  30 -11.572 -15.516   4.364
  315    H3*    C  30           H3*        C  30  -9.933 -18.066   4.291
  316    H2*    C  30           H2*        C  30  -9.333 -17.361   2.044
  317   2HO*    C  30          2HO*        C  30 -11.574 -16.304   1.752
  318    H1*    C  30           H1*        C  30  -8.811 -14.793   2.843
  319   1H4     C  30          1H4         C  30  -3.505 -18.350   3.140
  320   2H4     C  30          2H4         C  30  -3.858 -18.785   4.797
  321    H5     C  30           H5         C  30  -5.866 -18.114   5.935
  322    H6     C  30           H6         C  30  -7.992 -16.924   5.669
  323   1H5*    U  31          1H5*        U  31 -12.062 -17.764   0.553
  324   2H5*    U  31          2H5*        U  31 -12.994 -19.226   0.232
  325    H4*    U  31           H4*        U  31 -11.919 -18.456  -1.791
  326    H3*    U  31           H3*        U  31 -10.666 -21.003  -0.745
  327    H2*    U  31           H2*        U  31  -9.464 -21.084  -2.816
  328   2HO*    U  31          2HO*        U  31 -11.362 -20.192  -4.070
  329    H1*    U  31           H1*        U  31  -8.782 -18.436  -2.778
  330    H3     U  31           H3         U  31  -4.958 -20.791  -1.711
  331    H5     U  31           H5         U  31  -6.900 -20.104   1.940
  332    H6     U  31           H6         U  31  -8.883 -19.374   0.697
  333   1H5*    C  32          1H5*        C  32 -11.829 -22.393  -4.268
  334   2H5*    C  32          2H5*        C  32 -12.564 -24.000  -4.224
  335    H4*    C  32           H4*        C  32 -10.520 -24.054  -5.536
  336    H3*    C  32           H3*        C  32 -10.143 -25.436  -2.859
  337    H2*    C  32           H2*        C  32  -7.955 -26.048  -3.680
  338   2HO*    C  32          2HO*        C  32  -8.909 -26.284  -5.987
  339    H1*    C  32           H1*        C  32  -7.419 -23.576  -4.773
  340   1H4     C  32          1H4         C  32  -4.948 -23.918   1.103
  341   2H4     C  32          2H4         C  32  -6.495 -23.532   1.822
  342    H5     C  32           H5         C  32  -8.492 -23.188   0.537
  343    H6     C  32           H6         C  32  -9.426 -23.227  -1.726
  344   1H5*    U  33          1H5*        U  33  -8.288 -28.080  -4.907
  345   2H5*    U  33          2H5*        U  33  -8.982 -29.699  -4.796
  346    H4*    U  33           H4*        U  33  -6.652 -29.858  -4.173
  347    H3*    U  33           H3*        U  33  -8.478 -29.938  -1.752
  348    H2*    U  33           H2*        U  33  -6.665 -30.299  -0.425
  349   2HO*    U  33          2HO*        U  33  -4.716 -30.840  -2.462
  350    H1*    U  33           H1*        U  33  -4.873 -28.739  -1.960
  351    H3     U  33           H3         U  33  -4.825 -27.035   2.281
  352    H5     U  33           H5         U  33  -8.755 -26.345   1.028
  353    H6     U  33           H6         U  33  -8.221 -27.453  -1.098
  354   1H5*    U  34          1H5*        U  34  -8.600 -35.550  -1.009
  355   2H5*    U  34          2H5*        U  34  -7.870 -34.585   0.277
  356    H4*    U  34           H4*        U  34  -6.714 -36.715  -0.012
  357    H3*    U  34           H3*        U  34  -5.330 -34.369   0.315
  358    H2*    U  34           H2*        U  34  -5.041 -33.991  -2.037
  359   2HO*    U  34          2HO*        U  34  -2.780 -35.425  -1.039
  360    H1*    U  34           H1*        U  34  -4.316 -36.938  -2.266
  361    H3     U  34           H3         U  34  -3.345 -36.465  -6.651
  362    H5     U  34           H5         U  34  -6.715 -34.024  -6.225
  363    H6     U  34           H6         U  34  -6.752 -34.583  -3.832
  364   1H5*    C  35          1H5*        C  35  -1.864 -34.558   1.015
  365   2H5*    C  35          2H5*        C  35  -1.497 -35.432   2.503
  366    H4*    C  35           H4*        C  35  -0.480 -33.228   2.479
  367    H3*    C  35           H3*        C  35  -1.675 -34.246   4.715
  368    H2*    C  35           H2*        C  35  -3.810 -33.269   4.238
  369   2HO*    C  35          2HO*        C  35  -2.333 -31.542   5.953
  370    H1*    C  35           H1*        C  35  -2.454 -30.633   3.578
  371   1H4     C  35          1H4         C  35  -8.647 -29.749   2.290
  372   2H4     C  35          2H4         C  35  -8.634 -31.069   1.134
  373    H5     C  35           H5         C  35  -6.745 -32.487   0.822
  374    H6     C  35           H6         C  35  -4.379 -32.794   1.340
  375   1H5*    G  36          1H5*        G  36   2.818 -31.001   4.637
  376   2H5*    G  36          2H5*        G  36   1.261 -31.058   3.794
  377    H4*    G  36           H4*        G  36   3.798 -32.472   2.881
  378    H3*    G  36           H3*        G  36   2.314 -30.021   1.856
  379    H2*    G  36           H2*        G  36   3.103 -30.597  -0.304
  380   2HO*    G  36          2HO*        G  36   5.334 -31.111   0.766
  381    H1*    G  36           H1*        G  36   3.127 -33.391   0.225
  382    H8     G  36           H8         G  36   1.809 -33.861  -2.000
  383    H1     G  36           H1         G  36  -2.793 -29.604  -0.514
  384   1H2     G  36          1H2         G  36  -2.342 -28.610   1.321
  385   2H2     G  36          2H2         G  36  -0.871 -28.912   2.218
  386   1H5*    G  37          1H5*        G  37   4.867 -29.038  -0.171
  387   2H5*    G  37          2H5*        G  37   5.338 -27.342  -0.242
  388    H4*    G  37           H4*        G  37   4.005 -28.295  -2.216
  389    H3*    G  37           H3*        G  37   2.920 -25.838  -0.787
  390    H2*    G  37           H2*        G  37   1.373 -25.777  -2.706
  391   2HO*    G  37          2HO*        G  37   3.123 -26.789  -4.191
  392    H1*    G  37           H1*        G  37   0.712 -28.372  -2.461
  393    H8     G  37           H8         G  37   1.502 -27.047   1.054
  394    H1     G  37           H1         G  37  -4.073 -24.930  -1.338
  395   1H2     G  37          1H2         G  37  -4.245 -25.499  -3.413
  396   2H2     G  37          2H2         G  37  -3.094 -26.572  -4.183
  397   1H5*    U  38          1H5*        U  38   2.407 -24.912  -4.641
  398   2H5*    U  38          2H5*        U  38   3.096 -23.388  -5.176
  399    H4*    U  38           H4*        U  38   0.770 -23.581  -5.835
  400    H3*    U  38           H3*        U  38   1.180 -21.491  -3.717
  401    H2*    U  38           H2*        U  38  -1.040 -20.730  -4.252
  402   2HO*    U  38          2HO*        U  38  -1.005 -21.145  -6.559
  403    H1*    U  38           H1*        U  38  -2.071 -23.246  -4.089
  404    H3     U  38           H3         U  38  -3.161 -21.377  -0.040
  405    H5     U  38           H5         U  38   0.729 -22.812   0.485
  406    H6     U  38           H6         U  38   0.832 -23.268  -1.917
  407   1H5*    G  39          1H5*        G  39   0.152 -19.253  -7.027
  408   2H5*    G  39          2H5*        G  39   1.011 -17.716  -7.053
  409    H4*    G  39           H4*        G  39  -1.352 -17.365  -7.143
  410    H3*    G  39           H3*        G  39  -0.337 -16.543  -4.417
  411    H2*    G  39           H2*        G  39  -2.592 -15.624  -4.146
  412   2HO*    G  39          2HO*        G  39  -2.778 -15.123  -6.563
  413    H1*    G  39           H1*        G  39  -3.745 -17.933  -4.915
  414    H8     G  39           H8         G  39  -0.391 -18.846  -3.294
  415    H1     G  39           H1         G  39  -4.989 -17.272   0.907
  416   1H2     G  39          1H2         G  39  -6.628 -16.320  -0.126
  417   2H2     G  39          2H2         G  39  -6.717 -16.259  -1.874
  418   1H5*    G  40          1H5*        G  40  -2.421 -13.315  -5.866
  419   2H5*    G  40          2H5*        G  40  -1.669 -11.761  -5.475
  420    H4*    G  40           H4*        G  40  -4.015 -11.799  -4.833
  421    H3*    G  40           H3*        G  40  -1.989 -11.576  -2.584
  422    H2*    G  40           H2*        G  40  -3.910 -11.243  -1.123
  423   2HO*    G  40          2HO*        G  40  -5.099 -10.022  -2.949
  424    H1*    G  40           H1*        G  40  -5.361 -13.271  -2.147
  425    H8     G  40           H8         G  40  -1.863 -14.631  -2.378
  426    H1     G  40           H1         G  40  -4.029 -14.308   3.664
  427   1H2     G  40          1H2         G  40  -5.821 -13.111   3.752
  428   2H2     G  40          2H2         G  40  -6.522 -12.380   2.322
  429   1H5*    G  41          1H5*        G  41  -4.239  -9.023  -1.024
  430   2H5*    G  41          2H5*        G  41  -3.443  -7.492  -0.663
  431    H4*    G  41           H4*        G  41  -4.172  -8.433   1.418
  432    H3*    G  41           H3*        G  41  -1.186  -8.794   1.048
  433    H2*    G  41           H2*        G  41  -1.172  -9.532   3.379
  434   2HO*    G  41          2HO*        G  41  -2.923  -8.211   4.204
  435    H1*    G  41           H1*        G  41  -3.148 -11.311   2.955
  436    H8     G  41           H8         G  41  -1.492 -11.100  -0.440
  437    H1     G  41           H1         G  41   1.699 -14.781   3.747
  438   1H2     G  41          1H2         G  41   0.941 -14.511   5.730
  439   2H2     G  41          2H2         G  41  -0.379 -13.422   6.108
  440   1H5*    A  42          1H5*        A  42  -0.082  -4.795   4.567
  441   2H5*    A  42          2H5*        A  42   0.141  -6.131   5.702
  442    H4*    A  42           H4*        A  42  -2.496  -5.242   4.465
  443    H3*    A  42           H3*        A  42  -1.402  -5.339   7.290
  444    H2*    A  42           H2*        A  42  -3.665  -5.698   8.061
  445   2HO*    A  42          2HO*        A  42  -4.603  -4.319   6.233
  446    H1*    A  42           H1*        A  42  -4.132  -7.714   6.365
  447    H8     A  42           H8         A  42  -0.597  -8.491   6.550
  448   1H6     A  42          1H6         A  42  -1.384 -10.402  12.417
  449   2H6     A  42          2H6         A  42  -0.374 -10.545  10.995
  450    H2     A  42           H2         A  42  -4.959  -8.044  11.265
  451   1H5*    A  43          1H5*        A  43  -4.167  -2.833   7.640
  452   2H5*    A  43          2H5*        A  43  -4.192  -1.246   8.362
  453    H4*    A  43           H4*        A  43  -5.581  -2.711   9.673
  454    H3*    A  43           H3*        A  43  -2.957  -2.183  11.114
  455    H2*    A  43           H2*        A  43  -3.726  -3.627  12.885
  456   2HO*    A  43          2HO*        A  43  -6.052  -2.782  12.517
  457    H1*    A  43           H1*        A  43  -4.728  -5.575  11.227
  458    H8     A  43           H8         A  43  -1.704  -4.721   9.307
  459   1H6     A  43          1H6         A  43   1.490  -8.252  13.284
  460   2H6     A  43          2H6         A  43   1.476  -7.576  11.667
  461    H2     A  43           H2         A  43  -2.381  -7.218  15.188
  462   1H5*    U  44          1H5*        U  44  -5.133  -1.671  14.218
  463   2H5*    U  44          2H5*        U  44  -4.804  -0.164  15.086
  464    H4*    U  44           H4*        U  44  -4.177  -2.036  16.482
  465    H3*    U  44           H3*        U  44  -1.780  -0.585  15.328
  466    H2*    U  44           H2*        U  44  -0.435  -1.961  16.768
  467   2HO*    U  44          2HO*        U  44  -2.168  -1.898  18.528
  468    H1*    U  44           H1*        U  44  -1.765  -4.274  16.192
  469    H3     U  44           H3         U  44   2.158  -4.703  13.857
  470    H5     U  44           H5         U  44  -0.253  -2.331  11.396
  471    H6     U  44           H6         U  44  -1.828  -2.097  13.257
  472   1H5*    A  45          1H5*        A  45  -1.062  -0.458  19.427
  473   2H5*    A  45          2H5*        A  45  -0.330   1.076  19.915
  474    H4*    A  45           H4*        A  45   1.134  -0.816  20.429
  475    H3*    A  45           H3*        A  45   2.219   0.929  18.190
  476    H2*    A  45           H2*        A  45   4.240  -0.374  18.420
  477   2HO*    A  45          2HO*        A  45   3.889  -0.633  20.854
  478    H1*    A  45           H1*        A  45   2.920  -2.753  18.402
  479    H8     A  45           H8         A  45   0.947  -0.300  16.215
  480   1H6     A  45          1H6         A  45   4.813  -1.921  11.616
  481   2H6     A  45          2H6         A  45   3.307  -1.113  12.008
  482    H2     A  45           H2         A  45   6.394  -3.605  15.395
  483   1H5*    C  46          1H5*        C  46   5.212   0.816  21.066
  484   2H5*    C  46          2H5*        C  46   5.921   2.415  21.323
  485    H4*    C  46           H4*        C  46   7.636   0.783  20.775
  486    H3*    C  46           H3*        C  46   7.173   2.780  18.529
  487    H2*    C  46           H2*        C  46   9.239   1.911  17.643
  488   2HO*    C  46          2HO*        C  46  10.185   1.572  19.883
  489    H1*    C  46           H1*        C  46   8.497  -0.697  18.076
  490   1H4     C  46          1H4         C  46   6.634   0.798  12.163
  491   2H4     C  46          2H4         C  46   5.093   1.368  12.769
  492    H5     C  46           H5         C  46   4.581   1.545  15.108
  493    H6     C  46           H6         C  46   5.452   1.178  17.370
  494   1H5*    C  47          1H5*        C  47  11.155   3.301  19.589
  495   2H5*    C  47          2H5*        C  47  11.597   5.011  19.609
  496    H4*    C  47           H4*        C  47  13.061   3.745  18.132
  497    H3*    C  47           H3*        C  47  11.181   5.571  16.607
  498    H2*    C  47           H2*        C  47  12.663   5.118  14.735
  499   2HO*    C  47          2HO*        C  47  14.652   5.017  16.121
  500    H1*    C  47           H1*        C  47  12.700   2.423  15.261
  501   1H4     C  47          1H4         C  47   7.962   3.515  11.125
  502   2H4     C  47          2H4         C  47   6.865   3.891  12.434
  503    H5     C  47           H5         C  47   7.540   3.984  14.737
  504    H6     C  47           H6         C  47   9.440   3.728  16.266
  505   1H5*    A  48          1H5*        A  48  15.149   6.890  15.759
  506   2H5*    A  48          2H5*        A  48  15.240   8.649  15.663
  507    H4*    A  48           H4*        A  48  16.177   7.599  13.675
  508    H3*    A  48           H3*        A  48  13.569   9.032  13.101
  509    H2*    A  48           H2*        A  48  14.183   8.703  10.759
  510   2HO*    A  48          2HO*        A  48  16.597   8.865  11.267
  511    H1*    A  48           H1*        A  48  14.682   6.070  11.142
  512    H8     A  48           H8         A  48  11.970   6.870  13.668
  513   1H6     A  48          1H6         A  48   7.918   6.457   8.964
  514   2H6     A  48          2H6         A  48   8.094   6.572  10.703
  515    H2     A  48           H2         A  48  12.012   6.465   7.248
  516   1H5*    G  49          1H5*        G  49  16.389  10.663  10.536
  517   2H5*    G  49          2H5*        G  49  16.287  12.415  10.387
  518    H4*    G  49           H4*        G  49  16.287  11.328   8.207
  519    H3*    G  49           H3*        G  49  13.609  12.608   8.866
  520    H2*    G  49           H2*        G  49  13.093  12.147   6.516
  521   2HO*    G  49          2HO*        G  49  15.511  12.439   5.909
  522    H1*    G  49           H1*        G  49  13.921   9.584   6.682
  523    H8     G  49           H8         G  49  12.602  10.184  10.161
  524    H1     G  49           H1         G  49   7.952   9.755   5.742
  525   1H2     G  49          1H2         G  49   8.779  10.074   3.773
  526   2H2     G  49          2H2         G  49  10.508  10.138   3.493
  527   1H5*    G  50          1H5*        G  50  14.461  13.949   5.132
  528   2H5*    G  50          2H5*        G  50  14.343  15.695   4.947
  529    H4*    G  50           H4*        G  50  13.096  14.514   3.201
  530    H3*    G  50           H3*        G  50  11.334  16.040   5.154
  531    H2*    G  50           H2*        G  50   9.519  15.520   3.596
  532   2HO*    G  50          2HO*        G  50  11.141  15.631   1.687
  533    H1*    G  50           H1*        G  50  10.235  12.902   3.341
  534    H8     G  50           H8         G  50  11.061  13.386   6.945
  535    H1     G  50           H1         G  50   4.732  13.026   5.812
  536   1H2     G  50          1H2         G  50   4.351  13.202   3.706
  537   2H2     G  50          2H2         G  50   5.611  13.623   2.563
  538   1H5*    U  51          1H5*        U  51  10.122  17.252   1.503
  539   2H5*    U  51          2H5*        U  51  10.296  18.971   1.158
  540    H4*    U  51           H4*        U  51   8.072  18.190   0.540
  541    H3*    U  51           H3*        U  51   8.567  20.420   2.179
  542    H2*    U  51           H2*        U  51   7.836  19.519   4.125
  543   2HO*    U  51          2HO*        U  51   5.163  19.905   3.200
  544    H1*    U  51           H1*        U  51   5.718  17.855   2.771
  545    H3     U  51           H3         U  51   4.525  16.254   6.766
  546    H5     U  51           H5         U  51   8.648  16.820   7.247
  547    H6     U  51           H6         U  51   8.785  17.443   4.876
  548   1H5*    G  52          1H5*        G  52   7.612  22.265  -2.039
  549   2H5*    G  52          2H5*        G  52   6.000  22.446  -2.716
  550    H4*    G  52           H4*        G  52   7.245  19.776  -1.936
  551    H3*    G  52           H3*        G  52   6.781  21.197  -4.580
  552    H2*    G  52           H2*        G  52   6.657  19.012  -5.587
  553   2HO*    G  52          2HO*        G  52   7.107  17.754  -3.059
  554    H1*    G  52           H1*        G  52   4.988  18.047  -3.640
  555    H8     G  52           H8         G  52   3.923  21.649  -4.067
  556    H1     G  52           H1         G  52   1.505  17.597  -8.436
  557   1H2     G  52          1H2         G  52   2.742  15.833  -8.576
  558   2H2     G  52          2H2         G  52   4.094  15.553  -7.498
  559   1H5*    C  53          1H5*        C  53   9.637  18.370  -5.750
  560   2H5*    C  53          2H5*        C  53  10.845  19.087  -6.830
  561    H4*    C  53           H4*        C  53   9.769  17.197  -7.906
  562    H3*    C  53           H3*        C  53   8.849  19.817  -9.139
  563    H2*    C  53           H2*        C  53   7.857  18.414 -10.847
  564   2HO*    C  53          2HO*        C  53   9.681  16.764 -10.666
  565    H1*    C  53           H1*        C  53   6.739  16.711  -9.027
  566   1H4     C  53          1H4         C  53   2.301  21.161  -9.855
  567   2H4     C  53          2H4         C  53   3.018  22.141  -8.595
  568    H5     C  53           H5         C  53   5.177  21.695  -7.652
  569    H6     C  53           H6         C  53   6.971  20.033  -7.523
  570   1H5*    C  54          1H5*        C  54  10.233  17.657 -12.450
  571   2H5*    C  54          2H5*        C  54  11.138  18.697 -13.554
  572    H4*    C  54           H4*        C  54   9.318  17.568 -14.707
  573    H3*    C  54           H3*        C  54   8.797  20.550 -14.421
  574    H2*    C  54           H2*        C  54   7.015  20.157 -16.007
  575   2HO*    C  54          2HO*        C  54   8.328  18.389 -17.144
  576    H1*    C  54           H1*        C  54   6.100  17.957 -14.667
  577   1H4     C  54          1H4         C  54   3.002  22.952 -12.220
  578   2H4     C  54          2H4         C  54   4.269  23.186 -11.039
  579    H5     C  54           H5         C  54   6.324  21.955 -11.050
  580    H6     C  54           H6         C  54   7.569  20.175 -12.182
  581   1H5*    C  55          1H5*        C  55   8.442  19.914 -18.499
  582   2H5*    C  55          2H5*        C  55   9.308  21.150 -19.419
  583    H4*    C  55           H4*        C  55   6.982  21.011 -20.133
  584    H3*    C  55           H3*        C  55   7.647  23.562 -18.630
  585    H2*    C  55           H2*        C  55   5.491  24.344 -19.300
  586   2HO*    C  55          2HO*        C  55   5.668  23.341 -21.507
  587    H1*    C  55           H1*        C  55   4.219  21.931 -18.826
  588   1H4     C  55          1H4         C  55   3.449  25.707 -13.733
  589   2H4     C  55          2H4         C  55   5.013  25.236 -13.107
  590    H5     C  55           H5         C  55   6.504  23.757 -14.265
  591    H6     C  55           H6         C  55   6.820  22.457 -16.318
  592   1H    MET 104          1H        MET 104  10.619 -16.312   2.403
  593    HA   MET 104           HA       MET 104  11.585 -13.567   1.834
  594   1HB   MET 104          1HB       MET 104  13.482 -14.818   2.925
  595   2HB   MET 104          2HB       MET 104  13.406 -16.015   1.640
  596   1HG   MET 104          1HG       MET 104  14.751 -14.771   0.382
  597   2HG   MET 104          2HG       MET 104  13.590 -13.450   0.358
  598   1HE   MET 104          1HE       MET 104  14.717 -11.161   3.286
  599   2HE   MET 104          2HE       MET 104  13.939 -11.141   1.695
  600   3HE   MET 104          3HE       MET 104  13.313 -12.209   2.975
  601    H    TYR 105           H        TYR 105  11.072 -13.025  -0.194
  602    HA   TYR 105           HA       TYR 105  10.338 -15.208  -2.120
  603   1HB   TYR 105          1HB       TYR 105   9.271 -12.404  -1.665
  604   2HB   TYR 105          2HB       TYR 105   9.004 -13.251  -3.190
  605    HD1  TYR 105           HD1      TYR 105   7.388 -14.900  -3.438
  606    HD2  TYR 105           HD2      TYR 105   8.504 -13.798   0.623
  607    HE1  TYR 105           HE1      TYR 105   5.671 -16.431  -2.519
  608    HE2  TYR 105           HE2      TYR 105   6.903 -15.459   1.495
  609    HH   TYR 105           HH       TYR 105   4.801 -17.408  -0.660
  610    H    VAL 106           H        VAL 106  11.590 -15.505  -3.842
  611    HA   VAL 106           HA       VAL 106  13.720 -13.459  -4.351
  612    HB   VAL 106           HB       VAL 106  13.676 -16.455  -4.871
  613   1HG1  VAL 106          1HG1      VAL 106  15.276 -15.377  -6.391
  614   2HG1  VAL 106          2HG1      VAL 106  16.013 -14.501  -5.028
  615   3HG1  VAL 106          3HG1      VAL 106  16.135 -16.267  -5.148
  616   1HG2  VAL 106          1HG2      VAL 106  13.698 -15.988  -2.470
  617   2HG2  VAL 106          2HG2      VAL 106  15.254 -16.626  -3.028
  618   3HG2  VAL 106          3HG2      VAL 106  15.075 -14.872  -2.700
  619    H    CYS 107           H        CYS 107  14.167 -12.686  -6.348
  620    HA   CYS 107           HA       CYS 107  12.344 -13.233  -8.572
  621   1HB   CYS 107          1HB       CYS 107  13.283 -10.951  -8.108
  622   2HB   CYS 107          2HB       CYS 107  14.900 -11.582  -8.420
  623    H    HIS 108           H        HIS 108  12.652 -14.692 -10.133
  624    HA   HIS 108           HA       HIS 108  15.269 -16.130 -10.202
  625   1HB   HIS 108          1HB       HIS 108  12.484 -17.066 -11.034
  626   2HB   HIS 108          2HB       HIS 108  13.962 -18.032 -11.140
  627    HD2  HIS 108           HD2      HIS 108  11.136 -18.065  -9.042
  628    HE1  HIS 108           HE1      HIS 108  14.212 -18.263  -6.081
  629    HE2  HIS 108           HE2      HIS 108  11.721 -18.599  -6.529
  630    H    PHE 109           H        PHE 109  14.432 -13.561 -11.648
  631    HA   PHE 109           HA       PHE 109  14.326 -14.141 -14.478
  632   1HB   PHE 109          1HB       PHE 109  13.991 -11.862 -13.147
  633   2HB   PHE 109          2HB       PHE 109  15.726 -11.693 -13.328
  634    HD1  PHE 109           HD1      PHE 109  12.470 -11.606 -14.909
  635    HD2  PHE 109           HD2      PHE 109  16.718 -11.351 -15.546
  636    HE1  PHE 109           HE1      PHE 109  12.035 -10.781 -17.221
  637    HE2  PHE 109           HE2      PHE 109  16.299 -10.498 -17.881
  638    HZ   PHE 109           HZ       PHE 109  13.948 -10.213 -18.701
  639    H    GLU 110           H        GLU 110  16.095 -14.006 -16.013
  640    HA   GLU 110           HA       GLU 110  18.133 -15.809 -15.419
  641   1HB   GLU 110          1HB       GLU 110  17.343 -15.181 -17.696
  642   2HB   GLU 110          2HB       GLU 110  18.196 -13.640 -17.575
  643   1HG   GLU 110          1HG       GLU 110  20.358 -14.853 -17.384
  644   2HG   GLU 110          2HG       GLU 110  19.502 -16.397 -17.405
  645    H    ASN 111           H        ASN 111  19.715 -15.635 -13.937
  646    HA   ASN 111           HA       ASN 111  21.736 -14.973 -13.030
  647   1HB   ASN 111          1HB       ASN 111  22.210 -14.259 -15.496
  648   2HB   ASN 111          2HB       ASN 111  21.868 -12.613 -14.960
  649   1HD2  ASN 111          1HD2      ASN 111  23.949 -11.772 -15.187
  650   2HD2  ASN 111          2HD2      ASN 111  25.306 -12.370 -14.242
  651    H    CYS 112           H        CYS 112  18.932 -13.625 -12.458
  652    HA   CYS 112           HA       CYS 112  19.720 -11.027 -11.329
  653   1HB   CYS 112          1HB       CYS 112  17.543 -11.319 -12.390
  654   2HB   CYS 112          2HB       CYS 112  17.063 -12.533 -11.174
  655    H    GLY 113           H        GLY 113  17.775 -13.635  -9.759
  656   1HA   GLY 113          1HA       GLY 113  18.009 -14.732  -7.742
  657   2HA   GLY 113          2HA       GLY 113  19.721 -14.273  -7.767
  658    H    LYS 114           H        LYS 114  17.558 -11.537  -7.910
  659    HA   LYS 114           HA       LYS 114  18.410 -10.569  -5.305
  660   1HB   LYS 114          1HB       LYS 114  17.644  -9.306  -7.463
  661   2HB   LYS 114          2HB       LYS 114  16.014  -9.476  -6.801
  662   1HG   LYS 114          1HG       LYS 114  16.630  -8.167  -4.842
  663   2HG   LYS 114          2HG       LYS 114  18.366  -8.280  -5.242
  664   1HD   LYS 114          1HD       LYS 114  18.024  -6.980  -7.297
  665   2HD   LYS 114          2HD       LYS 114  16.292  -6.952  -6.982
  666   1HE   LYS 114          1HE       LYS 114  17.161  -4.831  -6.498
  667   2HE   LYS 114          2HE       LYS 114  16.593  -5.581  -4.996
  668   1HZ   LYS 114          1HZ       LYS 114  18.767  -4.504  -4.706
  669   2HZ   LYS 114          2HZ       LYS 114  18.919  -6.107  -4.459
  670   3HZ   LYS 114          3HZ       LYS 114  19.442  -5.437  -5.859
  671    H    ALA 115           H        ALA 115  17.285 -10.409  -3.357
  672    HA   ALA 115           HA       ALA 115  14.823 -12.113  -3.163
  673   1HB   ALA 115          1HB       ALA 115  16.848 -13.220  -2.289
  674   2HB   ALA 115          2HB       ALA 115  17.110 -11.866  -1.157
  675   3HB   ALA 115          3HB       ALA 115  15.665 -12.899  -1.018
  676    H    PHE 116           H        PHE 116  13.121 -11.398  -1.973
  677    HA   PHE 116           HA       PHE 116  13.389  -8.715  -0.664
  678   1HB   PHE 116          1HB       PHE 116  10.936  -9.739  -2.147
  679   2HB   PHE 116          2HB       PHE 116  11.250  -8.143  -1.533
  680    HD1  PHE 116           HD1      PHE 116  12.238 -10.602  -4.142
  681    HD2  PHE 116           HD2      PHE 116  12.520  -6.508  -2.827
  682    HE1  PHE 116           HE1      PHE 116  13.532 -10.070  -6.160
  683    HE2  PHE 116           HE2      PHE 116  13.828  -5.967  -4.890
  684    HZ   PHE 116           HZ       PHE 116  14.364  -7.801  -6.519
  685    H    LYS 117           H        LYS 117  11.951  -8.240   1.052
  686    HA   LYS 117           HA       LYS 117  11.391 -10.377   2.867
  687   1HB   LYS 117          1HB       LYS 117  11.779  -7.979   3.468
  688   2HB   LYS 117          2HB       LYS 117  10.205  -7.554   2.790
  689   1HG   LYS 117          1HG       LYS 117   9.078  -8.993   4.470
  690   2HG   LYS 117          2HG       LYS 117  10.694  -9.460   5.080
  691   1HD   LYS 117          1HD       LYS 117  11.054  -6.922   5.465
  692   2HD   LYS 117          2HD       LYS 117   9.288  -6.765   5.238
  693   1HE   LYS 117          1HE       LYS 117   8.894  -8.377   7.057
  694   2HE   LYS 117          2HE       LYS 117  10.615  -8.733   7.159
  695   1HZ   LYS 117          1HZ       LYS 117  10.056  -7.262   8.873
  696   2HZ   LYS 117          2HZ       LYS 117  10.978  -6.397   7.785
  697   3HZ   LYS 117          3HZ       LYS 117   9.351  -6.152   7.866
  698    H    LYS 118           H        LYS 118   9.310  -8.558   0.558
  699    HA   LYS 118           HA       LYS 118   7.124 -10.563   1.068
  700   1HB   LYS 118          1HB       LYS 118   6.802  -7.563   0.623
  701   2HB   LYS 118          2HB       LYS 118   5.498  -8.687   0.906
  702   1HG   LYS 118          1HG       LYS 118   7.724  -8.136   2.928
  703   2HG   LYS 118          2HG       LYS 118   6.235  -7.218   2.870
  704   1HD   LYS 118          1HD       LYS 118   4.890  -8.960   3.558
  705   2HD   LYS 118          2HD       LYS 118   6.024 -10.189   3.004
  706   1HE   LYS 118          1HE       LYS 118   5.573  -9.999   5.497
  707   2HE   LYS 118          2HE       LYS 118   7.227 -10.268   4.910
  708   1HZ   LYS 118          1HZ       LYS 118   7.472  -7.769   5.243
  709   2HZ   LYS 118          2HZ       LYS 118   6.028  -7.842   6.045
  710   3HZ   LYS 118          3HZ       LYS 118   7.254  -8.699   6.617
  711    H    HIS 119           H        HIS 119   5.820 -11.142  -0.689
  712    HA   HIS 119           HA       HIS 119   7.178 -11.245  -3.192
  713   1HB   HIS 119          1HB       HIS 119   5.143 -12.290  -4.066
  714   2HB   HIS 119          2HB       HIS 119   5.672 -12.964  -2.555
  715    HD1  HIS 119           HD1      HIS 119   2.852 -10.331  -3.419
  716    HD2  HIS 119           HD2      HIS 119   3.818 -13.836  -1.274
  717    HE1  HIS 119           HE1      HIS 119   0.676 -11.098  -2.221
  718    HE2  HIS 119           HE2      HIS 119   1.290 -13.204  -0.948
  719    H    ASN 120           H        ASN 120   4.781  -8.933  -1.962
  720    HA   ASN 120           HA       ASN 120   4.069  -7.791  -4.506
  721   1HB   ASN 120          1HB       ASN 120   3.897  -6.911  -1.614
  722   2HB   ASN 120          2HB       ASN 120   3.743  -5.678  -2.870
  723   1HD2  ASN 120          1HD2      ASN 120   1.842  -7.856  -1.100
  724   2HD2  ASN 120          2HD2      ASN 120   0.550  -7.997  -2.303
  725    H    GLN 121           H        GLN 121   6.911  -7.363  -2.384
  726    HA   GLN 121           HA       GLN 121   7.988  -5.069  -3.880
  727   1HB   GLN 121          1HB       GLN 121   9.588  -6.993  -2.205
  728   2HB   GLN 121          2HB       GLN 121   9.911  -5.293  -2.605
  729   1HG   GLN 121          1HG       GLN 121   8.150  -4.565  -1.098
  730   2HG   GLN 121          2HG       GLN 121   7.773  -6.261  -0.710
  731   1HE2  GLN 121          1HE2      GLN 121   9.494  -3.625   0.484
  732   2HE2  GLN 121          2HE2      GLN 121  10.643  -4.538   1.446
  733    H    LEU 122           H        LEU 122   8.415  -8.651  -3.850
  734    HA   LEU 122           HA       LEU 122  10.396  -8.837  -5.869
  735   1HB   LEU 122          1HB       LEU 122   9.758 -10.751  -4.529
  736   2HB   LEU 122          2HB       LEU 122   8.102 -10.668  -5.065
  737    HG   LEU 122           HG       LEU 122   8.667 -11.415  -7.294
  738   1HD1  LEU 122          1HD1      LEU 122  10.984 -10.455  -7.360
  739   2HD1  LEU 122          2HD1      LEU 122  11.464 -11.703  -6.172
  740   3HD1  LEU 122          3HD1      LEU 122  10.868 -12.154  -7.798
  741   1HD2  LEU 122          1HD2      LEU 122   9.920 -13.213  -5.139
  742   2HD2  LEU 122          2HD2      LEU 122   8.188 -13.129  -5.536
  743   3HD2  LEU 122          3HD2      LEU 122   9.356 -13.711  -6.736
  744    H    LYS 123           H        LYS 123   6.800  -8.922  -6.180
  745    HA   LYS 123           HA       LYS 123   6.571  -8.886  -8.973
  746   1HB   LYS 123          1HB       LYS 123   4.723  -9.108  -7.306
  747   2HB   LYS 123          2HB       LYS 123   4.851  -7.389  -6.952
  748   1HG   LYS 123          1HG       LYS 123   4.268  -6.975  -9.423
  749   2HG   LYS 123          2HG       LYS 123   3.852  -8.694  -9.506
  750   1HD   LYS 123          1HD       LYS 123   2.662  -6.604  -7.630
  751   2HD   LYS 123          2HD       LYS 123   1.865  -7.269  -9.052
  752   1HE   LYS 123          1HE       LYS 123   1.626  -9.434  -8.047
  753   2HE   LYS 123          2HE       LYS 123   2.737  -9.038  -6.731
  754   1HZ   LYS 123          1HZ       LYS 123   0.388  -8.923  -6.053
  755   2HZ   LYS 123          2HZ       LYS 123   1.154  -7.511  -5.819
  756   3HZ   LYS 123          3HZ       LYS 123   0.121  -7.689  -7.090
  757    H    VAL 124           H        VAL 124   6.963  -6.087  -6.731
  758    HA   VAL 124           HA       VAL 124   6.903  -4.004  -8.678
  759    HB   VAL 124           HB       VAL 124   8.163  -4.320  -5.958
  760   1HG1  VAL 124          1HG1      VAL 124   8.705  -1.902  -5.908
  761   2HG1  VAL 124          2HG1      VAL 124   9.783  -2.818  -6.960
  762   3HG1  VAL 124          3HG1      VAL 124   8.479  -1.834  -7.669
  763   1HG2  VAL 124          1HG2      VAL 124   6.441  -2.958  -5.273
  764   2HG2  VAL 124          2HG2      VAL 124   6.255  -2.246  -6.914
  765   3HG2  VAL 124          3HG2      VAL 124   5.671  -3.887  -6.541
  766    H    HIS 125           H        HIS 125   9.629  -6.042  -7.506
  767    HA   HIS 125           HA       HIS 125  11.648  -4.636  -8.941
  768   1HB   HIS 125          1HB       HIS 125  12.201  -6.030  -7.072
  769   2HB   HIS 125          2HB       HIS 125  11.490  -7.461  -7.818
  770    HD1  HIS 125           HD1      HIS 125  14.539  -5.146  -8.304
  771    HD2  HIS 125           HD2      HIS 125  12.933  -8.880  -9.423
  772    HE1  HIS 125           HE1      HIS 125  16.406  -6.392  -9.495
  773    H    GLN 126           H        GLN 126   9.775  -7.630  -9.745
  774    HA   GLN 126           HA       GLN 126  11.177  -8.186 -12.170
  775   1HB   GLN 126          1HB       GLN 126   8.408  -8.995 -11.177
  776   2HB   GLN 126          2HB       GLN 126   9.103  -9.537 -12.738
  777   1HG   GLN 126          1HG       GLN 126  11.187 -10.231 -11.491
  778   2HG   GLN 126          2HG       GLN 126  10.396  -9.888  -9.963
  779   1HE2  GLN 126          1HE2      GLN 126  11.588 -12.277 -10.584
  780   2HE2  GLN 126          2HE2      GLN 126  10.326 -13.533 -10.694
  781    H    PHE 127           H        PHE 127   8.413  -6.060 -11.498
  782    HA   PHE 127           HA       PHE 127   7.525  -5.571 -14.133
  783   1HB   PHE 127          1HB       PHE 127   6.194  -4.236 -13.092
  784   2HB   PHE 127          2HB       PHE 127   6.997  -4.586 -11.617
  785    HD1  PHE 127           HD1      PHE 127   7.646  -2.070 -14.487
  786    HD2  PHE 127           HD2      PHE 127   7.074  -2.816 -10.297
  787    HE1  PHE 127           HE1      PHE 127   8.155   0.270 -14.009
  788    HE2  PHE 127           HE2      PHE 127   7.680  -0.579  -9.727
  789    HZ   PHE 127           HZ       PHE 127   8.331   1.057 -11.611
  790    H    SER 128           H        SER 128  10.491  -4.540 -12.503
  791    HA   SER 128           HA       SER 128  11.217  -2.441 -14.381
  792   1HB   SER 128          1HB       SER 128  12.149  -2.782 -12.053
  793   2HB   SER 128          2HB       SER 128  13.090  -4.152 -12.690
  794    HG   SER 128           HG       SER 128  14.261  -2.154 -12.716
  795    H    HIS 129           H        HIS 129  12.086  -5.959 -14.103
  796    HA   HIS 129           HA       HIS 129  13.799  -6.021 -16.421
  797   1HB   HIS 129          1HB       HIS 129  12.133  -8.226 -15.134
  798   2HB   HIS 129          2HB       HIS 129  13.327  -8.443 -16.390
  799    HD1  HIS 129           HD1      HIS 129  15.980  -7.956 -15.624
  800    HD2  HIS 129           HD2      HIS 129  12.979  -8.923 -12.874
  801    HE1  HIS 129           HE1      HIS 129  17.138  -9.008 -13.589
  802    H    THR 130           H        THR 130  10.289  -6.497 -15.969
  803    HA   THR 130           HA       THR 130   9.833  -7.273 -18.762
  804    HB   THR 130           HB       THR 130   7.436  -7.122 -18.140
  805    HG1  THR 130           HG1      THR 130   8.473  -6.020 -15.798
  806   1HG2  THR 130          1HG2      THR 130   8.846  -9.182 -17.379
  807   2HG2  THR 130          2HG2      THR 130   8.830  -8.459 -15.757
  808   3HG2  THR 130          3HG2      THR 130   7.306  -8.879 -16.535
  809    H    GLN 131           H        GLN 131  10.107  -4.301 -17.012
  810    HA   GLN 131           HA       GLN 131   9.756  -2.103 -17.503
  811   1HB   GLN 131          1HB       GLN 131  11.074  -3.036 -19.668
  812   2HB   GLN 131          2HB       GLN 131   9.561  -2.600 -20.469
  813   1HG   GLN 131          1HG       GLN 131  10.513  -0.514 -20.538
  814   2HG   GLN 131          2HG       GLN 131   9.926  -0.366 -18.881
  815   1HE2  GLN 131          1HE2      GLN 131  11.852  -1.797 -17.316
  816   2HE2  GLN 131          2HE2      GLN 131  13.398  -1.047 -17.619
  817    H    GLN 132           H        GLN 132   7.400  -3.863 -17.074
  818    HA   GLN 132           HA       GLN 132   5.417  -1.885 -18.138
  819   1HB   GLN 132          1HB       GLN 132   3.707  -3.596 -18.315
  820   2HB   GLN 132          2HB       GLN 132   5.044  -3.872 -19.418
  821   1HG   GLN 132          1HG       GLN 132   4.321  -5.995 -18.680
  822   2HG   GLN 132          2HG       GLN 132   5.868  -5.670 -17.925
  823   1HE2  GLN 132          1HE2      GLN 132   5.969  -5.995 -15.755
  824   2HE2  GLN 132          2HE2      GLN 132   4.574  -6.065 -14.665
  825    H    LEU 133           H        LEU 133   3.556  -1.582 -16.706
  826    HA   LEU 133           HA       LEU 133   4.562  -1.623 -13.943
  827   1HB   LEU 133          1HB       LEU 133   2.458  -0.025 -15.405
  828   2HB   LEU 133          2HB       LEU 133   2.562   0.062 -13.640
  829    HG   LEU 133           HG       LEU 133   5.056   0.468 -15.415
  830   1HD1  LEU 133          1HD1      LEU 133   3.347   2.153 -16.050
  831   2HD1  LEU 133          2HD1      LEU 133   3.167   2.605 -14.340
  832   3HD1  LEU 133          3HD1      LEU 133   4.709   2.877 -15.180
  833   1HD2  LEU 133          1HD2      LEU 133   4.467   1.413 -12.622
  834   2HD2  LEU 133          2HD2      LEU 133   5.414  -0.041 -13.012
  835   3HD2  LEU 133          3HD2      LEU 133   5.982   1.549 -13.532
  836    HA   PRO 134           HA       PRO 134   1.872  -4.909 -12.873
  837   1HB   PRO 134          1HB       PRO 134   2.248  -4.682 -10.078
  838   2HB   PRO 134          2HB       PRO 134   3.270  -5.603 -11.223
  839   1HG   PRO 134          1HG       PRO 134   3.872  -3.118  -9.786
  840   2HG   PRO 134          2HG       PRO 134   4.954  -4.174 -10.702
  841   1HD   PRO 134          1HD       PRO 134   3.866  -1.622 -11.480
  842   2HD   PRO 134          2HD       PRO 134   4.889  -2.733 -12.397
  843    H    TYR 135           H        TYR 135   1.468  -1.844 -11.076
  844    HA   TYR 135           HA       TYR 135  -1.181  -2.740 -10.093
  845   1HB   TYR 135          1HB       TYR 135   0.463  -0.274  -9.334
  846   2HB   TYR 135          2HB       TYR 135  -0.966  -0.857  -8.522
  847    HD1  TYR 135           HD1      TYR 135  -0.979  -3.019  -7.302
  848    HD2  TYR 135           HD2      TYR 135   2.652  -1.256  -8.844
  849    HE1  TYR 135           HE1      TYR 135   0.406  -4.590  -5.904
  850    HE2  TYR 135           HE2      TYR 135   4.015  -2.755  -7.385
  851    HH   TYR 135           HH       TYR 135   3.964  -4.578  -5.935
  852    H    GLU 136           H        GLU 136  -2.609  -2.449 -11.793
  853    HA   GLU 136           HA       GLU 136  -2.627   0.232 -13.116
  854   1HB   GLU 136          1HB       GLU 136  -3.885  -0.813 -14.893
  855   2HB   GLU 136          2HB       GLU 136  -2.380  -1.685 -14.607
  856   1HG   GLU 136          1HG       GLU 136  -3.694  -3.431 -13.357
  857   2HG   GLU 136          2HG       GLU 136  -5.179  -2.592 -13.839
  858    H    CYS 137           H        CYS 137  -4.455   1.494 -13.138
  859    HA   CYS 137           HA       CYS 137  -6.440   1.052 -11.049
  860   1HB   CYS 137          1HB       CYS 137  -5.679   3.281 -11.491
  861   2HB   CYS 137          2HB       CYS 137  -6.061   3.168 -13.186
  862    HA   PRO 138           HA       PRO 138  -8.995  -1.220 -13.935
  863   1HB   PRO 138          1HB       PRO 138 -10.554  -2.553 -12.173
  864   2HB   PRO 138          2HB       PRO 138  -8.780  -2.786 -12.171
  865   1HG   PRO 138          1HG       PRO 138 -10.411  -0.926 -10.388
  866   2HG   PRO 138          2HG       PRO 138  -9.183  -2.129  -9.888
  867   1HD   PRO 138          1HD       PRO 138  -8.629   0.564 -10.288
  868   2HD   PRO 138          2HD       PRO 138  -7.428  -0.744 -10.525
  869    H    HIS 139           H        HIS 139  -9.896   1.625 -12.475
  870    HA   HIS 139           HA       HIS 139 -12.760   1.465 -12.335
  871   1HB   HIS 139          1HB       HIS 139 -11.127   3.225 -11.345
  872   2HB   HIS 139          2HB       HIS 139 -11.203   4.008 -12.924
  873    HD2  HIS 139           HD2      HIS 139 -13.307   3.186  -9.802
  874    HE1  HIS 139           HE1      HIS 139 -15.638   5.924 -12.095
  875    HE2  HIS 139           HE2      HIS 139 -15.482   4.675  -9.881
  876    H    GLU 140           H        GLU 140 -14.382   2.262 -13.745
  877    HA   GLU 140           HA       GLU 140 -13.993   1.642 -16.523
  878   1HB   GLU 140          1HB       GLU 140 -16.153   1.443 -15.283
  879   2HB   GLU 140          2HB       GLU 140 -16.262   3.205 -15.194
  880   1HG   GLU 140          1HG       GLU 140 -16.331   3.323 -17.678
  881   2HG   GLU 140          2HG       GLU 140 -16.132   1.574 -17.773
  882    H    GLY 141           H        GLY 141 -13.094   2.844 -18.098
  883   1HA   GLY 141          1HA       GLY 141 -12.857   4.769 -19.452
  884   2HA   GLY 141          2HA       GLY 141 -13.544   5.767 -18.158
  885    H    CYS 142           H        CYS 142 -11.239   3.813 -16.711
  886    HA   CYS 142           HA       CYS 142  -9.090   5.870 -17.053
  887   1HB   CYS 142          1HB       CYS 142 -10.353   5.563 -14.791
  888   2HB   CYS 142          2HB       CYS 142  -9.452   4.062 -14.654
  889    H    ASP 143           H        ASP 143  -6.873   5.099 -16.953
  890    HA   ASP 143           HA       ASP 143  -6.395   2.195 -17.281
  891   1HB   ASP 143          1HB       ASP 143  -7.113   3.217 -19.546
  892   2HB   ASP 143          2HB       ASP 143  -5.601   4.119 -19.506
  893    H    LYS 144           H        LYS 144  -5.514   4.771 -15.628
  894    HA   LYS 144           HA       LYS 144  -2.677   5.109 -16.150
  895   1HB   LYS 144          1HB       LYS 144  -4.072   5.504 -13.465
  896   2HB   LYS 144          2HB       LYS 144  -2.594   6.266 -14.052
  897   1HG   LYS 144          1HG       LYS 144  -4.273   7.216 -15.936
  898   2HG   LYS 144          2HG       LYS 144  -5.447   6.862 -14.658
  899   1HD   LYS 144          1HD       LYS 144  -4.007   8.316 -13.113
  900   2HD   LYS 144          2HD       LYS 144  -3.227   8.897 -14.606
  901   1HE   LYS 144          1HE       LYS 144  -5.521   9.402 -15.540
  902   2HE   LYS 144          2HE       LYS 144  -6.227   8.853 -14.021
  903   1HZ   LYS 144          1HZ       LYS 144  -6.128  11.152 -13.824
  904   2HZ   LYS 144          2HZ       LYS 144  -4.804  10.708 -12.971
  905   3HZ   LYS 144          3HZ       LYS 144  -4.683  11.318 -14.513
  906    H    ARG 145           H        ARG 145  -0.875   4.194 -15.097
  907    HA   ARG 145           HA       ARG 145  -1.386   1.824 -13.332
  908   1HB   ARG 145          1HB       ARG 145   0.710   1.772 -15.553
  909   2HB   ARG 145          2HB       ARG 145   0.144   0.469 -14.457
  910   1HG   ARG 145          1HG       ARG 145  -2.129   0.685 -15.499
  911   2HG   ARG 145          2HG       ARG 145  -1.412   1.719 -16.735
  912   1HD   ARG 145          1HD       ARG 145  -0.072  -0.077 -17.601
  913   2HD   ARG 145          2HD       ARG 145  -0.349  -1.068 -16.163
  914    HE   ARG 145           HE       ARG 145  -2.379  -1.794 -17.005
  915   1HH1  ARG 145          1HH1      ARG 145  -1.582   1.036 -18.942
  916   2HH1  ARG 145          2HH1      ARG 145  -3.168   1.034 -19.678
  917   1HH2  ARG 145          1HH2      ARG 145  -4.210  -1.754 -17.939
  918   2HH2  ARG 145          2HH2      ARG 145  -4.659  -0.461 -19.070
  919    H    PHE 146           H        PHE 146   0.266   1.311 -11.903
  920    HA   PHE 146           HA       PHE 146   2.199   3.537 -11.423
  921   1HB   PHE 146          1HB       PHE 146   0.486   2.185  -9.287
  922   2HB   PHE 146          2HB       PHE 146   1.523   3.572  -9.115
  923    HD1  PHE 146           HD1      PHE 146  -1.752   2.469 -10.468
  924    HD2  PHE 146           HD2      PHE 146   0.970   5.790  -9.990
  925    HE1  PHE 146           HE1      PHE 146  -3.524   4.001 -11.146
  926    HE2  PHE 146           HE2      PHE 146  -0.805   7.333 -10.792
  927    HZ   PHE 146           HZ       PHE 146  -3.021   6.441 -11.437
  928    H    SER 147           H        SER 147   3.896   3.030  -9.892
  929    HA   SER 147           HA       SER 147   5.018   0.419 -10.558
  930   1HB   SER 147          1HB       SER 147   6.133   2.634  -8.776
  931   2HB   SER 147          2HB       SER 147   7.074   1.368  -9.535
  932    HG   SER 147           HG       SER 147   6.443   2.288 -11.584
  933    H    LEU 148           H        LEU 148   3.474   1.897  -7.745
  934    HA   LEU 148           HA       LEU 148   4.033  -0.588  -6.177
  935   1HB   LEU 148          1HB       LEU 148   4.611   2.269  -5.434
  936   2HB   LEU 148          2HB       LEU 148   3.944   1.263  -4.180
  937    HG   LEU 148           HG       LEU 148   6.316   1.470  -3.962
  938   1HD1  LEU 148          1HD1      LEU 148   5.385  -1.300  -4.723
  939   2HD1  LEU 148          2HD1      LEU 148   6.967  -0.999  -3.959
  940   3HD1  LEU 148          3HD1      LEU 148   5.483  -0.584  -3.099
  941   1HD2  LEU 148          1HD2      LEU 148   7.951   0.669  -5.462
  942   2HD2  LEU 148          2HD2      LEU 148   6.749  -0.064  -6.522
  943   3HD2  LEU 148          3HD2      LEU 148   6.875   1.713  -6.411
  944    HA   PRO 149           HA       PRO 149  -0.303  -0.619  -5.432
  945   1HB   PRO 149          1HB       PRO 149  -0.440  -1.643  -2.829
  946   2HB   PRO 149          2HB       PRO 149  -0.119  -2.590  -4.298
  947   1HG   PRO 149          1HG       PRO 149   1.839  -1.602  -2.245
  948   2HG   PRO 149          2HG       PRO 149   1.818  -3.157  -3.156
  949   1HD   PRO 149          1HD       PRO 149   3.458  -1.064  -3.836
  950   2HD   PRO 149          2HD       PRO 149   2.833  -2.198  -4.984
  951    H    SER 150           H        SER 150   1.716   0.943  -2.938
  952    HA   SER 150           HA       SER 150  -0.320   2.406  -1.565
  953   1HB   SER 150          1HB       SER 150   1.577   3.980  -1.003
  954   2HB   SER 150          2HB       SER 150   1.917   2.276  -0.648
  955    HG   SER 150           HG       SER 150   3.579   3.576  -1.839
  956    H    ARG 151           H        ARG 151   1.450   3.042  -4.597
  957    HA   ARG 151           HA       ARG 151   0.507   5.781  -4.891
  958   1HB   ARG 151          1HB       ARG 151   1.559   3.909  -7.029
  959   2HB   ARG 151          2HB       ARG 151   1.531   5.674  -7.097
  960   1HG   ARG 151          1HG       ARG 151   3.194   3.904  -5.274
  961   2HG   ARG 151          2HG       ARG 151   3.785   4.779  -6.675
  962   1HD   ARG 151          1HD       ARG 151   3.658   6.881  -5.547
  963   2HD   ARG 151          2HD       ARG 151   2.556   6.251  -4.321
  964    HE   ARG 151           HE       ARG 151   4.299   5.445  -3.077
  965   1HH1  ARG 151          1HH1      ARG 151   5.728   6.114  -6.226
  966   2HH1  ARG 151          2HH1      ARG 151   7.258   5.446  -5.727
  967   1HH2  ARG 151          1HH2      ARG 151   6.096   4.645  -2.567
  968   2HH2  ARG 151          2HH2      ARG 151   7.492   4.603  -3.654
  969    H    LEU 152           H        LEU 152  -0.515   2.574  -6.150
  970    HA   LEU 152           HA       LEU 152  -2.632   3.576  -7.853
  971   1HB   LEU 152          1HB       LEU 152  -1.718   1.335  -8.116
  972   2HB   LEU 152          2HB       LEU 152  -2.148   0.919  -6.451
  973    HG   LEU 152           HG       LEU 152  -4.530   0.993  -6.981
  974   1HD1  LEU 152          1HD1      LEU 152  -3.667   1.632  -9.834
  975   2HD1  LEU 152          2HD1      LEU 152  -5.316   1.261  -9.284
  976   3HD1  LEU 152          3HD1      LEU 152  -4.541   2.751  -8.768
  977   1HD2  LEU 152          1HD2      LEU 152  -3.104  -1.076  -7.397
  978   2HD2  LEU 152          2HD2      LEU 152  -4.625  -0.992  -8.323
  979   3HD2  LEU 152          3HD2      LEU 152  -3.085  -0.616  -9.111
  980    H    LYS 153           H        LYS 153  -2.507   2.330  -4.454
  981    HA   LYS 153           HA       LYS 153  -5.220   2.605  -3.765
  982   1HB   LYS 153          1HB       LYS 153  -3.534   1.587  -2.292
  983   2HB   LYS 153          2HB       LYS 153  -2.727   3.127  -2.113
  984   1HG   LYS 153          1HG       LYS 153  -5.129   3.865  -1.087
  985   2HG   LYS 153          2HG       LYS 153  -5.268   2.125  -0.856
  986   1HD   LYS 153          1HD       LYS 153  -4.365   3.085   1.158
  987   2HD   LYS 153          2HD       LYS 153  -3.041   2.203   0.374
  988   1HE   LYS 153          1HE       LYS 153  -2.220   4.365  -0.609
  989   2HE   LYS 153          2HE       LYS 153  -3.557   5.218   0.164
  990   1HZ   LYS 153          1HZ       LYS 153  -1.479   5.377   1.395
  991   2HZ   LYS 153          2HZ       LYS 153  -2.626   4.644   2.313
  992   3HZ   LYS 153          3HZ       LYS 153  -1.425   3.757   1.631
  993    H    ARG 154           H        ARG 154  -2.619   5.110  -3.607
  994    HA   ARG 154           HA       ARG 154  -4.368   7.229  -2.702
  995   1HB   ARG 154          1HB       ARG 154  -1.552   6.950  -3.583
  996   2HB   ARG 154          2HB       ARG 154  -2.298   8.457  -4.112
  997   1HG   ARG 154          1HG       ARG 154  -3.029   8.961  -1.810
  998   2HG   ARG 154          2HG       ARG 154  -2.357   7.429  -1.232
  999   1HD   ARG 154          1HD       ARG 154  -0.918   9.460  -0.767
 1000   2HD   ARG 154          2HD       ARG 154  -0.118   8.149  -1.675
 1001    HE   ARG 154           HE       ARG 154  -1.393  10.387  -3.171
 1002   1HH1  ARG 154          1HH1      ARG 154   1.700   8.872  -2.406
 1003   2HH1  ARG 154          2HH1      ARG 154   2.521   9.975  -3.487
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.372  11.539  -4.431
 1005   2HH2  ARG 154          2HH2      ARG 154   1.379  11.717  -4.255
 1006    H    HIS 155           H        HIS 155  -3.549   5.957  -5.930
 1007    HA   HIS 155           HA       HIS 155  -4.722   8.130  -7.418
 1008   1HB   HIS 155          1HB       HIS 155  -3.179   6.573  -8.487
 1009   2HB   HIS 155          2HB       HIS 155  -4.267   5.208  -8.197
 1010    HD1  HIS 155           HD1      HIS 155  -4.357   8.565 -10.085
 1011    HD2  HIS 155           HD2      HIS 155  -6.260   4.823  -9.847
 1012    HE1  HIS 155           HE1      HIS 155  -6.252   8.635 -11.795
 1013    H    GLU 156           H        GLU 156  -6.024   4.973  -6.228
 1014    HA   GLU 156           HA       GLU 156  -8.581   5.131  -7.408
 1015   1HB   GLU 156          1HB       GLU 156  -7.630   3.894  -4.787
 1016   2HB   GLU 156          2HB       GLU 156  -9.296   3.765  -5.345
 1017   1HG   GLU 156          1HG       GLU 156  -8.541   2.722  -7.456
 1018   2HG   GLU 156          2HG       GLU 156  -6.870   2.781  -6.902
 1019    H    LYS 157           H        LYS 157  -7.289   6.843  -4.571
 1020    HA   LYS 157           HA       LYS 157  -9.766   7.733  -3.412
 1021   1HB   LYS 157          1HB       LYS 157  -7.606   7.886  -2.243
 1022   2HB   LYS 157          2HB       LYS 157  -7.008   9.015  -3.451
 1023   1HG   LYS 157          1HG       LYS 157  -7.563  10.116  -1.364
 1024   2HG   LYS 157          2HG       LYS 157  -8.453  10.752  -2.742
 1025   1HD   LYS 157          1HD       LYS 157 -10.480   9.565  -2.042
 1026   2HD   LYS 157          2HD       LYS 157  -9.610   8.825  -0.678
 1027   1HE   LYS 157          1HE       LYS 157  -9.280  10.956   0.373
 1028   2HE   LYS 157          2HE       LYS 157  -9.727  11.837  -1.096
 1029   1HZ   LYS 157          1HZ       LYS 157 -11.650  10.143   0.395
 1030   2HZ   LYS 157          2HZ       LYS 157 -11.518  11.759   0.599
 1031   3HZ   LYS 157          3HZ       LYS 157 -11.968  11.166  -0.861
 1032    H    VAL 158           H        VAL 158  -7.959   8.759  -6.287
 1033    HA   VAL 158           HA       VAL 158  -9.125  11.342  -6.652
 1034    HB   VAL 158           HB       VAL 158  -8.273   9.356  -8.821
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.544  11.298  -9.712
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.380  12.381  -8.878
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.840  11.304 -10.194
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.749  11.685  -7.632
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.367   9.997  -7.212
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.146  10.567  -8.890
 1041    H    HIS 159           H        HIS 159 -10.206   8.065  -7.625
 1042    HA   HIS 159           HA       HIS 159 -12.590   9.022  -8.997
 1043   1HB   HIS 159          1HB       HIS 159 -11.704   6.262  -8.042
 1044   2HB   HIS 159          2HB       HIS 159 -13.201   6.564  -8.942
 1045    HD1  HIS 159           HD1      HIS 159 -12.544   8.179 -11.356
 1046    HD2  HIS 159           HD2      HIS 159  -9.702   5.644  -9.563
 1047    HE1  HIS 159           HE1      HIS 159 -10.689   7.822 -13.078
 1048    H    ALA 160           H        ALA 160 -11.795   7.985  -5.692
 1049    HA   ALA 160           HA       ALA 160 -14.536   7.737  -4.780
 1050   1HB   ALA 160          1HB       ALA 160 -11.992   8.309  -3.196
 1051   2HB   ALA 160          2HB       ALA 160 -13.534   7.736  -2.536
 1052   3HB   ALA 160          3HB       ALA 160 -12.592   6.690  -3.618
 1053    H    GLY 161           H        GLY 161 -12.290  10.433  -5.248
 1054   1HA   GLY 161          1HA       GLY 161 -12.977  12.672  -5.522
 1055   2HA   GLY 161          2HA       GLY 161 -14.509  12.304  -4.733
 1056    H    TYR 162           H        TYR 162 -13.319  14.623  -4.087
 1057    HA   TYR 162           HA       TYR 162 -12.181  14.107  -1.359
 1058   1HB   TYR 162          1HB       TYR 162 -11.538  16.423  -3.231
 1059   2HB   TYR 162          2HB       TYR 162 -10.854  16.168  -1.618
 1060    HD1  TYR 162           HD1      TYR 162 -11.101  14.853  -5.085
 1061    HD2  TYR 162           HD2      TYR 162  -8.929  14.617  -1.368
 1062    HE1  TYR 162           HE1      TYR 162  -9.603  13.190  -6.083
 1063    HE2  TYR 162           HE2      TYR 162  -7.240  13.145  -2.478
 1064    HH   TYR 162           HH       TYR 162  -6.565  12.185  -4.526
 1065    HA   PRO 163           HA       PRO 163 -16.106  16.297  -0.943
 1066   1HB   PRO 163          1HB       PRO 163 -16.999  15.130   1.362
 1067   2HB   PRO 163          2HB       PRO 163 -16.941  14.238  -0.189
 1068   1HG   PRO 163          1HG       PRO 163 -14.909  14.171   2.058
 1069   2HG   PRO 163          2HG       PRO 163 -15.657  12.792   1.192
 1070   1HD   PRO 163          1HD       PRO 163 -13.203  13.825   0.520
 1071   2HD   PRO 163          2HD       PRO 163 -14.319  13.128  -0.701
 1072    H    CYS 164           H        CYS 164 -16.785  18.093   0.183
 1073    HA   CYS 164           HA       CYS 164 -14.838  19.441   1.859
 1074   1HB   CYS 164          1HB       CYS 164 -16.639  20.410   0.184
 1075   2HB   CYS 164          2HB       CYS 164 -17.718  20.322   1.597
 1076    H    LYS 165           H        LYS 165 -14.857  19.847   4.005
 1077    HA   LYS 165           HA       LYS 165 -17.164  18.996   5.649
 1078   1HB   LYS 165          1HB       LYS 165 -15.381  17.110   5.491
 1079   2HB   LYS 165          2HB       LYS 165 -14.339  18.153   6.433
 1080   1HG   LYS 165          1HG       LYS 165 -15.478  16.404   7.761
 1081   2HG   LYS 165          2HG       LYS 165 -15.828  18.006   8.354
 1082   1HD   LYS 165          1HD       LYS 165 -17.818  16.553   8.397
 1083   2HD   LYS 165          2HD       LYS 165 -18.061  17.969   7.398
 1084   1HE   LYS 165          1HE       LYS 165 -19.040  16.115   6.252
 1085   2HE   LYS 165          2HE       LYS 165 -17.603  16.591   5.348
 1086   1HZ   LYS 165          1HZ       LYS 165 -17.749  14.176   5.633
 1087   2HZ   LYS 165          2HZ       LYS 165 -16.419  14.722   6.403
 1088   3HZ   LYS 165          3HZ       LYS 165 -17.751  14.310   7.258
 1089    H    LYS 166           H        LYS 166 -15.393  21.434   4.658
 1090    HA   LYS 166           HA       LYS 166 -14.304  22.646   7.060
 1091   1HB   LYS 166          1HB       LYS 166 -15.308  23.837   4.464
 1092   2HB   LYS 166          2HB       LYS 166 -14.439  24.762   5.690
 1093   1HG   LYS 166          1HG       LYS 166 -13.276  22.333   4.251
 1094   2HG   LYS 166          2HG       LYS 166 -13.073  24.007   3.722
 1095   1HD   LYS 166          1HD       LYS 166 -11.853  24.620   5.668
 1096   2HD   LYS 166          2HD       LYS 166 -12.203  23.072   6.477
 1097   1HE   LYS 166          1HE       LYS 166 -10.987  21.871   4.676
 1098   2HE   LYS 166          2HE       LYS 166 -10.587  23.414   3.915
 1099   1HZ   LYS 166          1HZ       LYS 166  -9.360  24.005   5.951
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.736  22.567   6.635
 1101   3HZ   LYS 166          3HZ       LYS 166  -8.773  22.613   5.318
 1102    H    ASP 167           H        ASP 167 -17.553  22.318   5.782
 1103    HA   ASP 167           HA       ASP 167 -18.599  23.647   8.209
 1104   1HB   ASP 167          1HB       ASP 167 -18.444  25.401   6.342
 1105   2HB   ASP 167          2HB       ASP 167 -19.639  24.456   5.456
 1106    H    ASP 168           H        ASP 168 -20.575  22.813   8.882
 1107    HA   ASP 168           HA       ASP 168 -21.211  20.179   8.037
 1108   1HB   ASP 168          1HB       ASP 168 -21.634  21.146  10.304
 1109   2HB   ASP 168          2HB       ASP 168 -22.930  22.132   9.625
 1110    H    SER 169           H        SER 169 -22.446  23.323   6.952
 1111    HA   SER 169           HA       SER 169 -24.740  22.058   5.540
 1112   1HB   SER 169          1HB       SER 169 -23.900  24.983   5.776
 1113   2HB   SER 169          2HB       SER 169 -25.391  24.387   5.033
 1114    HG   SER 169           HG       SER 169 -24.619  24.129   7.762
 1115    H    CYS 170           H        CYS 170 -21.724  21.818   4.782
 1116    HA   CYS 170           HA       CYS 170 -21.914  22.831   1.970
 1117   1HB   CYS 170          1HB       CYS 170 -19.816  23.149   3.590
 1118   2HB   CYS 170          2HB       CYS 170 -19.452  21.495   3.119
 1119    H    SER 171           H        SER 171 -21.274  21.263   0.251
 1120    HA   SER 171           HA       SER 171 -21.587  18.387   0.899
 1121   1HB   SER 171          1HB       SER 171 -23.532  18.118  -0.612
 1122   2HB   SER 171          2HB       SER 171 -23.910  19.158   0.766
 1123    HG   SER 171           HG       SER 171 -24.679  20.037  -1.213
 1124    H    PHE 172           H        PHE 172 -19.932  20.683  -0.738
 1125    HA   PHE 172           HA       PHE 172 -19.830  19.731  -3.438
 1126   1HB   PHE 172          1HB       PHE 172 -18.997  21.923  -2.968
 1127   2HB   PHE 172          2HB       PHE 172 -17.946  21.338  -1.685
 1128    HD1  PHE 172           HD1      PHE 172 -15.844  20.171  -2.142
 1129    HD2  PHE 172           HD2      PHE 172 -18.312  21.597  -5.365
 1130    HE1  PHE 172           HE1      PHE 172 -14.014  19.722  -3.743
 1131    HE2  PHE 172           HE2      PHE 172 -16.392  21.359  -6.935
 1132    HZ   PHE 172           HZ       PHE 172 -14.224  20.454  -6.113
 1133    H    VAL 173           H        VAL 173 -18.629  18.167  -4.435
 1134    HA   VAL 173           HA       VAL 173 -16.442  16.863  -2.878
 1135    HB   VAL 173           HB       VAL 173 -18.381  15.426  -4.726
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.203  13.367  -3.922
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.063  14.423  -4.753
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.083  14.366  -2.980
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.561  15.834  -2.684
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.971  14.173  -2.561
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.139  15.493  -1.691
 1142    H    GLY 174           H        GLY 174 -14.542  17.100  -3.870
 1143   1HA   GLY 174          1HA       GLY 174 -14.512  18.066  -6.666
 1144   2HA   GLY 174          2HA       GLY 174 -13.128  17.947  -5.565
 1145    H    LYS 175           H        LYS 175 -13.871  16.974  -8.465
 1146    HA   LYS 175           HA       LYS 175 -13.547  14.127  -8.436
 1147   1HB   LYS 175          1HB       LYS 175 -14.330  15.608 -10.355
 1148   2HB   LYS 175          2HB       LYS 175 -12.640  16.044 -10.634
 1149   1HG   LYS 175          1HG       LYS 175 -12.092  13.686 -11.113
 1150   2HG   LYS 175          2HG       LYS 175 -13.752  13.202 -10.706
 1151   1HD   LYS 175          1HD       LYS 175 -14.605  14.577 -12.588
 1152   2HD   LYS 175          2HD       LYS 175 -12.944  15.074 -12.979
 1153   1HE   LYS 175          1HE       LYS 175 -12.329  12.695 -13.360
 1154   2HE   LYS 175          2HE       LYS 175 -13.983  12.202 -12.977
 1155   1HZ   LYS 175          1HZ       LYS 175 -13.212  13.950 -15.257
 1156   2HZ   LYS 175          2HZ       LYS 175 -13.653  12.384 -15.373
 1157   3HZ   LYS 175          3HZ       LYS 175 -14.743  13.501 -14.898
 1158    H    THR 176           H        THR 176 -11.277  16.702  -7.851
 1159    HA   THR 176           HA       THR 176  -9.132  14.705  -7.471
 1160    HB   THR 176           HB       THR 176  -7.586  16.652  -8.561
 1161    HG1  THR 176           HG1      THR 176  -8.781  17.903  -9.686
 1162   1HG2  THR 176          1HG2      THR 176  -8.853  14.351 -10.074
 1163   2HG2  THR 176          2HG2      THR 176  -7.409  15.233 -10.562
 1164   3HG2  THR 176          3HG2      THR 176  -7.386  14.276  -9.064
 1165    H    TRP 177           H        TRP 177  -7.324  15.556  -6.215
 1166    HA   TRP 177           HA       TRP 177  -8.226  16.868  -3.915
 1167   1HB   TRP 177          1HB       TRP 177  -6.285  15.460  -3.884
 1168   2HB   TRP 177          2HB       TRP 177  -5.458  16.449  -5.061
 1169    HD1  TRP 177           HD1      TRP 177  -3.531  17.450  -4.036
 1170    HE1  TRP 177           HE1      TRP 177  -2.903  18.738  -1.886
 1171    HE3  TRP 177           HE3      TRP 177  -7.850  16.733  -1.455
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.860  18.656   0.816
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.884  17.163   0.989
 1174    HH2  TRP 177           HH2      TRP 177  -5.884  18.051   2.142
 1175    H    THR 178           H        THR 178  -6.507  18.264  -6.759
 1176    HA   THR 178           HA       THR 178  -6.099  20.887  -5.773
 1177    HB   THR 178           HB       THR 178  -6.467  21.550  -8.247
 1178    HG1  THR 178           HG1      THR 178  -6.087  18.960  -9.024
 1179   1HG2  THR 178          1HG2      THR 178  -4.304  19.526  -7.643
 1180   2HG2  THR 178          2HG2      THR 178  -4.354  20.639  -9.022
 1181   3HG2  THR 178          3HG2      THR 178  -4.236  21.273  -7.372
 1182    H    LEU 179           H        LEU 179  -8.957  19.560  -7.538
 1183    HA   LEU 179           HA       LEU 179 -10.406  21.970  -7.659
 1184   1HB   LEU 179          1HB       LEU 179 -11.464  19.111  -7.471
 1185   2HB   LEU 179          2HB       LEU 179 -12.417  20.516  -7.942
 1186    HG   LEU 179           HG       LEU 179 -10.044  19.375  -9.445
 1187   1HD1  LEU 179          1HD1      LEU 179 -13.013  19.488 -10.124
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.725  18.812 -11.148
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.103  18.052  -9.601
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.059  21.789  -9.830
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.694  20.980 -11.259
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.815  21.764 -10.126
 1193    H    TYR 180           H        TYR 180 -10.189  19.595  -5.012
 1194    HA   TYR 180           HA       TYR 180 -12.318  20.771  -3.415
 1195   1HB   TYR 180          1HB       TYR 180 -11.820  18.579  -2.845
 1196   2HB   TYR 180          2HB       TYR 180 -10.079  18.805  -2.934
 1197    HD1  TYR 180           HD1      TYR 180 -13.061  19.964  -0.923
 1198    HD2  TYR 180           HD2      TYR 180  -8.835  19.117  -0.985
 1199    HE1  TYR 180           HE1      TYR 180 -12.908  20.457   1.518
 1200    HE2  TYR 180           HE2      TYR 180  -8.715  19.494   1.469
 1201    HH   TYR 180           HH       TYR 180  -9.874  19.976   3.365
 1202    H    LEU 181           H        LEU 181  -8.721  20.948  -3.334
 1203    HA   LEU 181           HA       LEU 181  -8.529  22.844  -1.255
 1204   1HB   LEU 181          1HB       LEU 181  -6.774  22.262  -3.673
 1205   2HB   LEU 181          2HB       LEU 181  -6.355  23.475  -2.496
 1206    HG   LEU 181           HG       LEU 181  -6.778  20.478  -1.965
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.707  20.700  -3.061
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.316  22.230  -2.215
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.297  20.693  -1.345
 1210   1HD2  LEU 181          1HD2      LEU 181  -7.438  21.543   0.063
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.806  20.957   0.323
 1212   3HD2  LEU 181          3HD2      LEU 181  -6.092  22.693  -0.020
 1213    H    LYS 182           H        LYS 182  -8.928  23.395  -4.787
 1214    HA   LYS 182           HA       LYS 182  -8.815  26.273  -4.722
 1215   1HB   LYS 182          1HB       LYS 182 -10.141  24.288  -6.623
 1216   2HB   LYS 182          2HB       LYS 182 -10.259  26.032  -6.835
 1217   1HG   LYS 182          1HG       LYS 182  -7.726  26.148  -6.869
 1218   2HG   LYS 182          2HG       LYS 182  -7.707  24.380  -6.937
 1219   1HD   LYS 182          1HD       LYS 182  -9.241  24.552  -8.979
 1220   2HD   LYS 182          2HD       LYS 182  -9.001  26.307  -8.910
 1221   1HE   LYS 182          1HE       LYS 182  -6.464  25.788  -9.052
 1222   2HE   LYS 182          2HE       LYS 182  -6.948  24.139  -9.483
 1223   1HZ   LYS 182          1HZ       LYS 182  -7.487  26.654 -10.951
 1224   2HZ   LYS 182          2HZ       LYS 182  -6.730  25.325 -11.539
 1225   3HZ   LYS 182          3HZ       LYS 182  -8.332  25.280 -11.288
 1226    H    HIS 183           H        HIS 183 -11.569  23.959  -4.437
 1227    HA   HIS 183           HA       HIS 183 -13.640  25.915  -4.198
 1228   1HB   HIS 183          1HB       HIS 183 -14.267  23.651  -4.611
 1229   2HB   HIS 183          2HB       HIS 183 -13.364  23.022  -3.248
 1230    HD1  HIS 183           HD1      HIS 183 -16.679  24.867  -3.929
 1231    HD2  HIS 183           HD2      HIS 183 -14.446  23.134  -0.810
 1232    HE1  HIS 183           HE1      HIS 183 -18.205  24.826  -1.881
 1233    H    VAL 184           H        VAL 184 -11.524  24.356  -1.750
 1234    HA   VAL 184           HA       VAL 184 -12.763  25.500   0.565
 1235    HB   VAL 184           HB       VAL 184 -10.044  24.328  -0.039
 1236   1HG1  VAL 184          1HG1      VAL 184 -10.833  25.484   2.658
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.417  24.449   2.307
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.509  26.065   1.611
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.492  23.610   1.621
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.845  22.784   0.195
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.934  22.705   1.692
 1242    H    ALA 185           H        ALA 185 -10.010  26.590  -1.455
 1243    HA   ALA 185           HA       ALA 185  -9.338  28.806   0.170
 1244   1HB   ALA 185          1HB       ALA 185  -8.098  29.598  -1.824
 1245   2HB   ALA 185          2HB       ALA 185  -7.847  27.861  -1.562
 1246   3HB   ALA 185          3HB       ALA 185  -8.957  28.417  -2.836
 1247    H    GLU 186           H        GLU 186 -11.765  28.413  -2.391
 1248    HA   GLU 186           HA       GLU 186 -12.267  31.314  -2.587
 1249   1HB   GLU 186          1HB       GLU 186 -12.256  29.755  -4.555
 1250   2HB   GLU 186          2HB       GLU 186 -13.711  28.978  -3.922
 1251   1HG   GLU 186          1HG       GLU 186 -14.976  31.063  -4.196
 1252   2HG   GLU 186          2HG       GLU 186 -13.502  31.938  -4.627
 1253    H    CYS 187           H        CYS 187 -13.714  28.485  -0.994
 1254    HA   CYS 187           HA       CYS 187 -16.218  30.036  -0.462
 1255   1HB   CYS 187          1HB       CYS 187 -16.178  27.767  -1.708
 1256   2HB   CYS 187          2HB       CYS 187 -15.858  27.035  -0.129
 1257    HG   CYS 187           HG       CYS 187 -17.937  28.186   1.066
 1258    H    HIS 188           H        HIS 188 -13.445  28.649   1.210
 1259    HA   HIS 188           HA       HIS 188 -14.800  29.200   3.835
 1260   1HB   HIS 188          1HB       HIS 188 -12.996  26.826   3.217
 1261   2HB   HIS 188          2HB       HIS 188 -13.717  27.202   4.787
 1262    HD1  HIS 188           HD1      HIS 188 -16.589  27.159   4.733
 1263    HD2  HIS 188           HD2      HIS 188 -14.372  25.330   1.666
 1264    HE1  HIS 188           HE1      HIS 188 -18.170  25.490   3.609
 1265    H    GLN 189           H        GLN 189 -12.496  30.352   1.888
 1266    HA   GLN 189           HA       GLN 189 -10.877  31.317   4.182
 1267   1HB   GLN 189          1HB       GLN 189  -9.598  30.227   1.644
 1268   2HB   GLN 189          2HB       GLN 189  -8.750  30.984   2.979
 1269   1HG   GLN 189          1HG       GLN 189  -9.503  29.146   4.490
 1270   2HG   GLN 189          2HG       GLN 189 -10.188  28.304   3.097
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.971  27.486   4.954
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.605  27.155   3.897
 1273    H    ASP 190           H        ASP 190  -9.266  33.094   3.268
 1274    HA   ASP 190           HA       ASP 190 -10.368  34.594   0.968
 1275   1HB   ASP 190          1HB       ASP 190 -11.770  35.298   2.918
 1276   2HB   ASP 190          2HB       ASP 190 -10.313  35.782   3.784
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -7.210  30.523 -13.440
    2   2H5*    G   1          2H5*        G   1  -8.010  28.986 -13.069
    3    H4*    G   1           H4*        G   1  -7.357  29.083 -15.412
    4    H3*    G   1           H3*        G   1  -5.742  27.111 -13.778
    5    H2*    G   1           H2*        G   1  -4.871  26.338 -15.915
    6   2HO*    G   1          2HO*        G   1  -7.031  26.886 -17.033
    7    H1*    G   1           H1*        G   1  -4.267  28.831 -16.762
    8    H8     G   1           H8         G   1  -3.788  29.267 -13.067
    9    H1     G   1           H1         G   1   1.046  26.153 -15.946
   10   1H2     G   1          1H2         G   1   0.403  25.365 -17.858
   11   2H2     G   1          2H2         G   1  -1.156  25.779 -18.547
   12   1H5*    G   2          1H5*        G   2  -7.190  24.901 -16.946
   13   2H5*    G   2          2H5*        G   2  -7.845  23.341 -16.454
   14    H4*    G   2           H4*        G   2  -6.183  23.077 -18.212
   15    H3*    G   2           H3*        G   2  -5.288  22.016 -15.521
   16    H2*    G   2           H2*        G   2  -3.408  21.055 -16.735
   17   2HO*    G   2          2HO*        G   2  -4.848  20.712 -18.740
   18    H1*    G   2           H1*        G   2  -2.863  23.352 -18.074
   19    H8     G   2           H8         G   2  -4.142  24.624 -14.755
   20    H1     G   2           H1         G   2   1.857  22.320 -14.477
   21   1H2     G   2          1H2         G   2   2.229  21.021 -16.158
   22   2H2     G   2          2H2         G   2   1.091  20.860 -17.480
   23   1H5*    G   3          1H5*        G   3  -4.700  18.778 -18.153
   24   2H5*    G   3          2H5*        G   3  -5.371  17.285 -17.485
   25    H4*    G   3           H4*        G   3  -3.008  16.980 -18.099
   26    H3*    G   3           H3*        G   3  -3.625  16.958 -15.119
   27    H2*    G   3           H2*        G   3  -1.333  16.277 -14.818
   28   2HO*    G   3          2HO*        G   3  -1.500  14.937 -16.920
   29    H1*    G   3           H1*        G   3  -0.300  18.011 -16.681
   30    H8     G   3           H8         G   3  -3.008  19.926 -14.819
   31    H1     G   3           H1         G   3   2.593  19.521 -11.667
   32   1H2     G   3          1H2         G   3   3.749  17.875 -12.434
   33   2H2     G   3          2H2         G   3   3.277  17.003 -13.878
   34   1H5*    C   4          1H5*        C   4  -1.515  13.426 -15.418
   35   2H5*    C   4          2H5*        C   4  -2.316  12.140 -14.513
   36    H4*    C   4           H4*        C   4  -0.077  12.417 -13.674
   37    H3*    C   4           H3*        C   4  -2.163  13.491 -11.743
   38    H2*    C   4           H2*        C   4  -0.368  13.783 -10.209
   39   2HO*    C   4          2HO*        C   4   0.631  11.649 -10.939
   40    H1*    C   4           H1*        C   4   1.465  14.637 -12.137
   41   1H4     C   4          1H4         C   4  -0.884  19.595  -8.888
   42   2H4     C   4          2H4         C   4  -2.349  19.579  -9.841
   43    H5     C   4           H5         C   4  -2.777  17.966 -11.565
   44    H6     C   4           H6         C   4  -1.906  15.966 -12.676
   45   1H5*    C   5          1H5*        C   5  -1.120  12.151  -8.792
   46   2H5*    C   5          2H5*        C   5  -2.225  11.013  -8.036
   47    H4*    C   5           H4*        C   5  -1.634  13.027  -6.711
   48    H3*    C   5           H3*        C   5  -4.077  11.730  -6.608
   49    H2*    C   5           H2*        C   5  -5.097  13.233  -8.225
   50   2HO*    C   5          2HO*        C   5  -5.492  14.141  -5.570
   51    H1*    C   5           H1*        C   5  -3.874  15.539  -6.764
   52   1H4     C   5          1H4         C   5  -5.852  18.760 -11.823
   53   2H4     C   5          2H4         C   5  -5.534  17.423 -12.895
   54    H5     C   5           H5         C   5  -4.728  15.305 -12.130
   55    H6     C   5           H6         C   5  -4.136  13.992 -10.156
   56   1H5*    A   6          1H5*        A   6  -2.125  15.109  -4.394
   57   2H5*    A   6          2H5*        A   6  -0.748  14.007  -4.357
   58    H4*    A   6           H4*        A   6  -0.144  15.939  -3.302
   59    H3*    A   6           H3*        A   6  -0.482  13.680  -1.402
   60    H2*    A   6           H2*        A   6  -0.169  15.122   0.504
   61   2HO*    A   6          2HO*        A   6   1.542  16.436   0.026
   62    H1*    A   6           H1*        A   6  -1.471  17.331  -0.391
   63    H8     A   6           H8         A   6  -3.966  15.128  -1.753
   64   1H6     A   6          1H6         A   6  -6.014  14.098   4.011
   65   2H6     A   6          2H6         A   6  -6.296  13.776   2.317
   66    H2     A   6           H2         A   6  -2.165  16.281   4.314
   67   1H5*    U   7          1H5*        U   7   3.225  13.085   0.915
   68   2H5*    U   7          2H5*        U   7   2.208  14.407   0.360
   69    H4*    U   7           H4*        U   7   3.982  15.243   1.747
   70    H3*    U   7           H3*        U   7   3.324  16.426  -0.677
   71    H2*    U   7           H2*        U   7   5.070  15.316  -1.862
   72   2HO*    U   7          2HO*        U   7   5.865  17.865  -0.958
   73    H1*    U   7           H1*        U   7   6.929  15.884   0.478
   74    H3     U   7           H3         U   7  10.449  14.065  -1.610
   75    H5     U   7           H5         U   7   7.577  11.026  -1.648
   76    H6     U   7           H6         U   7   5.899  12.668  -0.951
   77   1H5*    A   8          1H5*        A   8   4.169  20.147  -0.705
   78   2H5*    A   8          2H5*        A   8   3.432  20.978   0.670
   79    H4*    A   8           H4*        A   8   2.685  22.084  -1.254
   80    H3*    A   8           H3*        A   8   0.846  21.115   0.512
   81    H2*    A   8           H2*        A   8   0.463  19.129  -0.822
   82   2HO*    A   8          2HO*        A   8  -1.621  20.066  -0.330
   83    H1*    A   8           H1*        A   8   0.242  21.056  -3.131
   84    H8     A   8           H8         A   8   2.437  17.907  -2.981
   85   1H6     A   8          1H6         A   8  -1.241  15.817  -7.517
   86   2H6     A   8          2H6         A   8   0.307  15.624  -6.730
   87    H2     A   8           H2         A   8  -3.115  19.464  -5.805
   88   1H5*    C   9          1H5*        C   9  -2.400  22.453  -0.386
   89   2H5*    C   9          2H5*        C   9  -2.744  23.967   0.457
   90    H4*    C   9           H4*        C   9  -4.297  22.324   1.179
   91    H3*    C   9           H3*        C   9  -2.298  23.022   3.305
   92    H2*    C   9           H2*        C   9  -3.477  21.498   4.763
   93   2HO*    C   9          2HO*        C   9  -5.604  22.171   3.528
   94    H1*    C   9           H1*        C   9  -3.769  19.487   2.961
   95   1H4     C   9          1H4         C   9   1.867  18.412   5.812
   96   2H4     C   9          2H4         C   9   2.651  18.941   4.335
   97    H5     C   9           H5         C   9   1.483  20.078   2.588
   98    H6     C   9           H6         C   9  -0.706  20.811   1.810
   99   1H5*    C  10          1H5*        C  10  -5.794  23.085   5.305
  100   2H5*    C  10          2H5*        C  10  -6.041  24.487   6.346
  101    H4*    C  10           H4*        C  10  -6.120  22.394   7.630
  102    H3*    C  10           H3*        C  10  -3.686  24.108   8.216
  103    H2*    C  10           H2*        C  10  -3.290  22.607  10.048
  104   2HO*    C  10          2HO*        C  10  -5.650  22.337  10.530
  105    H1*    C  10           H1*        C  10  -3.765  20.339   8.538
  106   1H4     C  10          1H4         C  10   2.482  21.053   7.991
  107   2H4     C  10          2H4         C  10   2.249  21.905   6.481
  108    H5     C  10           H5         C  10   0.099  22.635   5.699
  109    H6     C  10           H6         C  10  -2.301  22.636   6.197
  110   1H5*    U  11          1H5*        U  11  -5.104  24.321  12.142
  111   2H5*    U  11          2H5*        U  11  -4.705  25.922  12.784
  112    H4*    U  11           H4*        U  11  -3.485  23.960  13.817
  113    H3*    U  11           H3*        U  11  -1.875  26.145  12.507
  114    H2*    U  11           H2*        U  11   0.029  25.161  13.589
  115   2HO*    U  11          2HO*        U  11  -1.285  24.640  15.595
  116    H1*    U  11           H1*        U  11  -0.736  22.587  12.990
  117    H3     U  11           H3         U  11   2.916  23.506  10.375
  118    H5     U  11           H5         U  11  -0.240  25.412   8.389
  119    H6     U  11           H6         U  11  -1.694  24.870  10.292
  120   1H5*    C  12          1H5*        C  12  -0.182  27.040  16.741
  121   2H5*    C  12          2H5*        C  12   0.778  28.408  16.171
  122    H4*    C  12           H4*        C  12   1.349  25.449  16.137
  123    H3*    C  12           H3*        C  12   2.408  27.541  17.542
  124    H2*    C  12           H2*        C  12   3.033  28.775  15.588
  125   2HO*    C  12          2HO*        C  12   5.016  27.849  17.071
  126    H1*    C  12           H1*        C  12   4.259  26.219  14.499
  127   1H4     C  12          1H4         C  12   5.170  30.271   9.668
  128   2H4     C  12          2H4         C  12   3.487  30.740   9.668
  129    H5     C  12           H5         C  12   1.890  29.891  11.245
  130    H6     C  12           H6         C  12   1.584  28.402  13.170
  131   1H5*    U  13          1H5*        U  13   3.595  23.052  18.450
  132   2H5*    U  13          2H5*        U  13   4.385  23.063  20.030
  133    H4*    U  13           H4*        U  13   5.500  21.285  19.123
  134    H3*    U  13           H3*        U  13   7.207  23.496  19.064
  135    H2*    U  13           H2*        U  13   6.598  24.036  16.796
  136   2HO*    U  13          2HO*        U  13   8.950  22.430  16.836
  137    H1*    U  13           H1*        U  13   6.894  21.053  16.228
  138    H3     U  13           H3         U  13   6.595  21.940  11.788
  139    H5     U  13           H5         U  13   3.527  24.280  13.397
  140    H6     U  13           H6         U  13   4.218  23.555  15.640
  141   1H5*    U  14          1H5*        U  14  10.046  18.751  19.629
  142   2H5*    U  14          2H5*        U  14  11.489  19.586  19.056
  143    H4*    U  14           H4*        U  14   8.824  19.312  17.622
  144    H3*    U  14           H3*        U  14  11.260  17.773  17.553
  145    H2*    U  14           H2*        U  14  12.378  19.392  16.297
  146   2HO*    U  14          2HO*        U  14  10.954  17.696  14.523
  147    H1*    U  14           H1*        U  14   9.717  20.021  14.937
  148    H3     U  14           H3         U  14  12.026  22.615  11.975
  149    H5     U  14           H5         U  14  13.449  23.917  15.687
  150    H6     U  14           H6         U  14  12.120  22.149  16.760
  151   1H5*    G  15          1H5*        G  15   6.593  15.088  15.829
  152   2H5*    G  15          2H5*        G  15   7.077  16.612  15.063
  153    H4*    G  15           H4*        G  15   4.965  16.577  17.233
  154    H3*    G  15           H3*        G  15   4.612  15.957  14.293
  155    H2*    G  15           H2*        G  15   2.366  16.845  14.561
  156   2HO*    G  15          2HO*        G  15   2.179  16.056  16.872
  157    H1*    G  15           H1*        G  15   3.277  19.086  15.774
  158    H8     G  15           H8         G  15   6.180  18.453  13.522
  159    H1     G  15           H1         G  15   0.962  20.419  10.321
  160   1H2     G  15          1H2         G  15  -0.803  20.125  11.528
  161   2H2     G  15          2H2         G  15  -0.707  19.665  13.218
  162   1H5*    G  16          1H5*        G  16   1.009  14.565  15.836
  163   2H5*    G  16          2H5*        G  16   0.650  12.946  15.228
  164    H4*    G  16           H4*        G  16  -1.214  14.453  14.833
  165    H3*    G  16           H3*        G  16   0.215  13.646  12.284
  166    H2*    G  16           H2*        G  16  -1.655  14.701  11.149
  167   2HO*    G  16          2HO*        G  16  -3.241  14.005  12.878
  168    H1*    G  16           H1*        G  16  -1.555  16.945  12.666
  169    H8     G  16           H8         G  16   2.083  16.047  12.519
  170    H1     G  16           H1         G  16  -0.161  17.839   6.793
  171   1H2     G  16          1H2         G  16  -2.314  18.151   6.872
  172   2H2     G  16          2H2         G  16  -3.241  17.721   8.295
  173   1H5*    G  17          1H5*        G  17  -3.596  12.615  11.134
  174   2H5*    G  17          2H5*        G  17  -3.602  11.068  10.274
  175    H4*    G  17           H4*        G  17  -4.446  12.929   8.904
  176    H3*    G  17           H3*        G  17  -1.867  11.698   7.898
  177    H2*    G  17           H2*        G  17  -2.212  13.132   5.928
  178   2HO*    G  17          2HO*        G  17  -4.623  12.926   6.130
  179    H1*    G  17           H1*        G  17  -2.517  15.355   7.350
  180    H8     G  17           H8         G  17  -0.361  13.586   9.799
  181    H1     G  17           H1         G  17   2.840  15.809   4.691
  182   1H2     G  17          1H2         G  17   1.453  16.342   3.107
  183   2H2     G  17          2H2         G  17  -0.268  16.005   3.235
  184   1H5*    C  18          1H5*        C  18  -3.687  11.462   4.385
  185   2H5*    C  18          2H5*        C  18  -3.533   9.877   3.605
  186    H4*    C  18           H4*        C  18  -2.486  11.548   2.212
  187    H3*    C  18           H3*        C  18  -0.359   9.917   3.633
  188    H2*    C  18           H2*        C  18   1.224  11.061   2.111
  189   2HO*    C  18          2HO*        C  18   0.154  11.561   0.203
  190    H1*    C  18           H1*        C  18   0.313  13.411   2.808
  191   1H4     C  18          1H4         C  18   4.339  11.855   7.484
  192   2H4     C  18          2H4         C  18   2.986  11.377   8.478
  193    H5     C  18           H5         C  18   0.719  11.350   7.693
  194    H6     C  18           H6         C  18  -0.695  11.679   5.737
  195   1H5*    C  19          1H5*        C  19   0.996   9.759  -0.055
  196   2H5*    C  19          2H5*        C  19   1.445   8.118  -0.553
  197    H4*    C  19           H4*        C  19   3.251   9.674  -0.989
  198    H3*    C  19           H3*        C  19   3.775   7.688   1.251
  199    H2*    C  19           H2*        C  19   6.090   8.364   1.008
  200   2HO*    C  19          2HO*        C  19   5.765   8.683  -1.422
  201    H1*    C  19           H1*        C  19   5.491  11.034   1.021
  202   1H4     C  19          1H4         C  19   6.259   9.284   7.116
  203   2H4     C  19          2H4         C  19   4.564   8.876   7.236
  204    H5     C  19           H5         C  19   3.067   8.896   5.364
  205    H6     C  19           H6         C  19   2.870   9.446   2.986
  206   1H5*    U  20          1H5*        U  20   6.778   6.893  -1.388
  207   2H5*    U  20          2H5*        U  20   6.980   5.160  -1.668
  208    H4*    U  20           H4*        U  20   9.067   6.170  -0.936
  209    H3*    U  20           H3*        U  20   7.847   4.394   1.197
  210    H2*    U  20           H2*        U  20  10.045   4.544   2.222
  211   2HO*    U  20          2HO*        U  20  11.207   4.639   0.078
  212    H1*    U  20           H1*        U  20  10.130   7.248   1.918
  213    H3     U  20           H3         U  20   9.186   6.403   6.329
  214    H5     U  20           H5         U  20   5.464   6.180   4.436
  215    H6     U  20           H6         U  20   6.615   6.342   2.271
  216   1H5*    G  21          1H5*        G  21  11.570   2.728   0.258
  217   2H5*    G  21          2H5*        G  21  11.549   0.966   0.310
  218    H4*    G  21           H4*        G  21  13.310   1.877   1.712
  219    H3*    G  21           H3*        G  21  11.093   0.644   3.379
  220    H2*    G  21           H2*        G  21  12.715   0.828   5.192
  221   2HO*    G  21          2HO*        G  21  14.625   0.517   3.622
  222    H1*    G  21           H1*        G  21  13.214   3.428   4.614
  223    H8     G  21           H8         G  21   9.585   2.921   3.599
  224    H1     G  21           H1         G  21  10.445   3.195   9.970
  225   1H2     G  21          1H2         G  21  12.532   2.919  10.445
  226   2H2     G  21          2H2         G  21  13.769   2.865   9.206
  227   1H5*    G  22          1H5*        G  22  14.531  -1.206   4.504
  228   2H5*    G  22          2H5*        G  22  14.383  -2.958   4.600
  229    H4*    G  22           H4*        G  22  15.378  -2.058   6.619
  230    H3*    G  22           H3*        G  22  12.586  -3.158   7.051
  231    H2*    G  22           H2*        G  22  13.016  -2.910   9.394
  232   2HO*    G  22          2HO*        G  22  15.301  -3.549   9.303
  233    H1*    G  22           H1*        G  22  14.055  -0.398   9.138
  234    H8     G  22           H8         G  22  11.359  -0.459   6.502
  235    H1     G  22           H1         G  22   9.042  -0.042  12.494
  236   1H2     G  22          1H2         G  22  10.568  -0.570  13.920
  237   2H2     G  22          2H2         G  22  12.221  -0.909  13.436
  238   1H5*    U  23          1H5*        U  23  12.305  -7.335   9.466
  239   2H5*    U  23          2H5*        U  23  11.392  -5.869   9.047
  240    H4*    U  23           H4*        U  23  12.984  -6.184  11.594
  241    H3*    U  23           H3*        U  23  10.036  -6.348  10.873
  242    H2*    U  23           H2*        U  23   9.570  -5.785  13.136
  243   2HO*    U  23          2HO*        U  23  11.527  -6.886  14.048
  244    H1*    U  23           H1*        U  23  11.230  -3.638  13.004
  245    H3     U  23           H3         U  23   6.694  -2.631  12.360
  246    H5     U  23           H5         U  23   8.348  -2.947   8.535
  247    H6     U  23           H6         U  23  10.446  -3.722   9.560
  248   1H5*    U  24          1H5*        U  24   9.791  -8.432  13.838
  249   2H5*    U  24          2H5*        U  24   9.139 -10.069  13.751
  250    H4*    U  24           H4*        U  24   7.822  -8.758  15.293
  251    H3*    U  24           H3*        U  24   6.406  -9.197  12.661
  252    H2*    U  24           H2*        U  24   4.435  -8.389  13.673
  253   2HO*    U  24          2HO*        U  24   4.796  -9.367  15.824
  254    H1*    U  24           H1*        U  24   5.751  -6.261  14.845
  255    H3     U  24           H3         U  24   3.163  -4.832  11.267
  256    H5     U  24           H5         U  24   6.777  -6.066   9.541
  257    H6     U  24           H6         U  24   7.504  -6.875  11.743
  258   1H5*    A  25          1H5*        A  25   4.977 -13.244  11.394
  259   2H5*    A  25          2H5*        A  25   6.681 -13.556  11.124
  260    H4*    A  25           H4*        A  25   5.685 -13.142   9.000
  261    H3*    A  25           H3*        A  25   7.855 -11.514   9.744
  262    H2*    A  25           H2*        A  25   6.415  -9.687  10.363
  263   2HO*    A  25          2HO*        A  25   7.959  -8.834   8.938
  264    H1*    A  25           H1*        A  25   4.978 -10.506   7.767
  265    H8     A  25           H8         A  25   3.565  -9.431  11.260
  266   1H6     A  25          1H6         A  25   0.614  -5.037   7.951
  267   2H6     A  25          2H6         A  25   0.618  -5.915   9.470
  268    H2     A  25           H2         A  25   3.565  -7.051   5.301
  269   1H5*    G  26          1H5*        G  26   7.866 -14.713   4.822
  270   2H5*    G  26          2H5*        G  26   7.805 -12.995   4.505
  271    H4*    G  26           H4*        G  26   5.832 -13.568   6.539
  272    H3*    G  26           H3*        G  26   6.109 -15.905   4.950
  273    H2*    G  26           H2*        G  26   5.914 -14.514   3.035
  274   2HO*    G  26          2HO*        G  26   3.460 -15.900   3.528
  275    H1*    G  26           H1*        G  26   3.434 -13.471   4.485
  276    H8     G  26           H8         G  26   5.501 -13.282   1.287
  277    H1     G  26           H1         G  26   0.935  -8.820   1.753
  278   1H2     G  26          1H2         G  26   0.426  -8.546   3.828
  279   2H2     G  26          2H2         G  26   0.957  -9.653   5.083
  280   1H5*    U  27          1H5*        U  27   4.807 -16.258   8.184
  281   2H5*    U  27          2H5*        U  27   4.083 -17.835   8.572
  282    H4*    U  27           H4*        U  27   3.816 -16.708  10.574
  283    H3*    U  27           H3*        U  27   1.268 -16.041   9.033
  284    H2*    U  27           H2*        U  27   0.628 -14.637  10.866
  285   2HO*    U  27          2HO*        U  27   1.792 -16.247  12.419
  286    H1*    U  27           H1*        U  27   2.997 -13.392  11.164
  287    H3     U  27           H3         U  27   0.286 -10.501   8.848
  288    H5     U  27           H5         U  27   3.073 -12.069   6.171
  289    H6     U  27           H6         U  27   3.447 -13.929   7.730
  290   1H5*    A  28          1H5*        A  28  -0.324 -16.091  12.734
  291   2H5*    A  28          2H5*        A  28  -1.585 -17.320  12.811
  292    H4*    A  28           H4*        A  28  -2.505 -15.199  13.514
  293    H3*    A  28           H3*        A  28  -3.494 -16.039  10.762
  294    H2*    A  28           H2*        A  28  -4.941 -14.098  10.867
  295   2HO*    A  28          2HO*        A  28  -5.246 -14.391  13.295
  296    H1*    A  28           H1*        A  28  -2.998 -12.424  11.763
  297    H8     A  28           H8         A  28  -0.902 -14.424   9.460
  298   1H6     A  28          1H6         A  28  -3.254 -10.885   4.912
  299   2H6     A  28          2H6         A  28  -1.995 -12.040   5.315
  300    H2     A  28           H2         A  28  -6.125 -10.878   8.287
  301   1H5*    C  29          1H5*        C  29  -7.045 -15.255  12.049
  302   2H5*    C  29          2H5*        C  29  -8.244 -16.514  11.717
  303    H4*    C  29           H4*        C  29  -8.789 -14.501  10.477
  304    H3*    C  29           H3*        C  29  -7.762 -16.713   8.683
  305    H2*    C  29           H2*        C  29  -8.337 -15.236   6.824
  306   2HO*    C  29          2HO*        C  29 -10.305 -14.374   7.990
  307    H1*    C  29           H1*        C  29  -7.189 -13.065   7.874
  308   1H4     C  29          1H4         C  29  -2.456 -15.909   4.707
  309   2H4     C  29          2H4         C  29  -1.933 -16.674   6.189
  310    H5     C  29           H5         C  29  -3.199 -16.620   8.216
  311    H6     C  29           H6         C  29  -5.211 -15.724   9.271
  312   1H5*    C  30          1H5*        C  30 -11.410 -15.872   6.877
  313   2H5*    C  30          2H5*        C  30 -12.257 -17.343   6.375
  314    H4*    C  30           H4*        C  30 -11.779 -15.876   4.466
  315    H3*    C  30           H3*        C  30 -10.116 -18.410   4.432
  316    H2*    C  30           H2*        C  30  -9.509 -17.728   2.182
  317   2HO*    C  30          2HO*        C  30 -11.759 -16.699   1.865
  318    H1*    C  30           H1*        C  30  -9.021 -15.143   2.949
  319   1H4     C  30          1H4         C  30  -3.671 -18.624   3.303
  320   2H4     C  30          2H4         C  30  -4.041 -19.079   4.952
  321    H5     C  30           H5         C  30  -6.073 -18.445   6.068
  322    H6     C  30           H6         C  30  -8.208 -17.276   5.786
  323   1H5*    U  31          1H5*        U  31 -12.234 -18.176   0.687
  324   2H5*    U  31          2H5*        U  31 -13.149 -19.651   0.378
  325    H4*    U  31           H4*        U  31 -12.074 -18.895  -1.650
  326    H3*    U  31           H3*        U  31 -10.800 -21.414  -0.563
  327    H2*    U  31           H2*        U  31  -9.589 -21.512  -2.629
  328   2HO*    U  31          2HO*        U  31 -11.484 -20.662  -3.907
  329    H1*    U  31           H1*        U  31  -8.934 -18.854  -2.626
  330    H3     U  31           H3         U  31  -5.084 -21.135  -1.508
  331    H5     U  31           H5         U  31  -7.055 -20.432   2.125
  332    H6     U  31           H6         U  31  -9.042 -19.747   0.862
  333   1H5*    C  32          1H5*        C  32 -11.939 -22.867  -4.071
  334   2H5*    C  32          2H5*        C  32 -12.662 -24.478  -4.006
  335    H4*    C  32           H4*        C  32 -10.611 -24.537  -5.306
  336    H3*    C  32           H3*        C  32 -10.236 -25.872  -2.604
  337    H2*    C  32           H2*        C  32  -8.042 -26.483  -3.403
  338   2HO*    C  32          2HO*        C  32  -8.981 -26.769  -5.708
  339    H1*    C  32           H1*        C  32  -7.516 -24.027  -4.535
  340   1H4     C  32          1H4         C  32  -5.066 -24.240   1.354
  341   2H4     C  32          2H4         C  32  -6.617 -23.838   2.058
  342    H5     C  32           H5         C  32  -8.613 -23.540   0.760
  343    H6     C  32           H6         C  32  -9.539 -23.637  -1.505
  344   1H5*    U  33          1H5*        U  33  -8.357 -28.545  -4.586
  345   2H5*    U  33          2H5*        U  33  -9.047 -30.164  -4.451
  346    H4*    U  33           H4*        U  33  -6.721 -30.300  -3.807
  347    H3*    U  33           H3*        U  33  -8.561 -30.339  -1.396
  348    H2*    U  33           H2*        U  33  -6.754 -30.667  -0.052
  349   2HO*    U  33          2HO*        U  33  -4.793 -31.245  -2.069
  350    H1*    U  33           H1*        U  33  -4.959 -29.131  -1.611
  351    H3     U  33           H3         U  33  -4.933 -27.339   2.594
  352    H5     U  33           H5         U  33  -8.860 -26.687   1.311
  353    H6     U  33           H6         U  33  -8.315 -27.840  -0.787
  354   1H5*    U  34          1H5*        U  34  -8.671 -35.930  -0.518
  355   2H5*    U  34          2H5*        U  34  -7.943 -34.930   0.744
  356    H4*    U  34           H4*        U  34  -6.787 -37.067   0.515
  357    H3*    U  34           H3*        U  34  -5.401 -34.715   0.783
  358    H2*    U  34           H2*        U  34  -5.110 -34.398  -1.579
  359   2HO*    U  34          2HO*        U  34  -2.850 -35.807  -0.543
  360    H1*    U  34           H1*        U  34  -4.386 -37.351  -1.733
  361    H3     U  34           H3         U  34  -3.416 -36.992  -6.128
  362    H5     U  34           H5         U  34  -6.787 -34.540  -5.765
  363    H6     U  34           H6         U  34  -6.822 -35.035  -3.359
  364   1H5*    C  35          1H5*        C  35  -1.936 -34.879   1.495
  365   2H5*    C  35          2H5*        C  35  -1.569 -35.719   3.002
  366    H4*    C  35           H4*        C  35  -0.560 -33.509   2.931
  367    H3*    C  35           H3*        C  35  -1.755 -34.482   5.188
  368    H2*    C  35           H2*        C  35  -3.894 -33.526   4.683
  369   2HO*    C  35          2HO*        C  35  -2.429 -31.752   6.362
  370    H1*    C  35           H1*        C  35  -2.547 -30.900   3.968
  371   1H4     C  35          1H4         C  35  -8.738 -30.064   2.648
  372   2H4     C  35          2H4         C  35  -8.717 -31.407   1.517
  373    H5     C  35           H5         C  35  -6.822 -32.828   1.243
  374    H6     C  35           H6         C  35  -4.458 -33.116   1.776
  375   1H5*    G  36          1H5*        G  36   2.724 -31.215   5.047
  376   2H5*    G  36          2H5*        G  36   1.169 -31.299   4.200
  377    H4*    G  36           H4*        G  36   3.715 -32.719   3.326
  378    H3*    G  36           H3*        G  36   2.222 -30.299   2.243
  379    H2*    G  36           H2*        G  36   3.021 -30.918   0.098
  380   2HO*    G  36          2HO*        G  36   5.254 -31.399   1.179
  381    H1*    G  36           H1*        G  36   3.056 -33.698   0.688
  382    H8     G  36           H8         G  36   1.744 -34.220  -1.529
  383    H1     G  36           H1         G  36  -2.882 -29.960  -0.140
  384   1H2     G  36          1H2         G  36  -2.440 -28.926   1.675
  385   2H2     G  36          2H2         G  36  -0.968 -29.200   2.581
  386   1H5*    G  37          1H5*        G  37   4.777 -29.345   0.200
  387   2H5*    G  37          2H5*        G  37   5.237 -27.646   0.094
  388    H4*    G  37           H4*        G  37   3.914 -28.646  -1.861
  389    H3*    G  37           H3*        G  37   2.811 -26.168  -0.484
  390    H2*    G  37           H2*        G  37   1.263 -26.156  -2.400
  391   2HO*    G  37          2HO*        G  37   3.018 -27.185  -3.870
  392    H1*    G  37           H1*        G  37   0.622 -28.751  -2.107
  393    H8     G  37           H8         G  37   1.402 -27.347   1.380
  394    H1     G  37           H1         G  37  -4.182 -25.313  -1.060
  395   1H2     G  37          1H2         G  37  -4.351 -25.928  -3.120
  396   2H2     G  37          2H2         G  37  -3.200 -27.019  -3.864
  397   1H5*    U  38          1H5*        U  38   2.280 -25.319  -4.355
  398   2H5*    U  38          2H5*        U  38   2.965 -23.805  -4.922
  399    H4*    U  38           H4*        U  38   0.640 -24.021  -5.575
  400    H3*    U  38           H3*        U  38   1.045 -21.884  -3.501
  401    H2*    U  38           H2*        U  38  -1.180 -21.146  -4.044
  402   2HO*    U  38          2HO*        U  38  -1.140 -21.613  -6.347
  403    H1*    U  38           H1*        U  38  -2.202 -23.661  -3.834
  404    H3     U  38           H3         U  38  -3.300 -21.715   0.176
  405    H5     U  38           H5         U  38   0.596 -23.126   0.731
  406    H6     U  38           H6         U  38   0.700 -23.629  -1.662
  407   1H5*    G  39          1H5*        G  39  -0.021 -19.717  -6.845
  408   2H5*    G  39          2H5*        G  39   0.830 -18.175  -6.907
  409    H4*    G  39           H4*        G  39  -1.541 -17.843  -6.983
  410    H3*    G  39           H3*        G  39  -0.493 -16.954  -4.290
  411    H2*    G  39           H2*        G  39  -2.746 -16.035  -4.010
  412   2HO*    G  39          2HO*        G  39  -2.967 -15.578  -6.431
  413    H1*    G  39           H1*        G  39  -3.907 -18.362  -4.725
  414    H8     G  39           H8         G  39  -0.546 -19.245  -3.102
  415    H1     G  39           H1         G  39  -5.123 -17.578   1.088
  416   1H2     G  39          1H2         G  39  -6.767 -16.647   0.041
  417   2H2     G  39          2H2         G  39  -6.863 -16.622  -1.706
  418   1H5*    G  40          1H5*        G  40  -2.591 -13.750  -5.802
  419   2H5*    G  40          2H5*        G  40  -1.830 -12.186  -5.460
  420    H4*    G  40           H4*        G  40  -4.171 -12.202  -4.800
  421    H3*    G  40           H3*        G  40  -2.128 -11.919  -2.567
  422    H2*    G  40           H2*        G  40  -4.057 -11.574  -1.108
  423   2HO*    G  40          2HO*        G  40  -5.245 -10.392  -2.959
  424    H1*    G  40           H1*        G  40  -5.509 -13.622  -2.089
  425    H8     G  40           H8         G  40  -1.997 -14.968  -2.280
  426    H1     G  40           H1         G  40  -4.218 -14.593   3.738
  427   1H2     G  40          1H2         G  40  -6.007 -13.387   3.803
  428   2H2     G  40          2H2         G  40  -6.695 -12.671   2.361
  429   1H5*    G  41          1H5*        G  41  -4.448  -9.357  -1.082
  430   2H5*    G  41          2H5*        G  41  -3.674  -7.812  -0.732
  431    H4*    G  41           H4*        G  41  -4.430  -8.743   1.353
  432    H3*    G  41           H3*        G  41  -1.432  -9.054   1.041
  433    H2*    G  41           H2*        G  41  -1.450  -9.779   3.378
  434   2HO*    G  41          2HO*        G  41  -3.246  -8.480   4.151
  435    H1*    G  41           H1*        G  41  -3.377 -11.602   2.919
  436    H8     G  41           H8         G  41  -1.665 -11.365  -0.449
  437    H1     G  41           H1         G  41   1.467 -15.042   3.789
  438   1H2     G  41          1H2         G  41   0.700 -14.748   5.767
  439   2H2     G  41          2H2         G  41  -0.613 -13.642   6.128
  440   1H5*    A  42          1H5*        A  42  -0.453  -5.052   4.591
  441   2H5*    A  42          2H5*        A  42  -0.279  -6.385   5.737
  442    H4*    A  42           H4*        A  42  -2.864  -5.455   4.429
  443    H3*    A  42           H3*        A  42  -1.810  -5.550   7.269
  444    H2*    A  42           H2*        A  42  -4.071  -5.900   8.038
  445   2HO*    A  42          2HO*        A  42  -4.991  -4.520   6.191
  446    H1*    A  42           H1*        A  42  -4.551  -7.923   6.356
  447    H8     A  42           H8         A  42  -1.019  -8.710   6.469
  448   1H6     A  42          1H6         A  42  -1.655 -10.495  12.398
  449   2H6     A  42          2H6         A  42  -0.665 -10.640  10.963
  450    H2     A  42           H2         A  42  -5.303  -8.250  11.258
  451   1H5*    A  43          1H5*        A  43  -4.566  -3.039   7.612
  452   2H5*    A  43          2H5*        A  43  -4.581  -1.444   8.323
  453    H4*    A  43           H4*        A  43  -5.954  -2.892   9.672
  454    H3*    A  43           H3*        A  43  -3.290  -2.389  11.053
  455    H2*    A  43           H2*        A  43  -4.101  -3.768  12.871
  456   2HO*    A  43          2HO*        A  43  -6.393  -2.883  12.520
  457    H1*    A  43           H1*        A  43  -5.121  -5.735  11.235
  458    H8     A  43           H8         A  43  -2.075  -4.894   9.331
  459   1H6     A  43          1H6         A  43   1.138  -8.332  13.362
  460   2H6     A  43          2H6         A  43   1.128  -7.656  11.743
  461    H2     A  43           H2         A  43  -2.780  -7.363  15.219
  462   1H5*    U  44          1H5*        U  44  -5.340  -1.734  14.232
  463   2H5*    U  44          2H5*        U  44  -4.917  -0.220  15.048
  464    H4*    U  44           H4*        U  44  -4.295  -2.093  16.459
  465    H3*    U  44           H3*        U  44  -1.902  -0.736  15.185
  466    H2*    U  44           H2*        U  44  -0.545  -2.141  16.592
  467   2HO*    U  44          2HO*        U  44  -2.202  -2.009  18.414
  468    H1*    U  44           H1*        U  44  -1.956  -4.427  16.074
  469    H3     U  44           H3         U  44   1.964  -4.736  13.643
  470    H5     U  44           H5         U  44  -0.652  -2.580  11.186
  471    H6     U  44           H6         U  44  -2.206  -2.421  13.071
  472   1H5*    A  45          1H5*        A  45  -0.980  -0.557  19.221
  473   2H5*    A  45          2H5*        A  45  -0.224   0.981  19.664
  474    H4*    A  45           H4*        A  45   1.258  -0.903  20.130
  475    H3*    A  45           H3*        A  45   2.245   0.804  17.814
  476    H2*    A  45           H2*        A  45   4.282  -0.481  18.012
  477   2HO*    A  45          2HO*        A  45   4.003  -0.712  20.462
  478    H1*    A  45           H1*        A  45   2.966  -2.854  18.045
  479    H8     A  45           H8         A  45   0.848  -0.493  15.921
  480   1H6     A  45          1H6         A  45   4.624  -1.966  11.203
  481   2H6     A  45          2H6         A  45   3.092  -1.236  11.640
  482    H2     A  45           H2         A  45   6.396  -3.575  14.929
  483   1H5*    C  46          1H5*        C  46   5.329   0.728  20.536
  484   2H5*    C  46          2H5*        C  46   6.060   2.319  20.766
  485    H4*    C  46           H4*        C  46   7.736   0.666  20.180
  486    H3*    C  46           H3*        C  46   7.253   2.658  17.931
  487    H2*    C  46           H2*        C  46   9.296   1.748  17.018
  488   2HO*    C  46          2HO*        C  46  10.240   1.388  19.274
  489    H1*    C  46           H1*        C  46   8.507  -0.839  17.460
  490   1H4     C  46          1H4         C  46   6.537   0.735  11.599
  491   2H4     C  46          2H4         C  46   4.996   1.261  12.242
  492    H5     C  46           H5         C  46   4.523   1.390  14.593
  493    H6     C  46           H6         C  46   5.445   1.008  16.832
  494   1H5*    C  47          1H5*        C  47  11.248   3.040  18.884
  495   2H5*    C  47          2H5*        C  47  11.769   4.727  18.924
  496    H4*    C  47           H4*        C  47  13.159   3.415  17.417
  497    H3*    C  47           H3*        C  47  11.356   5.356  15.938
  498    H2*    C  47           H2*        C  47  12.797   4.866  14.042
  499   2HO*    C  47          2HO*        C  47  14.779   4.618  15.456
  500    H1*    C  47           H1*        C  47  12.688   2.166  14.508
  501   1H4     C  47          1H4         C  47   7.895   3.481  10.520
  502   2H4     C  47          2H4         C  47   6.834   3.829  11.867
  503    H5     C  47           H5         C  47   7.571   3.863  14.152
  504    H6     C  47           H6         C  47   9.507   3.548  15.625
  505   1H5*    A  48          1H5*        A  48  15.347   6.454  14.992
  506   2H5*    A  48          2H5*        A  48  15.531   8.209  14.946
  507    H4*    A  48           H4*        A  48  16.351   7.185  12.899
  508    H3*    A  48           H3*        A  48  13.800   8.760  12.465
  509    H2*    A  48           H2*        A  48  14.326   8.501  10.095
  510   2HO*    A  48          2HO*        A  48  16.752   8.547  10.503
  511    H1*    A  48           H1*        A  48  14.723   5.833  10.353
  512    H8     A  48           H8         A  48  12.113   6.642  12.981
  513   1H6     A  48          1H6         A  48   7.925   6.454   8.384
  514   2H6     A  48          2H6         A  48   8.153   6.528  10.118
  515    H2     A  48           H2         A  48  11.970   6.431   6.549
  516   1H5*    G  49          1H5*        G  49  16.651  10.402   9.920
  517   2H5*    G  49          2H5*        G  49  16.587  12.159   9.818
  518    H4*    G  49           H4*        G  49  16.497  11.124   7.611
  519    H3*    G  49           H3*        G  49  13.873  12.447   8.384
  520    H2*    G  49           H2*        G  49  13.274  12.051   6.041
  521   2HO*    G  49          2HO*        G  49  15.684  12.298   5.372
  522    H1*    G  49           H1*        G  49  14.048   9.465   6.122
  523    H8     G  49           H8         G  49  12.835  10.079   9.651
  524    H1     G  49           H1         G  49   8.063   9.738   5.357
  525   1H2     G  49          1H2         G  49   8.842  10.037   3.367
  526   2H2     G  49          2H2         G  49  10.564  10.062   3.039
  527   1H5*    G  50          1H5*        G  50  14.636  13.845   4.659
  528   2H5*    G  50          2H5*        G  50  14.538  15.595   4.513
  529    H4*    G  50           H4*        G  50  13.211  14.459   2.790
  530    H3*    G  50           H3*        G  50  11.539  15.977   4.825
  531    H2*    G  50           H2*        G  50   9.667  15.501   3.321
  532   2HO*    G  50          2HO*        G  50  11.239  15.622   1.366
  533    H1*    G  50           H1*        G  50  10.351  12.879   3.000
  534    H8     G  50           H8         G  50  11.273  13.340   6.594
  535    H1     G  50           H1         G  50   4.916  13.031   5.618
  536   1H2     G  50          1H2         G  50   4.484  13.206   3.526
  537   2H2     G  50          2H2         G  50   5.722  13.594   2.347
  538   1H5*    U  51          1H5*        U  51  10.239  17.257   1.211
  539   2H5*    U  51          2H5*        U  51  10.424  18.979   0.888
  540    H4*    U  51           H4*        U  51   8.181  18.233   0.304
  541    H3*    U  51           H3*        U  51   8.734  20.430   1.972
  542    H2*    U  51           H2*        U  51   8.028  19.508   3.913
  543   2HO*    U  51          2HO*        U  51   5.338  19.916   3.055
  544    H1*    U  51           H1*        U  51   5.874  17.879   2.579
  545    H3     U  51           H3         U  51   4.748  16.262   6.584
  546    H5     U  51           H5         U  51   8.887  16.777   6.981
  547    H6     U  51           H6         U  51   8.980  17.414   4.612
  548   1H5*    G  52          1H5*        G  52   7.723  22.502  -2.128
  549   2H5*    G  52          2H5*        G  52   6.106  22.688  -2.787
  550    H4*    G  52           H4*        G  52   7.459  20.022  -2.204
  551    H3*    G  52           H3*        G  52   6.757  21.560  -4.734
  552    H2*    G  52           H2*        G  52   6.697  19.434  -5.858
  553   2HO*    G  52          2HO*        G  52   7.413  18.102  -3.418
  554    H1*    G  52           H1*        G  52   5.190  18.288  -3.880
  555    H8     G  52           H8         G  52   3.972  21.871  -4.078
  556    H1     G  52           H1         G  52   1.524  17.962  -8.560
  557   1H2     G  52          1H2         G  52   2.817  16.252  -8.830
  558   2H2     G  52          2H2         G  52   4.198  15.953  -7.796
  559   1H5*    C  53          1H5*        C  53   9.586  18.940  -6.299
  560   2H5*    C  53          2H5*        C  53  10.690  19.776  -7.404
  561    H4*    C  53           H4*        C  53   9.634  17.900  -8.517
  562    H3*    C  53           H3*        C  53   8.532  20.530  -9.563
  563    H2*    C  53           H2*        C  53   7.536  19.156 -11.294
  564   2HO*    C  53          2HO*        C  53   9.447  17.594 -11.267
  565    H1*    C  53           H1*        C  53   6.586  17.322  -9.513
  566   1H4     C  53          1H4         C  53   1.939  21.622  -9.977
  567   2H4     C  53          2H4         C  53   2.664  22.574  -8.699
  568    H5     C  53           H5         C  53   4.860  22.155  -7.831
  569    H6     C  53           H6         C  53   6.718  20.562  -7.836
  570   1H5*    C  54          1H5*        C  54   9.821  18.591 -13.016
  571   2H5*    C  54          2H5*        C  54  10.638  19.699 -14.120
  572    H4*    C  54           H4*        C  54   8.811  18.544 -15.231
  573    H3*    C  54           H3*        C  54   8.196  21.493 -14.822
  574    H2*    C  54           H2*        C  54   6.358  21.081 -16.344
  575   2HO*    C  54          2HO*        C  54   7.677  19.404 -17.596
  576    H1*    C  54           H1*        C  54   5.583  18.812 -15.035
  577   1H4     C  54          1H4         C  54   2.423  23.599 -12.276
  578   2H4     C  54          2H4         C  54   3.727  23.827 -11.133
  579    H5     C  54           H5         C  54   5.820  22.665 -11.273
  580    H6     C  54           H6         C  54   7.074  20.974 -12.523
  581   1H5*    C  55          1H5*        C  55   7.713  20.939 -18.923
  582   2H5*    C  55          2H5*        C  55   8.477  22.246 -19.835
  583    H4*    C  55           H4*        C  55   6.135  22.005 -20.466
  584    H3*    C  55           H3*        C  55   6.727  24.543 -18.913
  585    H2*    C  55           H2*        C  55   4.508  25.229 -19.474
  586   2HO*    C  55          2HO*        C  55   4.648  24.297 -21.717
  587    H1*    C  55           H1*        C  55   3.381  22.741 -19.021
  588   1H4     C  55          1H4         C  55   2.651  26.358 -13.803
  589   2H4     C  55          2H4         C  55   4.257  25.939 -13.251
  590    H5     C  55           H5         C  55   5.768  24.569 -14.511
  591    H6     C  55           H6         C  55   6.060  23.337 -16.610
  592   1H    MET 104          1H        MET 104  10.368 -17.186   2.137
  593    HA   MET 104           HA       MET 104  11.309 -14.399   1.912
  594   1HB   MET 104          1HB       MET 104  13.240 -15.674   2.866
  595   2HB   MET 104          2HB       MET 104  13.203 -16.757   1.481
  596   1HG   MET 104          1HG       MET 104  14.468 -15.363   0.300
  597   2HG   MET 104          2HG       MET 104  13.323 -14.043   0.485
  598   1HE   MET 104          1HE       MET 104  13.807 -11.876   1.874
  599   2HE   MET 104          2HE       MET 104  13.171 -12.951   3.146
  600   3HE   MET 104          3HE       MET 104  14.626 -11.972   3.444
  601    H    TYR 105           H        TYR 105  10.907 -13.624  -0.082
  602    HA   TYR 105           HA       TYR 105  10.153 -15.593  -2.217
  603   1HB   TYR 105          1HB       TYR 105   9.187 -12.776  -1.573
  604   2HB   TYR 105          2HB       TYR 105   8.860 -13.559  -3.124
  605    HD1  TYR 105           HD1      TYR 105   8.276 -14.076   0.681
  606    HD2  TYR 105           HD2      TYR 105   7.276 -15.261  -3.386
  607    HE1  TYR 105           HE1      TYR 105   6.642 -15.707   1.543
  608    HE2  TYR 105           HE2      TYR 105   5.537 -16.776  -2.484
  609    HH   TYR 105           HH       TYR 105   4.604 -17.702  -0.628
  610    H    VAL 106           H        VAL 106  11.544 -15.816  -3.833
  611    HA   VAL 106           HA       VAL 106  13.668 -13.727  -4.146
  612    HB   VAL 106           HB       VAL 106  13.667 -16.683  -4.853
  613   1HG1  VAL 106          1HG1      VAL 106  16.002 -14.723  -4.747
  614   2HG1  VAL 106          2HG1      VAL 106  16.134 -16.476  -4.980
  615   3HG1  VAL 106          3HG1      VAL 106  15.344 -15.500  -6.205
  616   1HG2  VAL 106          1HG2      VAL 106  15.130 -16.978  -2.939
  617   2HG2  VAL 106          2HG2      VAL 106  14.944 -15.247  -2.513
  618   3HG2  VAL 106          3HG2      VAL 106  13.547 -16.362  -2.427
  619    H    CYS 107           H        CYS 107  14.200 -12.839  -6.072
  620    HA   CYS 107           HA       CYS 107  12.484 -13.261  -8.410
  621   1HB   CYS 107          1HB       CYS 107  13.365 -11.004  -7.801
  622   2HB   CYS 107          2HB       CYS 107  15.012 -11.609  -8.010
  623    H    HIS 108           H        HIS 108  12.872 -14.632 -10.034
  624    HA   HIS 108           HA       HIS 108  15.491 -16.067 -10.050
  625   1HB   HIS 108          1HB       HIS 108  12.750 -16.953 -11.067
  626   2HB   HIS 108          2HB       HIS 108  14.234 -17.914 -11.153
  627    HD2  HIS 108           HD2      HIS 108  11.305 -18.040  -9.190
  628    HE1  HIS 108           HE1      HIS 108  14.245 -18.446  -6.117
  629    HE2  HIS 108           HE2      HIS 108  11.773 -18.728  -6.691
  630    H    PHE 109           H        PHE 109  14.747 -13.425 -11.400
  631    HA   PHE 109           HA       PHE 109  14.766 -13.857 -14.258
  632   1HB   PHE 109          1HB       PHE 109  14.389 -11.647 -12.832
  633   2HB   PHE 109          2HB       PHE 109  16.133 -11.492 -12.916
  634    HD1  PHE 109           HD1      PHE 109  17.245 -11.054 -15.069
  635    HD2  PHE 109           HD2      PHE 109  12.965 -11.271 -14.649
  636    HE1  PHE 109           HE1      PHE 109  16.949 -10.077 -17.372
  637    HE2  PHE 109           HE2      PHE 109  12.657 -10.322 -16.935
  638    HZ   PHE 109           HZ       PHE 109  14.649  -9.710 -18.288
  639    H    GLU 110           H        GLU 110  16.594 -13.691 -15.707
  640    HA   GLU 110           HA       GLU 110  18.596 -15.528 -15.109
  641   1HB   GLU 110          1HB       GLU 110  17.912 -14.793 -17.393
  642   2HB   GLU 110          2HB       GLU 110  18.743 -13.261 -17.150
  643   1HG   GLU 110          1HG       GLU 110  20.132 -14.697 -18.487
  644   2HG   GLU 110          2HG       GLU 110  20.914 -14.491 -16.928
  645    H    ASN 111           H        ASN 111  20.118 -15.439 -13.563
  646    HA   ASN 111           HA       ASN 111  22.100 -14.833 -12.535
  647   1HB   ASN 111          1HB       ASN 111  22.686 -14.012 -14.938
  648   2HB   ASN 111          2HB       ASN 111  22.327 -12.387 -14.344
  649   1HD2  ASN 111          1HD2      ASN 111  24.416 -11.551 -14.438
  650   2HD2  ASN 111          2HD2      ASN 111  25.726 -12.194 -13.459
  651    H    CYS 112           H        CYS 112  19.282 -13.497 -12.016
  652    HA   CYS 112           HA       CYS 112  20.044 -10.966 -10.713
  653   1HB   CYS 112          1HB       CYS 112  17.917 -11.150 -11.889
  654   2HB   CYS 112          2HB       CYS 112  17.366 -12.442 -10.790
  655    H    GLY 113           H        GLY 113  17.995 -13.632  -9.395
  656   1HA   GLY 113          1HA       GLY 113  18.095 -14.825  -7.421
  657   2HA   GLY 113          2HA       GLY 113  19.819 -14.414  -7.347
  658    H    LYS 114           H        LYS 114  17.689 -11.636  -7.449
  659    HA   LYS 114           HA       LYS 114  18.440 -10.808  -4.760
  660   1HB   LYS 114          1HB       LYS 114  17.771  -9.422  -6.883
  661   2HB   LYS 114          2HB       LYS 114  16.115  -9.620  -6.290
  662   1HG   LYS 114          1HG       LYS 114  16.673  -8.437  -4.231
  663   2HG   LYS 114          2HG       LYS 114  18.418  -8.527  -4.585
  664   1HD   LYS 114          1HD       LYS 114  18.131  -7.105  -6.571
  665   2HD   LYS 114          2HD       LYS 114  16.392  -7.093  -6.295
  666   1HE   LYS 114          1HE       LYS 114  17.262  -5.009  -5.670
  667   2HE   LYS 114          2HE       LYS 114  16.638  -5.843  -4.235
  668   1HZ   LYS 114          1HZ       LYS 114  19.517  -5.668  -4.991
  669   2HZ   LYS 114          2HZ       LYS 114  18.808  -4.795  -3.810
  670   3HZ   LYS 114          3HZ       LYS 114  18.943  -6.411  -3.651
  671    H    ALA 115           H        ALA 115  17.234 -10.760  -2.860
  672    HA   ALA 115           HA       ALA 115  14.775 -12.473  -2.883
  673   1HB   ALA 115          1HB       ALA 115  16.943 -12.321  -0.741
  674   2HB   ALA 115          2HB       ALA 115  15.504 -13.375  -0.764
  675   3HB   ALA 115          3HB       ALA 115  16.771 -13.605  -1.971
  676    H    PHE 116           H        PHE 116  13.016 -11.839  -1.745
  677    HA   PHE 116           HA       PHE 116  13.187  -9.248  -0.250
  678   1HB   PHE 116          1HB       PHE 116  10.816 -10.194  -1.904
  679   2HB   PHE 116          2HB       PHE 116  11.074  -8.647  -1.175
  680    HD1  PHE 116           HD1      PHE 116  12.450  -6.921  -2.280
  681    HD2  PHE 116           HD2      PHE 116  12.198 -10.903  -3.909
  682    HE1  PHE 116           HE1      PHE 116  13.855  -6.243  -4.232
  683    HE2  PHE 116           HE2      PHE 116  13.586 -10.237  -5.816
  684    HZ   PHE 116           HZ       PHE 116  14.454  -7.958  -5.968
  685    H    LYS 117           H        LYS 117  11.677  -8.927   1.449
  686    HA   LYS 117           HA       LYS 117  11.085 -11.283   2.973
  687   1HB   LYS 117          1HB       LYS 117  10.756  -9.836   4.640
  688   2HB   LYS 117          2HB       LYS 117  11.430  -8.656   3.536
  689   1HG   LYS 117          1HG       LYS 117   9.128  -7.913   2.960
  690   2HG   LYS 117          2HG       LYS 117   8.521  -9.029   4.203
  691   1HD   LYS 117          1HD       LYS 117  10.464  -6.807   4.821
  692   2HD   LYS 117          2HD       LYS 117   8.696  -6.619   4.876
  693   1HE   LYS 117          1HE       LYS 117   8.451  -8.340   6.543
  694   2HE   LYS 117          2HE       LYS 117  10.152  -8.814   6.402
  695   1HZ   LYS 117          1HZ       LYS 117   9.859  -7.463   8.314
  696   2HZ   LYS 117          2HZ       LYS 117  10.733  -6.575   7.203
  697   3HZ   LYS 117          3HZ       LYS 117   9.143  -6.244   7.462
  698    H    LYS 118           H        LYS 118   9.113  -9.164   0.839
  699    HA   LYS 118           HA       LYS 118   6.865 -11.171   1.084
  700   1HB   LYS 118          1HB       LYS 118   6.535  -8.139   0.800
  701   2HB   LYS 118          2HB       LYS 118   5.249  -9.314   0.934
  702   1HG   LYS 118          1HG       LYS 118   6.880  -9.879   3.114
  703   2HG   LYS 118          2HG       LYS 118   6.974  -8.115   2.967
  704   1HD   LYS 118          1HD       LYS 118   4.969  -7.823   3.905
  705   2HD   LYS 118          2HD       LYS 118   4.253  -9.159   2.990
  706   1HE   LYS 118          1HE       LYS 118   4.257  -9.778   5.428
  707   2HE   LYS 118          2HE       LYS 118   5.231 -10.786   4.396
  708   1HZ   LYS 118          1HZ       LYS 118   6.258  -8.699   6.206
  709   2HZ   LYS 118          2HZ       LYS 118   6.391 -10.298   6.431
  710   3HZ   LYS 118          3HZ       LYS 118   7.219  -9.677   5.233
  711    H    HIS 119           H        HIS 119   5.545 -11.512  -0.755
  712    HA   HIS 119           HA       HIS 119   7.038 -11.560  -3.198
  713   1HB   HIS 119          1HB       HIS 119   4.947 -12.454  -4.203
  714   2HB   HIS 119          2HB       HIS 119   5.492 -13.288  -2.781
  715    HD1  HIS 119           HD1      HIS 119   2.683 -10.578  -3.397
  716    HD2  HIS 119           HD2      HIS 119   3.683 -14.143  -1.355
  717    HE1  HIS 119           HE1      HIS 119   0.537 -11.359  -2.163
  718    HE2  HIS 119           HE2      HIS 119   1.175 -13.491  -0.936
  719    H    ASN 120           H        ASN 120   4.649  -9.251  -1.938
  720    HA   ASN 120           HA       ASN 120   4.041  -7.992  -4.452
  721   1HB   ASN 120          1HB       ASN 120   3.740  -7.259  -1.531
  722   2HB   ASN 120          2HB       ASN 120   3.668  -5.954  -2.719
  723   1HD2  ASN 120          1HD2      ASN 120   1.613  -8.140  -1.145
  724   2HD2  ASN 120          2HD2      ASN 120   0.393  -8.220  -2.416
  725    H    GLN 121           H        GLN 121   6.786  -7.674  -2.188
  726    HA   GLN 121           HA       GLN 121   7.945  -5.336  -3.539
  727   1HB   GLN 121          1HB       GLN 121   9.538  -7.313  -1.937
  728   2HB   GLN 121          2HB       GLN 121   9.758  -5.567  -2.173
  729   1HG   GLN 121          1HG       GLN 121   7.933  -5.092  -0.639
  730   2HG   GLN 121          2HG       GLN 121   7.661  -6.834  -0.415
  731   1HE2  GLN 121          1HE2      GLN 121   9.316  -4.184   0.940
  732   2HE2  GLN 121          2HE2      GLN 121  10.481  -5.122   1.855
  733    H    LEU 122           H        LEU 122   8.316  -8.920  -3.667
  734    HA   LEU 122           HA       LEU 122  10.401  -9.039  -5.572
  735   1HB   LEU 122          1HB       LEU 122   9.659 -11.001  -4.380
  736   2HB   LEU 122          2HB       LEU 122   8.039 -10.879  -5.011
  737    HG   LEU 122           HG       LEU 122   8.729 -11.521  -7.230
  738   1HD1  LEU 122          1HD1      LEU 122  11.047 -10.563  -7.141
  739   2HD1  LEU 122          2HD1      LEU 122  11.472 -11.864  -5.991
  740   3HD1  LEU 122          3HD1      LEU 122  10.952 -12.237  -7.662
  741   1HD2  LEU 122          1HD2      LEU 122   8.158 -13.318  -5.600
  742   2HD2  LEU 122          2HD2      LEU 122   9.418 -13.839  -6.736
  743   3HD2  LEU 122          3HD2      LEU 122   9.856 -13.407  -5.081
  744    H    LYS 123           H        LYS 123   6.818  -9.045  -6.125
  745    HA   LYS 123           HA       LYS 123   6.813  -8.832  -8.928
  746   1HB   LYS 123          1HB       LYS 123   4.941  -7.617  -6.850
  747   2HB   LYS 123          2HB       LYS 123   4.629  -7.545  -8.585
  748   1HG   LYS 123          1HG       LYS 123   4.577  -9.982  -8.747
  749   2HG   LYS 123          2HG       LYS 123   5.000 -10.144  -7.039
  750   1HD   LYS 123          1HD       LYS 123   2.896  -8.886  -6.443
  751   2HD   LYS 123          2HD       LYS 123   2.456  -8.892  -8.166
  752   1HE   LYS 123          1HE       LYS 123   2.553 -11.385  -8.161
  753   2HE   LYS 123          2HE       LYS 123   2.989 -11.362  -6.449
  754   1HZ   LYS 123          1HZ       LYS 123   0.675 -11.762  -6.651
  755   2HZ   LYS 123          2HZ       LYS 123   0.814 -10.251  -6.033
  756   3HZ   LYS 123          3HZ       LYS 123   0.415 -10.453  -7.611
  757    H    VAL 124           H        VAL 124   7.050  -6.176  -6.497
  758    HA   VAL 124           HA       VAL 124   7.149  -3.983  -8.305
  759    HB   VAL 124           HB       VAL 124   8.250  -4.478  -5.542
  760   1HG1  VAL 124          1HG1      VAL 124   9.926  -2.924  -6.361
  761   2HG1  VAL 124          2HG1      VAL 124   8.666  -1.897  -7.084
  762   3HG1  VAL 124          3HG1      VAL 124   8.790  -2.066  -5.320
  763   1HG2  VAL 124          1HG2      VAL 124   6.505  -3.134  -4.868
  764   2HG2  VAL 124          2HG2      VAL 124   6.404  -2.335  -6.477
  765   3HG2  VAL 124          3HG2      VAL 124   5.791  -3.988  -6.221
  766    H    HIS 125           H        HIS 125   9.788  -6.114  -7.100
  767    HA   HIS 125           HA       HIS 125  11.895  -4.653  -8.339
  768   1HB   HIS 125          1HB       HIS 125  12.330  -6.163  -6.528
  769   2HB   HIS 125          2HB       HIS 125  11.654  -7.537  -7.399
  770    HD1  HIS 125           HD1      HIS 125  14.729  -5.210  -7.607
  771    HD2  HIS 125           HD2      HIS 125  13.177  -8.872  -9.003
  772    HE1  HIS 125           HE1      HIS 125  16.648  -6.391  -8.787
  773    H    GLN 126           H        GLN 126  10.049  -7.569  -9.426
  774    HA   GLN 126           HA       GLN 126  11.582  -8.002 -11.795
  775   1HB   GLN 126          1HB       GLN 126   8.754  -8.834 -11.010
  776   2HB   GLN 126          2HB       GLN 126   9.533  -9.290 -12.560
  777   1HG   GLN 126          1HG       GLN 126  11.534 -10.087 -11.247
  778   2HG   GLN 126          2HG       GLN 126  10.668  -9.814  -9.744
  779   1HE2  GLN 126          1HE2      GLN 126  11.865 -12.182 -10.423
  780   2HE2  GLN 126          2HE2      GLN 126  10.598 -13.415 -10.667
  781    H    PHE 127           H        PHE 127   8.804  -5.885 -11.152
  782    HA   PHE 127           HA       PHE 127   8.068  -5.235 -13.799
  783   1HB   PHE 127          1HB       PHE 127   6.700  -3.945 -12.769
  784   2HB   PHE 127          2HB       PHE 127   7.399  -4.394 -11.268
  785    HD1  PHE 127           HD1      PHE 127   8.254  -1.716 -13.932
  786    HD2  PHE 127           HD2      PHE 127   7.406  -2.703  -9.841
  787    HE1  PHE 127           HE1      PHE 127   8.742   0.585 -13.284
  788    HE2  PHE 127           HE2      PHE 127   7.972  -0.502  -9.102
  789    HZ   PHE 127           HZ       PHE 127   8.736   1.239 -10.842
  790    H    SER 128           H        SER 128  10.946  -4.325 -11.951
  791    HA   SER 128           HA       SER 128  11.797  -2.140 -13.666
  792   1HB   SER 128          1HB       SER 128  12.598  -2.623 -11.318
  793   2HB   SER 128          2HB       SER 128  13.556  -3.972 -11.980
  794    HG   SER 128           HG       SER 128  14.755  -1.998 -11.831
  795    H    HIS 129           H        HIS 129  12.614  -5.681 -13.547
  796    HA   HIS 129           HA       HIS 129  14.446  -5.632 -15.772
  797   1HB   HIS 129          1HB       HIS 129  12.693  -7.887 -14.707
  798   2HB   HIS 129          2HB       HIS 129  13.952  -8.046 -15.909
  799    HD1  HIS 129           HD1      HIS 129  16.561  -7.647 -14.979
  800    HD2  HIS 129           HD2      HIS 129  13.405  -8.713 -12.445
  801    HE1  HIS 129           HE1      HIS 129  17.596  -8.820 -12.945
  802    H    THR 130           H        THR 130  10.912  -6.089 -15.535
  803    HA   THR 130           HA       THR 130  10.599  -6.687 -18.389
  804    HB   THR 130           HB       THR 130   8.174  -6.515 -17.890
  805    HG1  THR 130           HG1      THR 130   9.098  -5.580 -15.434
  806   1HG2  THR 130          1HG2      THR 130   9.508  -8.654 -17.189
  807   2HG2  THR 130          2HG2      THR 130   9.412  -8.039 -15.526
  808   3HG2  THR 130          3HG2      THR 130   7.929  -8.380 -16.413
  809    H    GLN 131           H        GLN 131  10.846  -3.832 -16.459
  810    HA   GLN 131           HA       GLN 131  10.535  -1.603 -16.822
  811   1HB   GLN 131          1HB       GLN 131  11.979  -2.412 -18.952
  812   2HB   GLN 131          2HB       GLN 131  10.527  -1.916 -19.822
  813   1HG   GLN 131          1HG       GLN 131  11.483   0.166 -19.700
  814   2HG   GLN 131          2HG       GLN 131  10.802   0.214 -18.072
  815   1HE2  GLN 131          1HE2      GLN 131  12.640  -1.352 -16.508
  816   2HE2  GLN 131          2HE2      GLN 131  14.198  -0.585 -16.670
  817    H    GLN 132           H        GLN 132   8.141  -3.316 -16.613
  818    HA   GLN 132           HA       GLN 132   6.254  -1.258 -17.689
  819   1HB   GLN 132          1HB       GLN 132   4.538  -2.913 -18.100
  820   2HB   GLN 132          2HB       GLN 132   5.949  -3.166 -19.117
  821   1HG   GLN 132          1HG       GLN 132   5.107  -5.304 -18.538
  822   2HG   GLN 132          2HG       GLN 132   6.617  -5.063 -17.681
  823   1HE2  GLN 132          1HE2      GLN 132   6.576  -5.544 -15.534
  824   2HE2  GLN 132          2HE2      GLN 132   5.115  -5.620 -14.533
  825    H    LEU 133           H        LEU 133   4.301  -1.027 -16.370
  826    HA   LEU 133           HA       LEU 133   5.108  -1.278 -13.553
  827   1HB   LEU 133          1HB       LEU 133   3.148   0.466 -15.047
  828   2HB   LEU 133          2HB       LEU 133   3.128   0.428 -13.275
  829    HG   LEU 133           HG       LEU 133   5.741   0.915 -14.849
  830   1HD1  LEU 133          1HD1      LEU 133   4.103   2.668 -15.473
  831   2HD1  LEU 133          2HD1      LEU 133   3.806   2.999 -13.750
  832   3HD1  LEU 133          3HD1      LEU 133   5.406   3.307 -14.460
  833   1HD2  LEU 133          1HD2      LEU 133   5.929   0.234 -12.464
  834   2HD2  LEU 133          2HD2      LEU 133   6.550   1.851 -12.821
  835   3HD2  LEU 133          3HD2      LEU 133   4.973   1.674 -12.043
  836    HA   PRO 134           HA       PRO 134   2.297  -4.583 -12.974
  837   1HB   PRO 134          1HB       PRO 134   2.507  -4.674 -10.160
  838   2HB   PRO 134          2HB       PRO 134   3.610  -5.455 -11.332
  839   1HG   PRO 134          1HG       PRO 134   4.076  -3.115  -9.605
  840   2HG   PRO 134          2HG       PRO 134   5.241  -4.104 -10.498
  841   1HD   PRO 134          1HD       PRO 134   4.262  -1.493 -11.171
  842   2HD   PRO 134          2HD       PRO 134   5.320  -2.553 -12.104
  843    H    TYR 135           H        TYR 135   1.845  -1.722 -10.866
  844    HA   TYR 135           HA       TYR 135  -0.852  -2.653 -10.104
  845   1HB   TYR 135          1HB       TYR 135   0.748  -0.232  -9.140
  846   2HB   TYR 135          2HB       TYR 135  -0.730  -0.838  -8.437
  847    HD1  TYR 135           HD1      TYR 135  -0.823  -3.068  -7.343
  848    HD2  TYR 135           HD2      TYR 135   2.893  -1.254  -8.583
  849    HE1  TYR 135           HE1      TYR 135   0.482  -4.765  -6.009
  850    HE2  TYR 135           HE2      TYR 135   4.174  -2.851  -7.163
  851    HH   TYR 135           HH       TYR 135   4.045  -4.806  -5.903
  852    H    GLU 136           H        GLU 136  -2.215  -2.282 -11.832
  853    HA   GLU 136           HA       GLU 136  -2.181   0.437 -13.065
  854   1HB   GLU 136          1HB       GLU 136  -3.580  -0.594 -14.827
  855   2HB   GLU 136          2HB       GLU 136  -2.010  -1.360 -14.635
  856   1HG   GLU 136          1HG       GLU 136  -3.054  -3.267 -13.441
  857   2HG   GLU 136          2HG       GLU 136  -4.637  -2.501 -13.601
  858    H    CYS 137           H        CYS 137  -3.990   1.749 -13.064
  859    HA   CYS 137           HA       CYS 137  -6.009   1.298 -11.010
  860   1HB   CYS 137          1HB       CYS 137  -5.212   3.533 -11.429
  861   2HB   CYS 137          2HB       CYS 137  -5.625   3.439 -13.124
  862    HA   PRO 138           HA       PRO 138  -8.493  -0.980 -13.939
  863   1HB   PRO 138          1HB       PRO 138 -10.172  -2.226 -12.214
  864   2HB   PRO 138          2HB       PRO 138  -8.408  -2.515 -12.148
  865   1HG   PRO 138          1HG       PRO 138 -10.033  -0.572 -10.455
  866   2HG   PRO 138          2HG       PRO 138  -8.869  -1.812  -9.891
  867   1HD   PRO 138          1HD       PRO 138  -8.185   0.836 -10.293
  868   2HD   PRO 138          2HD       PRO 138  -7.037  -0.519 -10.519
  869    H    HIS 139           H        HIS 139  -9.408   1.909 -12.571
  870    HA   HIS 139           HA       HIS 139 -12.271   1.840 -12.598
  871   1HB   HIS 139          1HB       HIS 139 -10.875   3.597 -11.495
  872   2HB   HIS 139          2HB       HIS 139 -10.419   4.209 -13.088
  873    HD2  HIS 139           HD2      HIS 139 -12.054   5.925 -14.197
  874    HE1  HIS 139           HE1      HIS 139 -15.452   5.416 -11.674
  875    HE2  HIS 139           HE2      HIS 139 -14.482   6.758 -13.611
  876    H    GLU 140           H        GLU 140 -13.800   2.431 -14.138
  877    HA   GLU 140           HA       GLU 140 -13.175   1.847 -16.890
  878   1HB   GLU 140          1HB       GLU 140 -15.645   3.081 -15.577
  879   2HB   GLU 140          2HB       GLU 140 -15.541   2.623 -17.284
  880   1HG   GLU 140          1HG       GLU 140 -15.044   0.274 -16.617
  881   2HG   GLU 140          2HG       GLU 140 -15.229   0.724 -14.918
  882    H    GLY 141           H        GLY 141 -11.947   3.167 -18.121
  883   1HA   GLY 141          1HA       GLY 141 -11.969   5.145 -19.545
  884   2HA   GLY 141          2HA       GLY 141 -12.698   6.068 -18.219
  885    H    CYS 142           H        CYS 142 -10.408   4.192 -16.729
  886    HA   CYS 142           HA       CYS 142  -8.318   6.325 -16.952
  887   1HB   CYS 142          1HB       CYS 142  -9.518   5.781 -14.712
  888   2HB   CYS 142          2HB       CYS 142  -8.592   4.286 -14.718
  889    H    ASP 143           H        ASP 143  -6.075   5.657 -16.936
  890    HA   ASP 143           HA       ASP 143  -5.509   2.816 -17.625
  891   1HB   ASP 143          1HB       ASP 143  -4.466   3.311 -19.680
  892   2HB   ASP 143          2HB       ASP 143  -6.008   4.143 -19.752
  893    H    LYS 144           H        LYS 144  -4.859   5.146 -15.536
  894    HA   LYS 144           HA       LYS 144  -2.011   5.580 -15.672
  895   1HB   LYS 144          1HB       LYS 144  -3.876   5.572 -13.263
  896   2HB   LYS 144          2HB       LYS 144  -2.258   6.262 -13.294
  897   1HG   LYS 144          1HG       LYS 144  -4.409   7.286 -15.180
  898   2HG   LYS 144          2HG       LYS 144  -4.334   7.808 -13.499
  899   1HD   LYS 144          1HD       LYS 144  -2.155   8.783 -13.780
  900   2HD   LYS 144          2HD       LYS 144  -1.975   8.052 -15.383
  901   1HE   LYS 144          1HE       LYS 144  -2.504  10.416 -15.600
  902   2HE   LYS 144          2HE       LYS 144  -3.785   9.426 -16.285
  903   1HZ   LYS 144          1HZ       LYS 144  -4.570  11.321 -14.919
  904   2HZ   LYS 144          2HZ       LYS 144  -5.148   9.879 -14.381
  905   3HZ   LYS 144          3HZ       LYS 144  -3.956  10.640 -13.559
  906    H    ARG 145           H        ARG 145  -0.286   4.515 -14.703
  907    HA   ARG 145           HA       ARG 145  -0.870   2.013 -13.158
  908   1HB   ARG 145          1HB       ARG 145   1.464   2.120 -15.069
  909   2HB   ARG 145          2HB       ARG 145   0.629   0.734 -14.307
  910   1HG   ARG 145          1HG       ARG 145  -1.272   1.018 -15.850
  911   2HG   ARG 145          2HG       ARG 145  -0.465   2.409 -16.596
  912   1HD   ARG 145          1HD       ARG 145  -0.046   0.541 -18.024
  913   2HD   ARG 145          2HD       ARG 145   1.461   0.955 -17.223
  914    HE   ARG 145           HE       ARG 145   1.404  -1.079 -16.006
  915   1HH1  ARG 145          1HH1      ARG 145  -1.624  -0.843 -17.831
  916   2HH1  ARG 145          2HH1      ARG 145  -2.095  -2.439 -17.239
  917   1HH2  ARG 145          1HH2      ARG 145   0.694  -3.064 -15.474
  918   2HH2  ARG 145          2HH2      ARG 145  -0.925  -3.570 -16.004
  919    H    PHE 146           H        PHE 146   0.674   1.441 -11.633
  920    HA   PHE 146           HA       PHE 146   2.560   3.642 -10.890
  921   1HB   PHE 146          1HB       PHE 146   0.712   2.133  -8.983
  922   2HB   PHE 146          2HB       PHE 146   1.751   3.472  -8.600
  923    HD1  PHE 146           HD1      PHE 146   1.287   5.773  -9.299
  924    HD2  PHE 146           HD2      PHE 146  -1.434   2.566 -10.299
  925    HE1  PHE 146           HE1      PHE 146  -0.411   7.423 -10.054
  926    HE2  PHE 146           HE2      PHE 146  -3.127   4.196 -10.958
  927    HZ   PHE 146           HZ       PHE 146  -2.582   6.641 -10.945
  928    H    SER 147           H        SER 147   4.200   3.053  -9.350
  929    HA   SER 147           HA       SER 147   5.351   0.469 -10.069
  930   1HB   SER 147          1HB       SER 147   7.265   1.366  -8.608
  931   2HB   SER 147          2HB       SER 147   6.831   2.360 -10.016
  932    HG   SER 147           HG       SER 147   7.148   3.392  -7.853
  933    H    LEU 148           H        LEU 148   3.628   1.820  -7.309
  934    HA   LEU 148           HA       LEU 148   4.097  -0.730  -5.818
  935   1HB   LEU 148          1HB       LEU 148   4.526   2.108  -4.891
  936   2HB   LEU 148          2HB       LEU 148   3.839   0.997  -3.747
  937    HG   LEU 148           HG       LEU 148   6.188   1.243  -3.372
  938   1HD1  LEU 148          1HD1      LEU 148   6.890  -1.211  -3.477
  939   2HD1  LEU 148          2HD1      LEU 148   5.342  -0.882  -2.697
  940   3HD1  LEU 148          3HD1      LEU 148   5.372  -1.497  -4.366
  941   1HD2  LEU 148          1HD2      LEU 148   6.880   1.631  -5.781
  942   2HD2  LEU 148          2HD2      LEU 148   7.933   0.583  -4.805
  943   3HD2  LEU 148          3HD2      LEU 148   6.831  -0.142  -5.972
  944    HA   PRO 149           HA       PRO 149  -0.284  -0.825  -5.370
  945   1HB   PRO 149          1HB       PRO 149  -0.571  -1.955  -2.827
  946   2HB   PRO 149          2HB       PRO 149  -0.173  -2.842  -4.312
  947   1HG   PRO 149          1HG       PRO 149   1.668  -1.961  -2.112
  948   2HG   PRO 149          2HG       PRO 149   1.697  -3.467  -3.103
  949   1HD   PRO 149          1HD       PRO 149   3.375  -1.343  -3.580
  950   2HD   PRO 149          2HD       PRO 149   2.816  -2.427  -4.812
  951    H    SER 150           H        SER 150   1.566   0.600  -2.665
  952    HA   SER 150           HA       SER 150  -0.591   1.998  -1.407
  953   1HB   SER 150          1HB       SER 150   2.349   2.794  -1.567
  954   2HB   SER 150          2HB       SER 150   1.164   3.360  -0.371
  955    HG   SER 150           HG       SER 150   2.431   1.635   0.452
  956    H    ARG 151           H        ARG 151   1.546   2.828  -4.151
  957    HA   ARG 151           HA       ARG 151   0.687   5.595  -4.395
  958   1HB   ARG 151          1HB       ARG 151   2.000   3.661  -6.355
  959   2HB   ARG 151          2HB       ARG 151   1.630   5.345  -6.727
  960   1HG   ARG 151          1HG       ARG 151   3.079   6.044  -4.779
  961   2HG   ARG 151          2HG       ARG 151   3.517   4.345  -4.553
  962   1HD   ARG 151          1HD       ARG 151   5.259   5.405  -5.851
  963   2HD   ARG 151          2HD       ARG 151   4.377   4.279  -6.893
  964    HE   ARG 151           HE       ARG 151   3.501   7.113  -6.911
  965   1HH1  ARG 151          1HH1      ARG 151   5.522   4.790  -8.608
  966   2HH1  ARG 151          2HH1      ARG 151   5.453   5.711 -10.088
  967   1HH2  ARG 151          1HH2      ARG 151   3.480   8.213  -8.830
  968   2HH2  ARG 151          2HH2      ARG 151   4.327   7.579 -10.206
  969    H    LEU 152           H        LEU 152  -0.347   2.487  -5.868
  970    HA   LEU 152           HA       LEU 152  -2.304   3.625  -7.665
  971   1HB   LEU 152          1HB       LEU 152  -1.471   1.386  -8.007
  972   2HB   LEU 152          2HB       LEU 152  -1.942   0.899  -6.375
  973    HG   LEU 152           HG       LEU 152  -4.299   0.985  -6.939
  974   1HD1  LEU 152          1HD1      LEU 152  -5.098   1.417  -9.171
  975   2HD1  LEU 152          2HD1      LEU 152  -4.239   2.854  -8.642
  976   3HD1  LEU 152          3HD1      LEU 152  -3.450   1.733  -9.767
  977   1HD2  LEU 152          1HD2      LEU 152  -2.912  -1.077  -7.455
  978   2HD2  LEU 152          2HD2      LEU 152  -4.391  -0.902  -8.427
  979   3HD2  LEU 152          3HD2      LEU 152  -2.818  -0.502  -9.130
  980    H    LYS 153           H        LYS 153  -2.515   2.195  -4.343
  981    HA   LYS 153           HA       LYS 153  -5.319   2.484  -4.044
  982   1HB   LYS 153          1HB       LYS 153  -3.821   1.142  -2.558
  983   2HB   LYS 153          2HB       LYS 153  -3.185   2.632  -1.862
  984   1HG   LYS 153          1HG       LYS 153  -4.887   1.586  -0.422
  985   2HG   LYS 153          2HG       LYS 153  -5.404   3.187  -0.949
  986   1HD   LYS 153          1HD       LYS 153  -6.875   2.144  -2.676
  987   2HD   LYS 153          2HD       LYS 153  -6.334   0.537  -2.153
  988   1HE   LYS 153          1HE       LYS 153  -7.317   0.968   0.084
  989   2HE   LYS 153          2HE       LYS 153  -7.774   2.601  -0.429
  990   1HZ   LYS 153          1HZ       LYS 153  -9.662   1.133  -0.676
  991   2HZ   LYS 153          2HZ       LYS 153  -9.166   1.557  -2.183
  992   3HZ   LYS 153          3HZ       LYS 153  -8.818   0.076  -1.593
  993    H    ARG 154           H        ARG 154  -2.668   4.810  -3.383
  994    HA   ARG 154           HA       ARG 154  -4.385   6.856  -2.253
  995   1HB   ARG 154          1HB       ARG 154  -1.763   6.591  -2.195
  996   2HB   ARG 154          2HB       ARG 154  -1.809   7.474  -3.731
  997   1HG   ARG 154          1HG       ARG 154  -3.169   9.267  -2.518
  998   2HG   ARG 154          2HG       ARG 154  -2.969   8.337  -1.029
  999   1HD   ARG 154          1HD       ARG 154  -1.294  10.049  -0.978
 1000   2HD   ARG 154          2HD       ARG 154  -0.484   8.518  -1.329
 1001    HE   ARG 154           HE       ARG 154  -1.220  10.552  -3.409
 1002   1HH1  ARG 154          1HH1      ARG 154   1.184   8.172  -2.431
 1003   2HH1  ARG 154          2HH1      ARG 154   2.242   8.656  -3.729
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.015  10.988  -4.932
 1005   2HH2  ARG 154          2HH2      ARG 154   1.597  10.301  -5.145
 1006    H    HIS 155           H        HIS 155  -3.210   6.142  -5.576
 1007    HA   HIS 155           HA       HIS 155  -4.365   8.395  -6.903
 1008   1HB   HIS 155          1HB       HIS 155  -2.820   6.997  -8.089
 1009   2HB   HIS 155          2HB       HIS 155  -3.798   5.551  -7.853
 1010    HD1  HIS 155           HD1      HIS 155  -3.934   8.852  -9.834
 1011    HD2  HIS 155           HD2      HIS 155  -5.816   5.093  -9.518
 1012    HE1  HIS 155           HE1      HIS 155  -5.794   8.863 -11.554
 1013    H    GLU 156           H        GLU 156  -5.778   5.271  -5.869
 1014    HA   GLU 156           HA       GLU 156  -8.225   5.391  -7.217
 1015   1HB   GLU 156          1HB       GLU 156  -7.173   3.600  -5.574
 1016   2HB   GLU 156          2HB       GLU 156  -8.108   4.458  -4.336
 1017   1HG   GLU 156          1HG       GLU 156 -10.170   4.077  -5.690
 1018   2HG   GLU 156          2HG       GLU 156  -9.188   3.247  -6.909
 1019    H    LYS 157           H        LYS 157  -7.155   7.250  -4.381
 1020    HA   LYS 157           HA       LYS 157  -9.710   8.140  -3.421
 1021   1HB   LYS 157          1HB       LYS 157  -7.437   8.364  -2.275
 1022   2HB   LYS 157          2HB       LYS 157  -7.088   9.679  -3.389
 1023   1HG   LYS 157          1HG       LYS 157  -7.783  10.579  -1.267
 1024   2HG   LYS 157          2HG       LYS 157  -8.947  11.002  -2.509
 1025   1HD   LYS 157          1HD       LYS 157 -10.046  10.452  -0.407
 1026   2HD   LYS 157          2HD       LYS 157 -10.528   9.326  -1.671
 1027   1HE   LYS 157          1HE       LYS 157  -8.931   7.636  -0.794
 1028   2HE   LYS 157          2HE       LYS 157  -8.385   8.784   0.434
 1029   1HZ   LYS 157          1HZ       LYS 157 -10.038   7.247   1.332
 1030   2HZ   LYS 157          2HZ       LYS 157 -10.640   8.760   1.364
 1031   3HZ   LYS 157          3HZ       LYS 157 -11.149   7.703   0.228
 1032    H    VAL 158           H        VAL 158  -7.759   9.081  -6.236
 1033    HA   VAL 158           HA       VAL 158  -8.965  11.632  -6.784
 1034    HB   VAL 158           HB       VAL 158  -7.915   9.576  -8.810
 1035   1HG1  VAL 158          1HG1      VAL 158  -7.478  11.577 -10.199
 1036   2HG1  VAL 158          2HG1      VAL 158  -9.208  11.437  -9.853
 1037   3HG1  VAL 158          3HG1      VAL 158  -8.192  12.590  -8.934
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.101  10.278  -7.189
 1039   2HG2  VAL 158          2HG2      VAL 158  -5.843  11.003  -8.802
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.588  11.958  -7.503
 1041    H    HIS 159           H        HIS 159  -9.922   8.283  -7.653
 1042    HA   HIS 159           HA       HIS 159 -12.233   9.162  -9.206
 1043   1HB   HIS 159          1HB       HIS 159 -11.298   6.447  -8.170
 1044   2HB   HIS 159          2HB       HIS 159 -12.783   6.674  -9.120
 1045    HD1  HIS 159           HD1      HIS 159 -12.077   8.388 -11.484
 1046    HD2  HIS 159           HD2      HIS 159  -9.264   5.835  -9.672
 1047    HE1  HIS 159           HE1      HIS 159 -10.162   8.115 -13.150
 1048    H    ALA 160           H        ALA 160 -11.598   8.191  -5.843
 1049    HA   ALA 160           HA       ALA 160 -14.383   7.942  -5.067
 1050   1HB   ALA 160          1HB       ALA 160 -13.499   7.985  -2.779
 1051   2HB   ALA 160          2HB       ALA 160 -12.482   6.933  -3.788
 1052   3HB   ALA 160          3HB       ALA 160 -11.931   8.571  -3.367
 1053    H    GLY 161           H        GLY 161 -12.081  10.635  -5.382
 1054   1HA   GLY 161          1HA       GLY 161 -12.695  12.898  -5.659
 1055   2HA   GLY 161          2HA       GLY 161 -14.296  12.545  -5.040
 1056    H    TYR 162           H        TYR 162 -13.288  14.799  -4.151
 1057    HA   TYR 162           HA       TYR 162 -12.278  14.187  -1.395
 1058   1HB   TYR 162          1HB       TYR 162 -11.644  16.549  -3.191
 1059   2HB   TYR 162          2HB       TYR 162 -11.116  16.393  -1.501
 1060    HD1  TYR 162           HD1      TYR 162  -9.287  14.857  -0.931
 1061    HD2  TYR 162           HD2      TYR 162 -10.847  15.050  -4.955
 1062    HE1  TYR 162           HE1      TYR 162  -7.396  13.445  -1.750
 1063    HE2  TYR 162           HE2      TYR 162  -9.166  13.442  -5.695
 1064    HH   TYR 162           HH       TYR 162  -6.873  12.764  -5.154
 1065    HA   PRO 163           HA       PRO 163 -16.301  16.208  -1.025
 1066   1HB   PRO 163          1HB       PRO 163 -17.192  14.935   1.231
 1067   2HB   PRO 163          2HB       PRO 163 -17.116  14.115  -0.357
 1068   1HG   PRO 163          1HG       PRO 163 -15.100  13.964   1.900
 1069   2HG   PRO 163          2HG       PRO 163 -15.814  12.619   0.953
 1070   1HD   PRO 163          1HD       PRO 163 -13.372  13.723   0.368
 1071   2HD   PRO 163          2HD       PRO 163 -14.459  13.076  -0.903
 1072    H    CYS 164           H        CYS 164 -16.962  17.998   0.087
 1073    HA   CYS 164           HA       CYS 164 -15.052  19.321   1.805
 1074   1HB   CYS 164          1HB       CYS 164 -16.832  20.307   0.149
 1075   2HB   CYS 164          2HB       CYS 164 -17.951  20.160   1.525
 1076    H    LYS 165           H        LYS 165 -15.050  19.687   3.953
 1077    HA   LYS 165           HA       LYS 165 -17.327  18.764   5.613
 1078   1HB   LYS 165          1HB       LYS 165 -15.833  17.579   7.187
 1079   2HB   LYS 165          2HB       LYS 165 -15.807  16.841   5.592
 1080   1HG   LYS 165          1HG       LYS 165 -13.634  17.938   5.085
 1081   2HG   LYS 165          2HG       LYS 165 -13.645  18.708   6.682
 1082   1HD   LYS 165          1HD       LYS 165 -13.650  16.472   7.759
 1083   2HD   LYS 165          2HD       LYS 165 -13.654  15.701   6.156
 1084   1HE   LYS 165          1HE       LYS 165 -11.494  16.802   5.619
 1085   2HE   LYS 165          2HE       LYS 165 -11.491  17.580   7.208
 1086   1HZ   LYS 165          1HZ       LYS 165 -10.138  15.562   7.209
 1087   2HZ   LYS 165          2HZ       LYS 165 -11.400  15.364   8.223
 1088   3HZ   LYS 165          3HZ       LYS 165 -11.411  14.643   6.756
 1089    H    LYS 166           H        LYS 166 -15.615  21.269   4.649
 1090    HA   LYS 166           HA       LYS 166 -14.586  22.462   7.102
 1091   1HB   LYS 166          1HB       LYS 166 -15.240  23.400   4.318
 1092   2HB   LYS 166          2HB       LYS 166 -15.130  24.611   5.591
 1093   1HG   LYS 166          1HG       LYS 166 -13.041  24.394   4.379
 1094   2HG   LYS 166          2HG       LYS 166 -12.880  24.063   6.110
 1095   1HD   LYS 166          1HD       LYS 166 -12.812  21.597   5.594
 1096   2HD   LYS 166          2HD       LYS 166 -12.983  21.987   3.877
 1097   1HE   LYS 166          1HE       LYS 166 -10.663  21.614   4.248
 1098   2HE   LYS 166          2HE       LYS 166 -10.864  23.352   4.033
 1099   1HZ   LYS 166          1HZ       LYS 166  -9.410  22.818   5.919
 1100   2HZ   LYS 166          2HZ       LYS 166 -10.738  23.587   6.465
 1101   3HZ   LYS 166          3HZ       LYS 166 -10.588  21.969   6.657
 1102    H    ASP 167           H        ASP 167 -17.799  22.088   5.735
 1103    HA   ASP 167           HA       ASP 167 -18.947  23.349   8.145
 1104   1HB   ASP 167          1HB       ASP 167 -18.697  25.193   6.387
 1105   2HB   ASP 167          2HB       ASP 167 -19.832  24.294   5.383
 1106    H    ASP 168           H        ASP 168 -20.983  22.536   8.674
 1107    HA   ASP 168           HA       ASP 168 -21.592  19.935   7.710
 1108   1HB   ASP 168          1HB       ASP 168 -22.125  20.828   9.985
 1109   2HB   ASP 168          2HB       ASP 168 -23.373  21.853   9.276
 1110    H    SER 169           H        SER 169 -22.783  23.127   6.700
 1111    HA   SER 169           HA       SER 169 -24.993  21.921   5.112
 1112   1HB   SER 169          1HB       SER 169 -24.167  24.830   5.533
 1113   2HB   SER 169          2HB       SER 169 -25.606  24.285   4.662
 1114    HG   SER 169           HG       SER 169 -26.043  24.850   6.859
 1115    H    CYS 170           H        CYS 170 -21.956  21.683   4.509
 1116    HA   CYS 170           HA       CYS 170 -22.099  22.651   1.682
 1117   1HB   CYS 170          1HB       CYS 170 -20.281  23.579   3.274
 1118   2HB   CYS 170          2HB       CYS 170 -19.578  21.976   3.217
 1119    H    SER 171           H        SER 171 -21.943  21.107   0.096
 1120    HA   SER 171           HA       SER 171 -21.322  18.287   0.922
 1121   1HB   SER 171          1HB       SER 171 -23.676  19.190  -0.792
 1122   2HB   SER 171          2HB       SER 171 -23.293  17.520  -0.347
 1123    HG   SER 171           HG       SER 171 -23.638  18.106   1.856
 1124    H    PHE 172           H        PHE 172 -20.017  20.566  -0.809
 1125    HA   PHE 172           HA       PHE 172 -19.935  19.645  -3.528
 1126   1HB   PHE 172          1HB       PHE 172 -19.150  21.846  -3.064
 1127   2HB   PHE 172          2HB       PHE 172 -18.110  21.301  -1.767
 1128    HD1  PHE 172           HD1      PHE 172 -15.970  20.168  -2.172
 1129    HD2  PHE 172           HD2      PHE 172 -18.357  21.643  -5.437
 1130    HE1  PHE 172           HE1      PHE 172 -14.052  19.867  -3.705
 1131    HE2  PHE 172           HE2      PHE 172 -16.369  21.525  -6.939
 1132    HZ   PHE 172           HZ       PHE 172 -14.200  20.674  -6.058
 1133    H    VAL 173           H        VAL 173 -18.600  18.187  -4.578
 1134    HA   VAL 173           HA       VAL 173 -16.462  16.858  -2.973
 1135    HB   VAL 173           HB       VAL 173 -18.273  15.467  -4.979
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.073  13.401  -4.229
 1137   2HG1  VAL 173          2HG1      VAL 173 -15.910  14.517  -4.927
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.040  14.369  -3.167
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.561  15.752  -2.984
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.923  14.108  -2.889
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.179  15.423  -1.935
 1142    H    GLY 174           H        GLY 174 -14.532  17.205  -3.833
 1143   1HA   GLY 174          1HA       GLY 174 -14.348  18.289  -6.571
 1144   2HA   GLY 174          2HA       GLY 174 -13.021  18.088  -5.413
 1145    H    LYS 175           H        LYS 175 -13.821  17.218  -8.399
 1146    HA   LYS 175           HA       LYS 175 -13.493  14.371  -8.456
 1147   1HB   LYS 175          1HB       LYS 175 -12.778  16.450 -10.584
 1148   2HB   LYS 175          2HB       LYS 175 -12.898  14.712 -10.845
 1149   1HG   LYS 175          1HG       LYS 175 -15.290  14.762 -10.174
 1150   2HG   LYS 175          2HG       LYS 175 -15.195  16.523  -9.979
 1151   1HD   LYS 175          1HD       LYS 175 -14.574  16.764 -12.368
 1152   2HD   LYS 175          2HD       LYS 175 -14.677  15.000 -12.572
 1153   1HE   LYS 175          1HE       LYS 175 -17.067  15.066 -11.886
 1154   2HE   LYS 175          2HE       LYS 175 -16.965  16.818 -11.684
 1155   1HZ   LYS 175          1HZ       LYS 175 -16.564  15.376 -14.251
 1156   2HZ   LYS 175          2HZ       LYS 175 -17.891  16.236 -13.850
 1157   3HZ   LYS 175          3HZ       LYS 175 -16.464  16.997 -14.064
 1158    H    THR 176           H        THR 176 -11.223  16.879  -7.747
 1159    HA   THR 176           HA       THR 176  -9.093  14.867  -7.467
 1160    HB   THR 176           HB       THR 176  -7.562  16.875  -8.525
 1161    HG1  THR 176           HG1      THR 176  -8.793  18.083  -9.646
 1162   1HG2  THR 176          1HG2      THR 176  -7.315  15.452 -10.518
 1163   2HG2  THR 176          2HG2      THR 176  -7.253  14.522  -9.002
 1164   3HG2  THR 176          3HG2      THR 176  -8.716  14.515 -10.031
 1165    H    TRP 177           H        TRP 177  -7.250  15.708  -6.224
 1166    HA   TRP 177           HA       TRP 177  -8.123  16.971  -3.887
 1167   1HB   TRP 177          1HB       TRP 177  -6.174  15.585  -3.904
 1168   2HB   TRP 177          2HB       TRP 177  -5.368  16.597  -5.083
 1169    HD1  TRP 177           HD1      TRP 177  -3.425  17.612  -4.069
 1170    HE1  TRP 177           HE1      TRP 177  -2.768  18.818  -1.896
 1171    HE3  TRP 177           HE3      TRP 177  -7.696  16.767  -1.458
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.675  18.603   0.829
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.690  17.076   1.008
 1174    HH2  TRP 177           HH2      TRP 177  -5.666  17.914   2.162
 1175    H    THR 178           H        THR 178  -6.416  18.442  -6.708
 1176    HA   THR 178           HA       THR 178  -6.039  21.043  -5.660
 1177    HB   THR 178           HB       THR 178  -6.369  21.775  -8.103
 1178    HG1  THR 178           HG1      THR 178  -6.063  19.195  -8.962
 1179   1HG2  THR 178          1HG2      THR 178  -4.261  19.664  -7.627
 1180   2HG2  THR 178          2HG2      THR 178  -4.283  20.882  -8.912
 1181   3HG2  THR 178          3HG2      THR 178  -4.141  21.382  -7.218
 1182    H    LEU 179           H        LEU 179  -8.876  19.743  -7.473
 1183    HA   LEU 179           HA       LEU 179 -10.326  22.153  -7.545
 1184   1HB   LEU 179          1HB       LEU 179 -11.399  19.296  -7.416
 1185   2HB   LEU 179          2HB       LEU 179 -12.330  20.719  -7.886
 1186    HG   LEU 179           HG       LEU 179  -9.959  19.536  -9.355
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.611  19.048 -11.099
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.069  18.309  -9.559
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.897  19.785 -10.111
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.506  21.189 -11.162
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.617  22.006 -10.042
 1192   3HD2  LEU 179          3HD2      LEU 179  -9.867  21.956  -9.711
 1193    H    TYR 180           H        TYR 180 -10.129  19.718  -4.949
 1194    HA   TYR 180           HA       TYR 180 -12.281  20.867  -3.359
 1195   1HB   TYR 180          1HB       TYR 180 -11.775  18.649  -2.916
 1196   2HB   TYR 180          2HB       TYR 180 -10.036  18.907  -2.842
 1197    HD1  TYR 180           HD1      TYR 180  -9.117  18.666  -0.730
 1198    HD2  TYR 180           HD2      TYR 180 -13.092  20.303  -1.073
 1199    HE1  TYR 180           HE1      TYR 180  -9.272  18.806   1.750
 1200    HE2  TYR 180           HE2      TYR 180 -13.197  20.542   1.400
 1201    HH   TYR 180           HH       TYR 180 -10.595  19.294   3.534
 1202    H    LEU 181           H        LEU 181  -8.682  21.013  -3.214
 1203    HA   LEU 181           HA       LEU 181  -8.501  22.851  -1.080
 1204   1HB   LEU 181          1HB       LEU 181  -6.732  22.368  -3.513
 1205   2HB   LEU 181          2HB       LEU 181  -6.320  23.514  -2.270
 1206    HG   LEU 181           HG       LEU 181  -6.704  20.490  -1.919
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.227  20.746  -1.246
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.622  20.810  -2.964
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.286  22.313  -2.052
 1210   1HD2  LEU 181          1HD2      LEU 181  -6.157  22.601   0.172
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.435  21.369   0.147
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.773  20.868   0.418
 1213    H    LYS 182           H        LYS 182  -8.835  23.509  -4.610
 1214    HA   LYS 182           HA       LYS 182  -8.704  26.385  -4.427
 1215   1HB   LYS 182          1HB       LYS 182  -9.903  24.477  -6.488
 1216   2HB   LYS 182          2HB       LYS 182 -10.004  26.234  -6.646
 1217   1HG   LYS 182          1HG       LYS 182  -7.509  26.379  -6.425
 1218   2HG   LYS 182          2HG       LYS 182  -7.427  24.617  -6.474
 1219   1HD   LYS 182          1HD       LYS 182  -8.512  24.665  -8.747
 1220   2HD   LYS 182          2HD       LYS 182  -8.542  26.441  -8.646
 1221   1HE   LYS 182          1HE       LYS 182  -5.989  26.249  -8.183
 1222   2HE   LYS 182          2HE       LYS 182  -6.122  24.595  -8.791
 1223   1HZ   LYS 182          1HZ       LYS 182  -6.903  27.052 -10.280
 1224   2HZ   LYS 182          2HZ       LYS 182  -5.515  26.228 -10.519
 1225   3HZ   LYS 182          3HZ       LYS 182  -6.923  25.535 -10.927
 1226    H    HIS 183           H        HIS 183 -11.462  24.067  -4.318
 1227    HA   HIS 183           HA       HIS 183 -13.550  26.013  -4.105
 1228   1HB   HIS 183          1HB       HIS 183 -14.164  23.763  -4.577
 1229   2HB   HIS 183          2HB       HIS 183 -13.270  23.107  -3.224
 1230    HD1  HIS 183           HD1      HIS 183 -16.643  24.801  -3.907
 1231    HD2  HIS 183           HD2      HIS 183 -14.349  23.196  -0.764
 1232    HE1  HIS 183           HE1      HIS 183 -18.188  24.659  -1.882
 1233    H    VAL 184           H        VAL 184 -11.512  24.395  -1.627
 1234    HA   VAL 184           HA       VAL 184 -12.822  25.477   0.674
 1235    HB   VAL 184           HB       VAL 184 -10.092  24.318   0.111
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.501  24.389   2.469
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.561  26.015   1.793
 1238   3HG1  VAL 184          3HG1      VAL 184 -10.908  25.437   2.814
 1239   1HG2  VAL 184          1HG2      VAL 184 -10.938  22.601   1.657
 1240   2HG2  VAL 184          2HG2      VAL 184 -12.463  23.555   1.864
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.021  22.847   0.300
 1242    H    ALA 185           H        ALA 185 -10.016  26.633  -1.233
 1243    HA   ALA 185           HA       ALA 185  -9.387  28.807   0.455
 1244   1HB   ALA 185          1HB       ALA 185  -8.132  29.668  -1.491
 1245   2HB   ALA 185          2HB       ALA 185  -7.877  27.925  -1.294
 1246   3HB   ALA 185          3HB       ALA 185  -8.975  28.523  -2.557
 1247    H    GLU 186           H        GLU 186 -11.804  28.472  -2.125
 1248    HA   GLU 186           HA       GLU 186 -12.324  31.376  -2.241
 1249   1HB   GLU 186          1HB       GLU 186 -12.302  29.892  -4.257
 1250   2HB   GLU 186          2HB       GLU 186 -13.736  29.061  -3.645
 1251   1HG   GLU 186          1HG       GLU 186 -15.056  31.115  -3.848
 1252   2HG   GLU 186          2HG       GLU 186 -13.606  32.053  -4.227
 1253    H    CYS 187           H        CYS 187 -13.792  28.467  -0.795
 1254    HA   CYS 187           HA       CYS 187 -16.294  29.993  -0.208
 1255   1HB   CYS 187          1HB       CYS 187 -15.731  26.989  -0.198
 1256   2HB   CYS 187          2HB       CYS 187 -17.296  27.747   0.132
 1257    HG   CYS 187           HG       CYS 187 -15.423  27.825  -2.578
 1258    H    HIS 188           H        HIS 188 -13.519  28.600   1.450
 1259    HA   HIS 188           HA       HIS 188 -14.891  29.077   4.079
 1260   1HB   HIS 188          1HB       HIS 188 -13.094  26.719   3.392
 1261   2HB   HIS 188          2HB       HIS 188 -13.839  27.037   4.972
 1262    HD1  HIS 188           HD1      HIS 188 -16.745  27.043   4.796
 1263    HD2  HIS 188           HD2      HIS 188 -14.382  25.245   1.832
 1264    HE1  HIS 188           HE1      HIS 188 -18.277  25.401   3.569
 1265    H    GLN 189           H        GLN 189 -12.592  30.310   2.198
 1266    HA   GLN 189           HA       GLN 189 -10.973  31.169   4.533
 1267   1HB   GLN 189          1HB       GLN 189  -9.688  30.214   1.946
 1268   2HB   GLN 189          2HB       GLN 189  -8.848  30.910   3.318
 1269   1HG   GLN 189          1HG       GLN 189  -9.581  28.988   4.732
 1270   2HG   GLN 189          2HG       GLN 189 -10.258  28.211   3.298
 1271   1HE2  GLN 189          1HE2      GLN 189  -8.103  27.204   5.046
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.698  27.001   4.007
 1273    H    ASP 190           H        ASP 190  -9.401  33.012   3.744
 1274    HA   ASP 190           HA       ASP 190 -10.489  34.610   1.501
 1275   1HB   ASP 190          1HB       ASP 190 -11.951  35.257   3.370
 1276   2HB   ASP 190          2HB       ASP 190 -10.552  35.548   4.404
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1  -7.556  30.454 -12.620
    2   2H5*    G   1          2H5*        G   1  -8.404  28.987 -12.104
    3    H4*    G   1           H4*        G   1  -8.056  28.923 -14.486
    4    H3*    G   1           H3*        G   1  -6.269  26.981 -13.009
    5    H2*    G   1           H2*        G   1  -5.723  26.098 -15.220
    6   2HO*    G   1          2HO*        G   1  -8.001  26.641 -16.051
    7    H1*    G   1           H1*        G   1  -5.189  28.540 -16.237
    8    H8     G   1           H8         G   1  -4.227  29.043 -12.634
    9    H1     G   1           H1         G   1   0.168  25.852 -16.078
   10   1H2     G   1          1H2         G   1  -0.722  25.058 -17.886
   11   2H2     G   1          2H2         G   1  -2.353  25.478 -18.366
   12   1H5*    G   2          1H5*        G   2  -8.260  24.669 -15.843
   13   2H5*    G   2          2H5*        G   2  -8.815  23.123 -15.208
   14    H4*    G   2           H4*        G   2  -7.480  22.826 -17.212
   15    H3*    G   2           H3*        G   2  -6.078  21.817 -14.727
   16    H2*    G   2           H2*        G   2  -4.470  20.832 -16.292
   17   2HO*    G   2          2HO*        G   2  -6.268  20.540 -18.000
   18    H1*    G   2           H1*        G   2  -4.151  23.152 -17.630
   19    H8     G   2           H8         G   2  -4.937  24.399 -14.162
   20    H1     G   2           H1         G   2   1.027  22.062 -14.721
   21   1H2     G   2          1H2         G   2   1.163  20.779 -16.449
   22   2H2     G   2          2H2         G   2  -0.144  20.636 -17.607
   23   1H5*    G   3          1H5*        G   3  -6.024  18.688 -17.463
   24   2H5*    G   3          2H5*        G   3  -6.588  17.161 -16.782
   25    H4*    G   3           H4*        G   3  -4.404  16.862 -17.906
   26    H3*    G   3           H3*        G   3  -4.551  16.563 -14.882
   27    H2*    G   3           H2*        G   3  -2.215  15.978 -14.915
   28   2HO*    G   3          2HO*        G   3  -2.664  14.783 -17.083
   29    H1*    G   3           H1*        G   3  -1.427  17.812 -16.796
   30    H8     G   3           H8         G   3  -3.891  19.655 -14.572
   31    H1     G   3           H1         G   3   2.027  19.160 -12.099
   32   1H2     G   3          1H2         G   3   3.058  17.491 -12.995
   33   2H2     G   3          2H2         G   3   2.416  16.643 -14.389
   34   1H5*    C   4          1H5*        C   4  -2.389  13.116 -15.710
   35   2H5*    C   4          2H5*        C   4  -3.070  11.729 -14.861
   36    H4*    C   4           H4*        C   4  -0.803  11.980 -14.154
   37    H3*    C   4           H3*        C   4  -2.682  12.991 -11.995
   38    H2*    C   4           H2*        C   4  -0.742  13.163 -10.619
   39   2HO*    C   4          2HO*        C   4   0.128  11.047 -11.546
   40    H1*    C   4           H1*        C   4   0.920  14.067 -12.671
   41   1H4     C   4          1H4         C   4  -0.896  18.997  -9.067
   42   2H4     C   4          2H4         C   4  -2.424  19.093  -9.910
   43    H5     C   4           H5         C   4  -3.067  17.565 -11.638
   44    H6     C   4           H6         C   4  -2.416  15.538 -12.839
   45   1H5*    C   5          1H5*        C   5  -1.463  11.580  -9.191
   46   2H5*    C   5          2H5*        C   5  -2.525  10.452  -8.364
   47    H4*    C   5           H4*        C   5  -1.841  12.410  -7.041
   48    H3*    C   5           H3*        C   5  -4.329  11.226  -6.850
   49    H2*    C   5           H2*        C   5  -5.352  12.795  -8.401
   50   2HO*    C   5          2HO*        C   5  -5.602  13.651  -5.716
   51    H1*    C   5           H1*        C   5  -3.982  15.028  -6.977
   52   1H4     C   5          1H4         C   5  -6.057  18.346 -11.937
   53   2H4     C   5          2H4         C   5  -5.834  16.995 -13.017
   54    H5     C   5           H5         C   5  -4.984  14.882 -12.300
   55    H6     C   5           H6         C   5  -4.399  13.528 -10.363
   56   1H5*    A   6          1H5*        A   6  -2.145  14.519  -4.715
   57   2H5*    A   6          2H5*        A   6  -0.813  13.357  -4.722
   58    H4*    A   6           H4*        A   6  -0.125  15.276  -3.648
   59    H3*    A   6           H3*        A   6  -0.438  12.956  -1.816
   60    H2*    A   6           H2*        A   6  -0.057  14.327   0.120
   61   2HO*    A   6          2HO*        A   6   1.679  15.617  -0.357
   62    H1*    A   6           H1*        A   6  -1.323  16.615  -0.675
   63    H8     A   6           H8         A   6  -3.966  14.611  -1.987
   64   1H6     A   6          1H6         A   6  -5.792  13.373   3.809
   65   2H6     A   6          2H6         A   6  -6.181  13.181   2.117
   66    H2     A   6           H2         A   6  -1.806  15.303   4.029
   67   1H5*    U   7          1H5*        U   7   3.329  12.247   0.371
   68   2H5*    U   7          2H5*        U   7   2.342  13.613  -0.128
   69    H4*    U   7           H4*        U   7   4.181  14.362   1.224
   70    H3*    U   7           H3*        U   7   3.467  15.602  -1.143
   71    H2*    U   7           H2*        U   7   5.119  14.447  -2.417
   72   2HO*    U   7          2HO*        U   7   6.041  16.965  -1.541
   73    H1*    U   7           H1*        U   7   7.123  14.961  -0.194
   74    H3     U   7           H3         U   7  10.427  13.006  -2.533
   75    H5     U   7           H5         U   7   7.386  10.138  -2.563
   76    H6     U   7           H6         U   7   5.864  11.808  -1.618
   77   1H5*    A   8          1H5*        A   8   4.429  19.311  -1.209
   78   2H5*    A   8          2H5*        A   8   3.777  20.139   0.212
   79    H4*    A   8           H4*        A   8   2.970  21.286  -1.660
   80    H3*    A   8           H3*        A   8   1.181  20.339   0.171
   81    H2*    A   8           H2*        A   8   0.693  18.380  -1.175
   82   2HO*    A   8          2HO*        A   8  -1.352  19.356  -0.595
   83    H1*    A   8           H1*        A   8   0.430  20.343  -3.448
   84    H8     A   8           H8         A   8   2.540  17.131  -3.404
   85   1H6     A   8          1H6         A   8  -1.351  15.194  -7.826
   86   2H6     A   8          2H6         A   8   0.221  14.954  -7.102
   87    H2     A   8           H2         A   8  -3.065  18.867  -6.008
   88   1H5*    C   9          1H5*        C   9  -2.055  21.794  -0.614
   89   2H5*    C   9          2H5*        C   9  -2.322  23.296   0.279
   90    H4*    C   9           H4*        C   9  -3.902  21.692   1.021
   91    H3*    C   9           H3*        C   9  -1.784  22.197   3.095
   92    H2*    C   9           H2*        C   9  -3.050  20.712   4.536
   93   2HO*    C   9          2HO*        C   9  -5.153  21.545   3.373
   94    H1*    C   9           H1*        C   9  -3.468  18.792   2.669
   95   1H4     C   9          1H4         C   9   2.174  17.501   5.474
   96   2H4     C   9          2H4         C   9   2.969  18.057   4.017
   97    H5     C   9           H5         C   9   1.815  19.193   2.260
   98    H6     C   9           H6         C   9  -0.357  20.015   1.519
   99   1H5*    C  10          1H5*        C  10  -5.271  22.385   5.144
  100   2H5*    C  10          2H5*        C  10  -5.424  23.755   6.241
  101    H4*    C  10           H4*        C  10  -5.658  21.614   7.434
  102    H3*    C  10           H3*        C  10  -3.130  23.157   8.106
  103    H2*    C  10           H2*        C  10  -2.815  21.546   9.864
  104   2HO*    C  10          2HO*        C  10  -5.191  21.366  10.327
  105    H1*    C  10           H1*        C  10  -3.374  19.385   8.244
  106   1H4     C  10          1H4         C  10   2.909  20.066   7.765
  107   2H4     C  10          2H4         C  10   2.695  21.008   6.305
  108    H5     C  10           H5         C  10   0.553  21.748   5.518
  109    H6     C  10           H6         C  10  -1.852  21.724   5.988
  110   1H5*    U  11          1H5*        U  11  -4.511  23.229  11.976
  111   2H5*    U  11          2H5*        U  11  -4.112  24.785  12.720
  112    H4*    U  11           H4*        U  11  -2.899  22.754  13.626
  113    H3*    U  11           H3*        U  11  -1.281  25.023  12.473
  114    H2*    U  11           H2*        U  11   0.610  23.968  13.488
  115   2HO*    U  11          2HO*        U  11  -0.656  23.314  15.463
  116    H1*    U  11           H1*        U  11  -0.147  21.440  12.717
  117    H3     U  11           H3         U  11   3.499  22.473  10.149
  118    H5     U  11           H5         U  11   0.364  24.555   8.313
  119    H6     U  11           H6         U  11  -1.090  23.911  10.184
  120   1H5*    C  12          1H5*        C  12   0.431  25.722  16.601
  121   2H5*    C  12          2H5*        C  12   1.235  27.236  16.210
  122    H4*    C  12           H4*        C  12   2.216  24.492  16.182
  123    H3*    C  12           H3*        C  12   3.251  26.899  16.935
  124    H2*    C  12           H2*        C  12   3.232  27.723  14.633
  125   2HO*    C  12          2HO*        C  12   5.722  27.080  15.697
  126    H1*    C  12           H1*        C  12   4.644  25.114  13.959
  127   1H4     C  12          1H4         C  12   4.356  27.609   8.116
  128   2H4     C  12          2H4         C  12   2.641  27.895   8.263
  129    H5     C  12           H5         C  12   1.402  27.449  10.271
  130    H6     C  12           H6         C  12   1.570  26.630  12.574
  131   1H5*    U  13          1H5*        U  13   4.650  22.736  18.075
  132   2H5*    U  13          2H5*        U  13   5.554  22.940  19.576
  133    H4*    U  13           H4*        U  13   6.466  20.955  18.921
  134    H3*    U  13           H3*        U  13   8.335  22.949  18.422
  135    H2*    U  13           H2*        U  13   7.571  23.250  16.140
  136   2HO*    U  13          2HO*        U  13   9.799  21.470  16.219
  137    H1*    U  13           H1*        U  13   7.648  20.207  15.967
  138    H3     U  13           H3         U  13   7.079  20.574  11.477
  139    H5     U  13           H5         U  13   4.198  23.193  12.986
  140    H6     U  13           H6         U  13   5.017  22.716  15.252
  141   1H5*    U  14          1H5*        U  14  10.785  18.035  19.366
  142   2H5*    U  14          2H5*        U  14  12.224  18.645  18.554
  143    H4*    U  14           H4*        U  14   9.415  18.435  17.423
  144    H3*    U  14           H3*        U  14  11.673  16.672  17.347
  145    H2*    U  14           H2*        U  14  12.855  18.068  15.884
  146   2HO*    U  14          2HO*        U  14  11.234  16.291  14.373
  147    H1*    U  14           H1*        U  14  10.184  18.732  14.559
  148    H3     U  14           H3         U  14  12.537  20.765  11.215
  149    H5     U  14           H5         U  14  14.237  22.374  14.682
  150    H6     U  14           H6         U  14  12.826  20.866  16.013
  151   1H5*    G  15          1H5*        G  15   6.948  13.998  15.851
  152   2H5*    G  15          2H5*        G  15   7.465  15.454  14.980
  153    H4*    G  15           H4*        G  15   5.203  15.516  16.999
  154    H3*    G  15           H3*        G  15   5.066  14.880  14.042
  155    H2*    G  15           H2*        G  15   2.783  15.714  14.193
  156   2HO*    G  15          2HO*        G  15   2.482  14.911  16.481
  157    H1*    G  15           H1*        G  15   3.603  17.958  15.485
  158    H8     G  15           H8         G  15   6.563  17.352  13.275
  159    H1     G  15           H1         G  15   1.399  19.359  10.012
  160   1H2     G  15          1H2         G  15  -0.384  19.057  11.193
  161   2H2     G  15          2H2         G  15  -0.312  18.588  12.879
  162   1H5*    G  16          1H5*        G  16   1.390  13.407  15.410
  163   2H5*    G  16          2H5*        G  16   1.088  11.793  14.759
  164    H4*    G  16           H4*        G  16  -0.799  13.258  14.346
  165    H3*    G  16           H3*        G  16   0.711  12.566  11.812
  166    H2*    G  16           H2*        G  16  -1.203  13.559  10.680
  167   2HO*    G  16          2HO*        G  16  -2.776  12.754  12.364
  168    H1*    G  16           H1*        G  16  -1.210  15.768  12.247
  169    H8     G  16           H8         G  16   2.463  15.016  12.096
  170    H1     G  16           H1         G  16   0.179  16.838   6.399
  171   1H2     G  16          1H2         G  16  -1.985  17.127   6.488
  172   2H2     G  16          2H2         G  16  -2.906  16.607   7.885
  173   1H5*    G  17          1H5*        G  17  -3.042  11.342  10.621
  174   2H5*    G  17          2H5*        G  17  -2.960   9.825   9.713
  175    H4*    G  17           H4*        G  17  -3.906  11.680   8.400
  176    H3*    G  17           H3*        G  17  -1.267  10.616   7.361
  177    H2*    G  17           H2*        G  17  -1.683  12.091   5.440
  178   2HO*    G  17          2HO*        G  17  -4.078  11.758   5.614
  179    H1*    G  17           H1*        G  17  -2.101  14.253   6.924
  180    H8     G  17           H8         G  17   0.144  12.536   9.326
  181    H1     G  17           H1         G  17   3.223  14.944   4.228
  182   1H2     G  17          1H2         G  17   1.793  15.520   2.695
  183   2H2     G  17          2H2         G  17   0.088  15.115   2.832
  184   1H5*    C  18          1H5*        C  18  -3.056  10.408   3.821
  185   2H5*    C  18          2H5*        C  18  -2.804   8.864   2.988
  186    H4*    C  18           H4*        C  18  -1.833  10.681   1.692
  187    H3*    C  18           H3*        C  18   0.338   8.990   2.994
  188    H2*    C  18           H2*        C  18   1.875  10.331   1.562
  189   2HO*    C  18          2HO*        C  18   0.704  10.973  -0.297
  190    H1*    C  18           H1*        C  18   0.879  12.606   2.452
  191   1H4     C  18          1H4         C  18   4.917  11.063   7.075
  192   2H4     C  18          2H4         C  18   3.568  10.535   8.048
  193    H5     C  18           H5         C  18   1.318  10.403   7.225
  194    H6     C  18           H6         C  18  -0.080  10.709   5.256
  195   1H5*    C  19          1H5*        C  19   1.987   9.026  -0.775
  196   2H5*    C  19          2H5*        C  19   2.397   7.378  -1.295
  197    H4*    C  19           H4*        C  19   4.354   8.792  -1.463
  198    H3*    C  19           H3*        C  19   4.489   6.775   0.818
  199    H2*    C  19           H2*        C  19   6.799   7.332   0.937
  200   2HO*    C  19          2HO*        C  19   7.583   7.559  -1.091
  201    H1*    C  19           H1*        C  19   6.356  10.044   0.648
  202   1H4     C  19          1H4         C  19   6.775   8.484   6.835
  203   2H4     C  19          2H4         C  19   5.078   8.067   6.878
  204    H5     C  19           H5         C  19   3.671   8.073   4.933
  205    H6     C  19           H6         C  19   3.594   8.577   2.536
  206   1H5*    U  20          1H5*        U  20   7.655   5.600  -1.599
  207   2H5*    U  20          2H5*        U  20   7.717   3.844  -1.749
  208    H4*    U  20           H4*        U  20   9.820   4.718  -0.939
  209    H3*    U  20           H3*        U  20   8.368   3.247   1.284
  210    H2*    U  20           H2*        U  20  10.536   3.325   2.371
  211   2HO*    U  20          2HO*        U  20  11.837   3.103   0.367
  212    H1*    U  20           H1*        U  20  10.828   5.977   1.802
  213    H3     U  20           H3         U  20   9.739   5.539   6.249
  214    H5     U  20           H5         U  20   6.048   5.430   4.286
  215    H6     U  20           H6         U  20   7.246   5.391   2.139
  216   1H5*    G  21          1H5*        G  21  11.941   1.176   0.541
  217   2H5*    G  21          2H5*        G  21  11.791  -0.567   0.730
  218    H4*    G  21           H4*        G  21  13.641   0.325   2.038
  219    H3*    G  21           H3*        G  21  11.380  -0.673   3.803
  220    H2*    G  21           H2*        G  21  12.980  -0.356   5.621
  221   2HO*    G  21          2HO*        G  21  14.877  -0.915   4.101
  222    H1*    G  21           H1*        G  21  13.640   2.143   4.799
  223    H8     G  21           H8         G  21   9.990   1.792   3.802
  224    H1     G  21           H1         G  21  10.847   2.583  10.133
  225   1H2     G  21          1H2         G  21  12.920   2.265  10.646
  226   2H2     G  21          2H2         G  21  14.154   2.029   9.424
  227   1H5*    G  22          1H5*        G  22  14.815  -2.588   5.112
  228   2H5*    G  22          2H5*        G  22  14.604  -4.324   5.339
  229    H4*    G  22           H4*        G  22  15.618  -3.297   7.302
  230    H3*    G  22           H3*        G  22  12.798  -4.335   7.775
  231    H2*    G  22           H2*        G  22  13.108  -3.763  10.065
  232   2HO*    G  22          2HO*        G  22  15.369  -4.516  10.150
  233    H1*    G  22           H1*        G  22  14.368  -1.362   9.607
  234    H8     G  22           H8         G  22  11.641  -1.512   6.996
  235    H1     G  22           H1         G  22   9.405  -0.352  12.916
  236   1H2     G  22          1H2         G  22  10.913  -0.814  14.383
  237   2H2     G  22          2H2         G  22  12.537  -1.300  13.935
  238   1H5*    U  23          1H5*        U  23  12.412  -8.163  10.697
  239   2H5*    U  23          2H5*        U  23  11.499  -6.819   9.978
  240    H4*    U  23           H4*        U  23  12.917  -6.711  12.657
  241    H3*    U  23           H3*        U  23  10.003  -6.837  11.792
  242    H2*    U  23           H2*        U  23   9.499  -5.978  13.959
  243   2HO*    U  23          2HO*        U  23  11.327  -7.086  15.080
  244    H1*    U  23           H1*        U  23  11.360  -3.991  13.642
  245    H3     U  23           H3         U  23   6.912  -2.663  12.943
  246    H5     U  23           H5         U  23   8.452  -3.533   9.155
  247    H6     U  23           H6         U  23  10.496  -4.382  10.231
  248   1H5*    U  24          1H5*        U  24   9.442  -8.583  14.963
  249   2H5*    U  24          2H5*        U  24   8.705 -10.187  14.995
  250    H4*    U  24           H4*        U  24   7.356  -8.707  16.306
  251    H3*    U  24           H3*        U  24   6.091  -9.160  13.605
  252    H2*    U  24           H2*        U  24   4.104  -8.285  14.514
  253   2HO*    U  24          2HO*        U  24   4.315  -9.238  16.692
  254    H1*    U  24           H1*        U  24   5.485  -6.204  15.722
  255    H3     U  24           H3         U  24   3.000  -4.706  12.096
  256    H5     U  24           H5         U  24   6.603  -6.061  10.440
  257    H6     U  24           H6         U  24   7.280  -6.843  12.667
  258   1H5*    A  25          1H5*        A  25   4.600 -13.130  12.170
  259   2H5*    A  25          2H5*        A  25   6.312 -13.460  11.967
  260    H4*    A  25           H4*        A  25   5.438 -12.966   9.809
  261    H3*    A  25           H3*        A  25   7.579 -11.409  10.675
  262    H2*    A  25           H2*        A  25   6.042  -9.609  11.337
  263   2HO*    A  25          2HO*        A  25   7.716  -8.745  10.030
  264    H1*    A  25           H1*        A  25   4.840 -10.305   8.606
  265    H8     A  25           H8         A  25   3.272  -9.230  12.045
  266   1H6     A  25          1H6         A  25   0.515  -4.804   8.628
  267   2H6     A  25          2H6         A  25   0.435  -5.676  10.145
  268    H2     A  25           H2         A  25   3.492  -6.915   6.071
  269   1H5*    G  26          1H5*        G  26   7.573 -14.148   5.416
  270   2H5*    G  26          2H5*        G  26   7.610 -12.401   5.277
  271    H4*    G  26           H4*        G  26   5.557 -13.078   7.194
  272    H3*    G  26           H3*        G  26   5.758 -15.289   5.503
  273    H2*    G  26           H2*        G  26   5.657 -13.798   3.647
  274   2HO*    G  26          2HO*        G  26   4.253 -15.659   3.300
  275    H1*    G  26           H1*        G  26   3.194 -12.756   5.089
  276    H8     G  26           H8         G  26   5.299 -12.508   1.934
  277    H1     G  26           H1         G  26   0.849  -7.927   2.530
  278   1H2     G  26          1H2         G  26   0.196  -7.824   4.589
  279   2H2     G  26          2H2         G  26   0.622  -9.051   5.772
  280   1H5*    U  27          1H5*        U  27   4.426 -15.820   8.703
  281   2H5*    U  27          2H5*        U  27   3.657 -17.402   8.947
  282    H4*    U  27           H4*        U  27   3.405 -16.460  11.049
  283    H3*    U  27           H3*        U  27   0.878 -15.653   9.549
  284    H2*    U  27           H2*        U  27   0.216 -14.350  11.438
  285   2HO*    U  27          2HO*        U  27   1.336 -16.063  12.921
  286    H1*    U  27           H1*        U  27   2.580 -13.128  11.859
  287    H3     U  27           H3         U  27  -0.082 -10.156   9.557
  288    H5     U  27           H5         U  27   2.586 -11.791   6.807
  289    H6     U  27           H6         U  27   3.081 -13.570   8.413
  290   1H5*    A  28          1H5*        A  28  -0.818 -15.883  13.141
  291   2H5*    A  28          2H5*        A  28  -2.086 -17.108  13.112
  292    H4*    A  28           H4*        A  28  -3.033 -15.016  13.853
  293    H3*    A  28           H3*        A  28  -3.878 -15.712  11.010
  294    H2*    A  28           H2*        A  28  -5.351 -13.799  11.172
  295   2HO*    A  28          2HO*        A  28  -5.777 -14.238  13.551
  296    H1*    A  28           H1*        A  28  -3.459 -12.172  12.269
  297    H8     A  28           H8         A  28  -1.268 -13.992   9.906
  298   1H6     A  28          1H6         A  28  -3.503 -10.174   5.523
  299   2H6     A  28          2H6         A  28  -2.253 -11.351   5.888
  300    H2     A  28           H2         A  28  -6.479 -10.406   8.798
  301   1H5*    C  29          1H5*        C  29  -7.498 -15.074  12.147
  302   2H5*    C  29          2H5*        C  29  -8.650 -16.324  11.657
  303    H4*    C  29           H4*        C  29  -9.167 -14.237  10.540
  304    H3*    C  29           H3*        C  29  -7.982 -16.278   8.639
  305    H2*    C  29           H2*        C  29  -8.538 -14.672   6.878
  306   2HO*    C  29          2HO*        C  29 -10.572 -13.956   8.035
  307    H1*    C  29           H1*        C  29  -7.482 -12.577   8.151
  308   1H4     C  29          1H4         C  29  -2.681 -15.239   4.888
  309   2H4     C  29          2H4         C  29  -2.184 -16.096   6.328
  310    H5     C  29           H5         C  29  -3.473 -16.137   8.346
  311    H6     C  29           H6         C  29  -5.500 -15.295   9.420
  312   1H5*    C  30          1H5*        C  30 -11.536 -15.393   6.703
  313   2H5*    C  30          2H5*        C  30 -12.348 -16.846   6.100
  314    H4*    C  30           H4*        C  30 -11.867 -15.265   4.293
  315    H3*    C  30           H3*        C  30 -10.151 -17.760   4.128
  316    H2*    C  30           H2*        C  30  -9.575 -16.940   1.912
  317   2HO*    C  30          2HO*        C  30 -11.839 -15.931   1.659
  318    H1*    C  30           H1*        C  30  -9.115 -14.408   2.841
  319   1H4     C  30          1H4         C  30  -3.718 -17.832   3.021
  320   2H4     C  30          2H4         C  30  -4.059 -18.325   4.664
  321    H5     C  30           H5         C  30  -6.097 -17.767   5.811
  322    H6     C  30           H6         C  30  -8.252 -16.619   5.582
  323   1H5*    U  31          1H5*        U  31 -12.238 -17.365   0.388
  324   2H5*    U  31          2H5*        U  31 -13.109 -18.843  -0.018
  325    H4*    U  31           H4*        U  31 -12.043 -17.932  -1.984
  326    H3*    U  31           H3*        U  31 -10.692 -20.475  -1.062
  327    H2*    U  31           H2*        U  31  -9.483 -20.397  -3.130
  328   2HO*    U  31          2HO*        U  31 -11.407 -19.524  -4.351
  329    H1*    U  31           H1*        U  31  -8.915 -17.727  -2.944
  330    H3     U  31           H3         U  31  -5.014 -20.029  -1.992
  331    H5     U  31           H5         U  31  -6.989 -19.611   1.682
  332    H6     U  31           H6         U  31  -8.988 -18.867   0.473
  333   1H5*    C  32          1H5*        C  32 -11.795 -21.720  -4.658
  334   2H5*    C  32          2H5*        C  32 -12.466 -23.354  -4.706
  335    H4*    C  32           H4*        C  32 -10.423 -23.246  -6.016
  336    H3*    C  32           H3*        C  32  -9.983 -24.768  -3.425
  337    H2*    C  32           H2*        C  32  -7.772 -25.236  -4.274
  338   2HO*    C  32          2HO*        C  32  -8.719 -25.371  -6.593
  339    H1*    C  32           H1*        C  32  -7.340 -22.683  -5.217
  340   1H4     C  32          1H4         C  32  -4.860 -23.278   0.634
  341   2H4     C  32          2H4         C  32  -6.423 -23.008   1.371
  342    H5     C  32           H5         C  32  -8.434 -22.676   0.103
  343    H6     C  32           H6         C  32  -9.364 -22.610  -2.162
  344   1H5*    U  33          1H5*        U  33  -8.014 -27.201  -5.624
  345   2H5*    U  33          2H5*        U  33  -8.638 -28.851  -5.615
  346    H4*    U  33           H4*        U  33  -6.302 -28.946  -4.998
  347    H3*    U  33           H3*        U  33  -8.123 -29.254  -2.589
  348    H2*    U  33           H2*        U  33  -6.295 -29.612  -1.282
  349   2HO*    U  33          2HO*        U  33  -4.323 -29.943  -3.342
  350    H1*    U  33           H1*        U  33  -4.575 -27.883  -2.716
  351    H3     U  33           H3         U  33  -4.602 -26.431   1.619
  352    H5     U  33           H5         U  33  -8.564 -25.865   0.406
  353    H6     U  33           H6         U  33  -7.980 -26.813  -1.783
  354   1H5*    U  34          1H5*        U  34  -8.002 -34.897  -2.167
  355   2H5*    U  34          2H5*        U  34  -7.312 -33.973  -0.827
  356    H4*    U  34           H4*        U  34  -6.067 -36.034  -1.231
  357    H3*    U  34           H3*        U  34  -4.781 -33.654  -0.774
  358    H2*    U  34           H2*        U  34  -4.515 -33.137  -3.103
  359   2HO*    U  34          2HO*        U  34  -2.192 -34.525  -2.185
  360    H1*    U  34           H1*        U  34  -3.665 -36.032  -3.495
  361    H3     U  34           H3         U  34  -2.729 -35.277  -7.848
  362    H5     U  34           H5         U  34  -6.202 -33.012  -7.286
  363    H6     U  34           H6         U  34  -6.207 -33.701  -4.929
  364   1H5*    C  35          1H5*        C  35  -1.308 -33.728  -0.079
  365   2H5*    C  35          2H5*        C  35  -0.904 -34.668   1.356
  366    H4*    C  35           H4*        C  35   0.015 -32.424   1.462
  367    H3*    C  35           H3*        C  35  -1.137 -33.621   3.631
  368    H2*    C  35           H2*        C  35  -3.311 -32.713   3.207
  369   2HO*    C  35          2HO*        C  35  -1.911 -31.021   5.020
  370    H1*    C  35           H1*        C  35  -2.074 -29.987   2.703
  371   1H4     C  35          1H4         C  35  -8.300 -29.312   1.458
  372   2H4     C  35          2H4         C  35  -8.227 -30.559   0.225
  373    H5     C  35           H5         C  35  -6.277 -31.871  -0.165
  374    H6     C  35           H6         C  35  -3.899 -32.100   0.339
  375   1H5*    G  36          1H5*        G  36   3.212 -30.186   3.758
  376   2H5*    G  36          2H5*        G  36   1.659 -30.260   2.909
  377    H4*    G  36           H4*        G  36   4.254 -31.506   1.920
  378    H3*    G  36           H3*        G  36   2.664 -29.064   1.037
  379    H2*    G  36           H2*        G  36   3.478 -29.475  -1.150
  380   2HO*    G  36          2HO*        G  36   5.732 -29.956  -0.105
  381    H1*    G  36           H1*        G  36   3.627 -32.293  -0.787
  382    H8     G  36           H8         G  36   2.327 -32.690  -3.038
  383    H1     G  36           H1         G  36  -2.455 -28.732  -1.321
  384   1H2     G  36          1H2         G  36  -2.046 -27.826   0.570
  385   2H2     G  36          2H2         G  36  -0.563 -28.116   1.452
  386   1H5*    G  37          1H5*        G  37   5.173 -27.861  -0.924
  387   2H5*    G  37          2H5*        G  37   5.584 -26.147  -0.885
  388    H4*    G  37           H4*        G  37   4.297 -27.009  -2.923
  389    H3*    G  37           H3*        G  37   3.111 -24.706  -1.328
  390    H2*    G  37           H2*        G  37   1.569 -24.564  -3.247
  391   2HO*    G  37          2HO*        G  37   3.368 -25.402  -4.788
  392    H1*    G  37           H1*        G  37   1.013 -27.198  -3.198
  393    H8     G  37           H8         G  37   1.735 -26.082   0.407
  394    H1     G  37           H1         G  37  -3.929 -24.076  -1.865
  395   1H2     G  37          1H2         G  37  -4.074 -24.515  -3.973
  396   2H2     G  37          2H2         G  37  -2.875 -25.481  -4.808
  397   1H5*    U  38          1H5*        U  38   2.585 -23.523  -5.113
  398   2H5*    U  38          2H5*        U  38   3.227 -21.941  -5.532
  399    H4*    U  38           H4*        U  38   0.915 -22.163  -6.228
  400    H3*    U  38           H3*        U  38   1.232 -20.221  -3.959
  401    H2*    U  38           H2*        U  38  -1.007 -19.501  -4.462
  402   2HO*    U  38          2HO*        U  38  -0.949 -19.728  -6.789
  403    H1*    U  38           H1*        U  38  -1.952 -22.056  -4.508
  404    H3     U  38           H3         U  38  -3.179 -20.571  -0.345
  405    H5     U  38           H5         U  38   0.784 -21.812   0.129
  406    H6     U  38           H6         U  38   0.934 -22.089  -2.300
  407   1H5*    G  39          1H5*        G  39   0.189 -17.777  -7.125
  408   2H5*    G  39          2H5*        G  39   1.000 -16.218  -7.026
  409    H4*    G  39           H4*        G  39  -1.377 -15.930  -7.133
  410    H3*    G  39           H3*        G  39  -0.425 -15.280  -4.340
  411    H2*    G  39           H2*        G  39  -2.720 -14.496  -4.012
  412   2HO*    G  39          2HO*        G  39  -2.885 -13.824  -6.409
  413    H1*    G  39           H1*        G  39  -3.777 -16.770  -5.009
  414    H8     G  39           H8         G  39  -0.419 -17.655  -3.367
  415    H1     G  39           H1         G  39  -5.214 -16.702   0.802
  416   1H2     G  39          1H2         G  39  -6.869 -15.740  -0.199
  417   2H2     G  39          2H2         G  39  -6.912 -15.534  -1.937
  418   1H5*    G  40          1H5*        G  40  -2.691 -12.120  -5.481
  419   2H5*    G  40          2H5*        G  40  -2.044 -10.569  -4.921
  420    H4*    G  40           H4*        G  40  -4.378 -10.815  -4.311
  421    H3*    G  40           H3*        G  40  -2.352 -10.749  -2.042
  422    H2*    G  40           H2*        G  40  -4.313 -10.527  -0.602
  423   2HO*    G  40          2HO*        G  40  -5.493  -9.192  -2.340
  424    H1*    G  40           H1*        G  40  -5.690 -12.510  -1.804
  425    H8     G  40           H8         G  40  -2.139 -13.749  -2.020
  426    H1     G  40           H1         G  40  -4.463 -13.842   3.970
  427   1H2     G  40          1H2         G  40  -6.299 -12.715   4.076
  428   2H2     G  40          2H2         G  40  -6.997 -11.940   2.668
  429   1H5*    G  41          1H5*        G  41  -4.669  -8.314  -0.393
  430   2H5*    G  41          2H5*        G  41  -3.888  -6.806   0.086
  431    H4*    G  41           H4*        G  41  -4.677  -7.882   2.086
  432    H3*    G  41           H3*        G  41  -1.678  -8.225   1.771
  433    H2*    G  41           H2*        G  41  -1.739  -9.043   4.075
  434   2HO*    G  41          2HO*        G  41  -3.520  -7.751   4.877
  435    H1*    G  41           H1*        G  41  -3.659 -10.825   3.490
  436    H8     G  41           H8         G  41  -1.882 -10.389   0.166
  437    H1     G  41           H1         G  41   1.198 -14.295   4.237
  438   1H2     G  41          1H2         G  41   0.392 -14.131   6.210
  439   2H2     G  41          2H2         G  41  -0.926 -13.042   6.617
  440   1H5*    A  42          1H5*        A  42  -0.590  -4.369   5.388
  441   2H5*    A  42          2H5*        A  42  -0.402  -5.745   6.485
  442    H4*    A  42           H4*        A  42  -3.008  -4.772   5.243
  443    H3*    A  42           H3*        A  42  -1.932  -4.987   8.069
  444    H2*    A  42           H2*        A  42  -4.208  -5.317   8.827
  445   2HO*    A  42          2HO*        A  42  -5.092  -3.856   7.025
  446    H1*    A  42           H1*        A  42  -4.716  -7.262   7.048
  447    H8     A  42           H8         A  42  -1.220  -8.159   7.210
  448   1H6     A  42          1H6         A  42  -2.073 -10.200  13.030
  449   2H6     A  42          2H6         A  42  -1.045 -10.304  11.619
  450    H2     A  42           H2         A  42  -5.579  -7.723  11.931
  451   1H5*    A  43          1H5*        A  43  -4.639  -2.429   8.461
  452   2H5*    A  43          2H5*        A  43  -4.624  -0.852   9.214
  453    H4*    A  43           H4*        A  43  -6.026  -2.309  10.529
  454    H3*    A  43           H3*        A  43  -3.337  -1.877  11.891
  455    H2*    A  43           H2*        A  43  -4.148  -3.276  13.692
  456   2HO*    A  43          2HO*        A  43  -6.420  -2.327  13.414
  457    H1*    A  43           H1*        A  43  -5.270  -5.179  12.026
  458    H8     A  43           H8         A  43  -2.205  -4.443  10.120
  459   1H6     A  43          1H6         A  43   0.867  -8.099  14.072
  460   2H6     A  43          2H6         A  43   0.880  -7.400  12.464
  461    H2     A  43           H2         A  43  -2.979  -6.957  15.980
  462   1H5*    U  44          1H5*        U  44  -5.333  -1.109  15.117
  463   2H5*    U  44          2H5*        U  44  -4.819   0.402  15.888
  464    H4*    U  44           H4*        U  44  -4.215  -1.449  17.323
  465    H3*    U  44           H3*        U  44  -1.801  -0.308  15.878
  466    H2*    U  44           H2*        U  44  -0.484  -1.719  17.318
  467   2HO*    U  44          2HO*        U  44  -2.082  -1.400  19.181
  468    H1*    U  44           H1*        U  44  -2.067  -3.921  16.938
  469    H3     U  44           H3         U  44   1.814  -4.494  14.466
  470    H5     U  44           H5         U  44  -0.681  -2.215  11.999
  471    H6     U  44           H6         U  44  -2.228  -1.966  13.883
  472   1H5*    A  45          1H5*        A  45  -0.638  -0.057  19.787
  473   2H5*    A  45          2H5*        A  45   0.205   1.452  20.149
  474    H4*    A  45           H4*        A  45   1.608  -0.477  20.631
  475    H3*    A  45           H3*        A  45   2.603   1.077  18.210
  476    H2*    A  45           H2*        A  45   4.589  -0.272  18.448
  477   2HO*    A  45          2HO*        A  45   4.372  -0.370  20.902
  478    H1*    A  45           H1*        A  45   3.171  -2.580  18.622
  479    H8     A  45           H8         A  45   1.114  -0.259  16.402
  480   1H6     A  45          1H6         A  45   4.806  -2.083  11.730
  481   2H6     A  45          2H6         A  45   3.292  -1.298  12.137
  482    H2     A  45           H2         A  45   6.543  -3.582  15.516
  483   1H5*    C  46          1H5*        C  46   5.716   1.060  20.885
  484   2H5*    C  46          2H5*        C  46   6.496   2.639  21.013
  485    H4*    C  46           H4*        C  46   8.115   0.904  20.511
  486    H3*    C  46           H3*        C  46   7.669   2.764  18.140
  487    H2*    C  46           H2*        C  46   9.679   1.746  17.289
  488   2HO*    C  46          2HO*        C  46  10.633   1.505  19.553
  489    H1*    C  46           H1*        C  46   8.818  -0.786  17.903
  490   1H4     C  46          1H4         C  46   6.912   0.471  11.943
  491   2H4     C  46          2H4         C  46   5.373   1.051  12.544
  492    H5     C  46           H5         C  46   4.894   1.337  14.880
  493    H6     C  46           H6         C  46   5.797   1.070  17.146
  494   1H5*    C  47          1H5*        C  47  11.667   3.119  19.049
  495   2H5*    C  47          2H5*        C  47  12.223   4.792  18.970
  496    H4*    C  47           H4*        C  47  13.570   3.353  17.547
  497    H3*    C  47           H3*        C  47  11.795   5.224  15.942
  498    H2*    C  47           H2*        C  47  13.214   4.581  14.086
  499   2HO*    C  47          2HO*        C  47  15.214   4.411  15.456
  500    H1*    C  47           H1*        C  47  13.073   1.919  14.747
  501   1H4     C  47          1H4         C  47   8.324   3.049  10.646
  502   2H4     C  47          2H4         C  47   7.272   3.541  11.953
  503    H5     C  47           H5         C  47   7.998   3.722  14.236
  504    H6     C  47           H6         C  47   9.914   3.450  15.744
  505   1H5*    A  48          1H5*        A  48  15.821   6.219  14.963
  506   2H5*    A  48          2H5*        A  48  16.012   7.965  14.791
  507    H4*    A  48           H4*        A  48  16.835   6.792  12.823
  508    H3*    A  48           H3*        A  48  14.288   8.340  12.277
  509    H2*    A  48           H2*        A  48  14.818   7.919   9.933
  510   2HO*    A  48          2HO*        A  48  17.229   8.015  10.299
  511    H1*    A  48           H1*        A  48  15.233   5.275  10.379
  512    H8     A  48           H8         A  48  12.578   6.308  12.898
  513   1H6     A  48          1H6         A  48   8.464   5.766   8.261
  514   2H6     A  48          2H6         A  48   8.664   5.991   9.986
  515    H2     A  48           H2         A  48  12.536   5.475   6.516
  516   1H5*    G  49          1H5*        G  49  17.201   9.876   9.657
  517   2H5*    G  49          2H5*        G  49  17.090  11.623   9.456
  518    H4*    G  49           H4*        G  49  17.065  10.468   7.307
  519    H3*    G  49           H3*        G  49  14.389  11.753   7.964
  520    H2*    G  49           H2*        G  49  13.843  11.215   5.637
  521   2HO*    G  49          2HO*        G  49  16.243  11.509   4.984
  522    H1*    G  49           H1*        G  49  14.689   8.660   5.882
  523    H8     G  49           H8         G  49  13.394   9.468   9.347
  524    H1     G  49           H1         G  49   8.711   8.834   4.998
  525   1H2     G  49          1H2         G  49   9.536   9.019   3.011
  526   2H2     G  49          2H2         G  49  11.262   8.980   2.715
  527   1H5*    G  50          1H5*        G  50  15.180  13.016   4.179
  528   2H5*    G  50          2H5*        G  50  15.046  14.756   3.960
  529    H4*    G  50           H4*        G  50  13.791  13.527   2.251
  530    H3*    G  50           H3*        G  50  12.033  15.080   4.184
  531    H2*    G  50           H2*        G  50  10.203  14.495   2.676
  532   2HO*    G  50          2HO*        G  50  11.801  14.576   0.739
  533    H1*    G  50           H1*        G  50  10.938  11.878   2.492
  534    H8     G  50           H8         G  50  11.849  12.381   6.049
  535    H1     G  50           H1         G  50   5.482  12.272   5.090
  536   1H2     G  50          1H2         G  50   5.053  12.506   3.004
  537   2H2     G  50          2H2         G  50   6.297  12.869   1.827
  538   1H5*    U  51          1H5*        U  51  10.571  16.156   0.549
  539   2H5*    U  51          2H5*        U  51  10.791  17.866   0.164
  540    H4*    U  51           H4*        U  51   8.518  17.167  -0.359
  541    H3*    U  51           H3*        U  51   9.171  19.385   1.235
  542    H2*    U  51           H2*        U  51   8.489  18.531   3.206
  543   2HO*    U  51          2HO*        U  51   5.785  19.013   2.450
  544    H1*    U  51           H1*        U  51   6.233  16.951   1.977
  545    H3     U  51           H3         U  51   5.159  15.489   6.058
  546    H5     U  51           H5         U  51   9.321  15.881   6.335
  547    H6     U  51           H6         U  51   9.378  16.415   3.939
  548   1H5*    G  52          1H5*        G  52   8.148  21.563  -2.834
  549   2H5*    G  52          2H5*        G  52   6.525  21.847  -3.433
  550    H4*    G  52           H4*        G  52   7.834  19.121  -3.080
  551    H3*    G  52           H3*        G  52   6.886  20.802  -5.442
  552    H2*    G  52           H2*        G  52   6.720  18.737  -6.665
  553   2HO*    G  52          2HO*        G  52   8.680  17.794  -5.515
  554    H1*    G  52           H1*        G  52   5.441  17.474  -4.600
  555    H8     G  52           H8         G  52   4.186  21.056  -4.530
  556    H1     G  52           H1         G  52   1.360  17.336  -8.950
  557   1H2     G  52          1H2         G  52   2.596  15.619  -9.373
  558   2H2     G  52          2H2         G  52   4.047  15.267  -8.457
  559   1H5*    C  53          1H5*        C  53   9.523  18.287  -7.454
  560   2H5*    C  53          2H5*        C  53  10.474  19.185  -8.639
  561    H4*    C  53           H4*        C  53   9.290  17.340  -9.681
  562    H3*    C  53           H3*        C  53   8.115  20.013 -10.528
  563    H2*    C  53           H2*        C  53   6.932  18.689 -12.187
  564   2HO*    C  53          2HO*        C  53   8.833  17.106 -12.370
  565    H1*    C  53           H1*        C  53   6.151  16.822 -10.367
  566   1H4     C  53          1H4         C  53   1.567  21.219 -10.279
  567   2H4     C  53          2H4         C  53   2.423  22.118  -9.047
  568    H5     C  53           H5         C  53   4.673  21.623  -8.383
  569    H6     C  53           H6         C  53   6.493  20.000  -8.608
  570   1H5*    C  54          1H5*        C  54   8.989  18.119 -14.118
  571   2H5*    C  54          2H5*        C  54   9.714  19.219 -15.296
  572    H4*    C  54           H4*        C  54   7.756  18.111 -16.220
  573    H3*    C  54           H3*        C  54   7.265  21.069 -15.736
  574    H2*    C  54           H2*        C  54   5.268  20.721 -17.055
  575   2HO*    C  54          2HO*        C  54   6.398  19.015 -18.448
  576    H1*    C  54           H1*        C  54   4.564  18.469 -15.683
  577   1H4     C  54          1H4         C  54   1.872  23.309 -12.543
  578   2H4     C  54          2H4         C  54   3.297  23.477 -11.543
  579    H5     C  54           H5         C  54   5.320  22.246 -11.917
  580    H6     C  54           H6         C  54   6.380  20.541 -13.317
  581   1H5*    C  55          1H5*        C  55   6.347  20.539 -19.786
  582   2H5*    C  55          2H5*        C  55   7.043  21.834 -20.768
  583    H4*    C  55           H4*        C  55   4.645  21.648 -21.154
  584    H3*    C  55           H3*        C  55   5.443  24.168 -19.663
  585    H2*    C  55           H2*        C  55   3.193  24.897 -19.985
  586   2HO*    C  55          2HO*        C  55   3.063  23.980 -22.228
  587    H1*    C  55           H1*        C  55   2.070  22.432 -19.411
  588   1H4     C  55          1H4         C  55   2.014  26.027 -14.128
  589   2H4     C  55          2H4         C  55   3.659  25.560 -13.759
  590    H5     C  55           H5         C  55   4.989  24.169 -15.190
  591    H6     C  55           H6         C  55   5.017  22.951 -17.318
  592   1H    MET 104          1H        MET 104  10.212 -15.625   3.456
  593    HA   MET 104           HA       MET 104  11.004 -12.813   2.936
  594   1HB   MET 104          1HB       MET 104  12.864 -14.007   4.225
  595   2HB   MET 104          2HB       MET 104  13.039 -15.087   2.851
  596   1HG   MET 104          1HG       MET 104  14.422 -13.632   1.916
  597   2HG   MET 104          2HG       MET 104  13.135 -12.443   1.773
  598   1HE   MET 104          1HE       MET 104  13.164 -10.112   3.180
  599   2HE   MET 104          2HE       MET 104  12.380 -11.239   4.322
  600   3HE   MET 104          3HE       MET 104  13.644 -10.135   4.885
  601    H    TYR 105           H        TYR 105  10.684 -12.311   0.853
  602    HA   TYR 105           HA       TYR 105  10.185 -14.556  -1.079
  603   1HB   TYR 105          1HB       TYR 105   9.001 -11.785  -0.753
  604   2HB   TYR 105          2HB       TYR 105   8.895 -12.635  -2.289
  605    HD1  TYR 105           HD1      TYR 105   8.127 -13.256   1.452
  606    HD2  TYR 105           HD2      TYR 105   7.266 -14.245  -2.691
  607    HE1  TYR 105           HE1      TYR 105   6.479 -14.937   2.180
  608    HE2  TYR 105           HE2      TYR 105   5.467 -15.768  -1.923
  609    HH   TYR 105           HH       TYR 105   4.462 -16.777  -0.132
  610    H    VAL 106           H        VAL 106  11.564 -14.852  -2.698
  611    HA   VAL 106           HA       VAL 106  13.672 -12.763  -3.096
  612    HB   VAL 106           HB       VAL 106  13.721 -15.760  -3.606
  613   1HG1  VAL 106          1HG1      VAL 106  16.026 -13.762  -3.599
  614   2HG1  VAL 106          2HG1      VAL 106  16.187 -15.525  -3.709
  615   3HG1  VAL 106          3HG1      VAL 106  15.402 -14.647  -5.010
  616   1HG2  VAL 106          1HG2      VAL 106  14.924 -14.146  -1.342
  617   2HG2  VAL 106          2HG2      VAL 106  13.566 -15.298  -1.212
  618   3HG2  VAL 106          3HG2      VAL 106  15.173 -15.897  -1.655
  619    H    CYS 107           H        CYS 107  14.235 -11.995  -5.064
  620    HA   CYS 107           HA       CYS 107  12.570 -12.584  -7.398
  621   1HB   CYS 107          1HB       CYS 107  13.393 -10.282  -6.911
  622   2HB   CYS 107          2HB       CYS 107  15.055 -10.861  -7.050
  623    H    HIS 108           H        HIS 108  13.017 -14.024  -8.945
  624    HA   HIS 108           HA       HIS 108  15.661 -15.408  -8.837
  625   1HB   HIS 108          1HB       HIS 108  12.958 -16.412  -9.843
  626   2HB   HIS 108          2HB       HIS 108  14.463 -17.341  -9.847
  627    HD2  HIS 108           HD2      HIS 108  11.502 -17.417  -7.934
  628    HE1  HIS 108           HE1      HIS 108  14.384 -17.546  -4.780
  629    HE2  HIS 108           HE2      HIS 108  11.932 -17.922  -5.384
  630    H    PHE 109           H        PHE 109  14.882 -12.860 -10.335
  631    HA   PHE 109           HA       PHE 109  14.965 -13.437 -13.166
  632   1HB   PHE 109          1HB       PHE 109  14.520 -11.166 -11.863
  633   2HB   PHE 109          2HB       PHE 109  16.263 -10.983 -11.919
  634    HD1  PHE 109           HD1      PHE 109  13.125 -10.913 -13.722
  635    HD2  PHE 109           HD2      PHE 109  17.407 -10.618 -14.064
  636    HE1  PHE 109           HE1      PHE 109  12.844 -10.061 -16.047
  637    HE2  PHE 109           HE2      PHE 109  17.138  -9.731 -16.406
  638    HZ   PHE 109           HZ       PHE 109  14.845  -9.450 -17.380
  639    H    GLU 110           H        GLU 110  16.826 -13.293 -14.582
  640    HA   GLU 110           HA       GLU 110  18.841 -15.074 -13.856
  641   1HB   GLU 110          1HB       GLU 110  18.883 -12.916 -16.020
  642   2HB   GLU 110          2HB       GLU 110  20.061 -14.234 -15.885
  643   1HG   GLU 110          1HG       GLU 110  18.206 -15.892 -16.081
  644   2HG   GLU 110          2HG       GLU 110  17.061 -14.568 -16.312
  645    H    ASN 111           H        ASN 111  20.316 -14.891 -12.275
  646    HA   ASN 111           HA       ASN 111  22.265 -14.214 -11.235
  647   1HB   ASN 111          1HB       ASN 111  22.894 -13.494 -13.664
  648   2HB   ASN 111          2HB       ASN 111  22.510 -11.852 -13.146
  649   1HD2  ASN 111          1HD2      ASN 111  24.597 -10.999 -13.233
  650   2HD2  ASN 111          2HD2      ASN 111  25.891 -11.592 -12.201
  651    H    CYS 112           H        CYS 112  19.415 -12.867 -10.871
  652    HA   CYS 112           HA       CYS 112  20.124 -10.289  -9.654
  653   1HB   CYS 112          1HB       CYS 112  18.028 -10.571 -10.871
  654   2HB   CYS 112          2HB       CYS 112  17.464 -11.797  -9.708
  655    H    GLY 113           H        GLY 113  18.050 -12.880  -8.240
  656   1HA   GLY 113          1HA       GLY 113  18.143 -14.006  -6.221
  657   2HA   GLY 113          2HA       GLY 113  19.855 -13.557  -6.119
  658    H    LYS 114           H        LYS 114  17.691 -10.824  -6.409
  659    HA   LYS 114           HA       LYS 114  18.377  -9.851  -3.753
  660   1HB   LYS 114          1HB       LYS 114  17.777  -8.577  -5.947
  661   2HB   LYS 114          2HB       LYS 114  16.097  -8.757  -5.422
  662   1HG   LYS 114          1HG       LYS 114  16.545  -7.456  -3.413
  663   2HG   LYS 114          2HG       LYS 114  18.305  -7.556  -3.669
  664   1HD   LYS 114          1HD       LYS 114  18.122  -6.241  -5.741
  665   2HD   LYS 114          2HD       LYS 114  16.372  -6.229  -5.570
  666   1HE   LYS 114          1HE       LYS 114  17.179  -4.106  -4.996
  667   2HE   LYS 114          2HE       LYS 114  16.502  -4.875  -3.551
  668   1HZ   LYS 114          1HZ       LYS 114  18.785  -5.389  -2.839
  669   2HZ   LYS 114          2HZ       LYS 114  19.408  -4.701  -4.185
  670   3HZ   LYS 114          3HZ       LYS 114  18.638  -3.783  -3.080
  671    H    ALA 115           H        ALA 115  17.133  -9.694  -1.882
  672    HA   ALA 115           HA       ALA 115  14.664 -11.398  -1.843
  673   1HB   ALA 115          1HB       ALA 115  16.805 -11.084   0.310
  674   2HB   ALA 115          2HB       ALA 115  15.354 -12.116   0.385
  675   3HB   ALA 115          3HB       ALA 115  16.618 -12.469  -0.802
  676    H    PHE 116           H        PHE 116  12.864 -10.667  -0.837
  677    HA   PHE 116           HA       PHE 116  13.010  -7.985   0.489
  678   1HB   PHE 116          1HB       PHE 116  10.686  -9.044  -1.163
  679   2HB   PHE 116          2HB       PHE 116  10.945  -7.440  -0.535
  680    HD1  PHE 116           HD1      PHE 116  12.260  -5.800  -1.744
  681    HD2  PHE 116           HD2      PHE 116  12.142  -9.908  -3.049
  682    HE1  PHE 116           HE1      PHE 116  13.734  -5.258  -3.694
  683    HE2  PHE 116           HE2      PHE 116  13.582  -9.370  -4.964
  684    HZ   PHE 116           HZ       PHE 116  14.420  -7.097  -5.258
  685    H    LYS 117           H        LYS 117  11.421  -7.504   2.063
  686    HA   LYS 117           HA       LYS 117  10.824  -9.625   3.866
  687   1HB   LYS 117          1HB       LYS 117  11.082  -7.168   4.406
  688   2HB   LYS 117          2HB       LYS 117   9.465  -6.883   3.737
  689   1HG   LYS 117          1HG       LYS 117   8.478  -8.415   5.370
  690   2HG   LYS 117          2HG       LYS 117  10.103  -8.896   5.883
  691   1HD   LYS 117          1HD       LYS 117  10.403  -6.377   6.534
  692   2HD   LYS 117          2HD       LYS 117   8.652  -6.252   6.332
  693   1HE   LYS 117          1HE       LYS 117   9.321  -6.688   8.692
  694   2HE   LYS 117          2HE       LYS 117   8.279  -7.960   8.019
  695   1HZ   LYS 117          1HZ       LYS 117  10.076  -9.387   7.784
  696   2HZ   LYS 117          2HZ       LYS 117  11.203  -8.196   8.140
  697   3HZ   LYS 117          3HZ       LYS 117  10.164  -8.807   9.307
  698    H    LYS 118           H        LYS 118   8.818  -7.946   1.404
  699    HA   LYS 118           HA       LYS 118   6.678 -10.013   1.848
  700   1HB   LYS 118          1HB       LYS 118   6.286  -7.027   1.367
  701   2HB   LYS 118          2HB       LYS 118   5.001  -8.187   1.592
  702   1HG   LYS 118          1HG       LYS 118   7.116  -7.546   3.716
  703   2HG   LYS 118          2HG       LYS 118   5.586  -6.711   3.594
  704   1HD   LYS 118          1HD       LYS 118   4.325  -8.493   4.299
  705   2HD   LYS 118          2HD       LYS 118   5.494  -9.683   3.735
  706   1HE   LYS 118          1HE       LYS 118   5.049  -9.545   6.231
  707   2HE   LYS 118          2HE       LYS 118   6.712  -9.727   5.639
  708   1HZ   LYS 118          1HZ       LYS 118   6.631  -8.159   7.378
  709   2HZ   LYS 118          2HZ       LYS 118   6.855  -7.225   6.010
  710   3HZ   LYS 118          3HZ       LYS 118   5.397  -7.346   6.768
  711    H    HIS 119           H        HIS 119   5.428 -10.610   0.035
  712    HA   HIS 119           HA       HIS 119   6.898 -10.756  -2.398
  713   1HB   HIS 119          1HB       HIS 119   4.868 -11.773  -3.356
  714   2HB   HIS 119          2HB       HIS 119   5.346 -12.453  -1.830
  715    HD1  HIS 119           HD1      HIS 119   2.584  -9.743  -2.695
  716    HD2  HIS 119           HD2      HIS 119   3.441 -13.323  -0.628
  717    HE1  HIS 119           HE1      HIS 119   0.361 -10.497  -1.554
  718    HE2  HIS 119           HE2      HIS 119   0.928 -12.633  -0.312
  719    H    ASN 120           H        ASN 120   4.459  -8.425  -1.318
  720    HA   ASN 120           HA       ASN 120   3.900  -7.294  -3.899
  721   1HB   ASN 120          1HB       ASN 120   3.642  -6.317  -1.031
  722   2HB   ASN 120          2HB       ASN 120   3.400  -5.195  -2.375
  723   1HD2  ASN 120          1HD2      ASN 120   1.498  -7.030  -0.350
  724   2HD2  ASN 120          2HD2      ASN 120   0.278  -7.446  -1.562
  725    H    GLN 121           H        GLN 121   6.602  -6.881  -1.616
  726    HA   GLN 121           HA       GLN 121   7.773  -4.585  -3.031
  727   1HB   GLN 121          1HB       GLN 121   9.160  -6.527  -1.182
  728   2HB   GLN 121          2HB       GLN 121   9.653  -4.882  -1.648
  729   1HG   GLN 121          1HG       GLN 121   7.746  -3.966  -0.409
  730   2HG   GLN 121          2HG       GLN 121   7.325  -5.615   0.123
  731   1HE2  GLN 121          1HE2      GLN 121   8.826  -2.883   1.241
  732   2HE2  GLN 121          2HE2      GLN 121   9.931  -3.649   2.377
  733    H    LEU 122           H        LEU 122   8.180  -8.172  -2.981
  734    HA   LEU 122           HA       LEU 122  10.315  -8.334  -4.838
  735   1HB   LEU 122          1HB       LEU 122   9.613 -10.258  -3.555
  736   2HB   LEU 122          2HB       LEU 122   7.991 -10.197  -4.203
  737    HG   LEU 122           HG       LEU 122   8.715 -10.928  -6.388
  738   1HD1  LEU 122          1HD1      LEU 122  10.999  -9.899  -6.346
  739   2HD1  LEU 122          2HD1      LEU 122  11.460 -11.112  -5.122
  740   3HD1  LEU 122          3HD1      LEU 122  10.965 -11.600  -6.775
  741   1HD2  LEU 122          1HD2      LEU 122   8.198 -12.666  -4.670
  742   2HD2  LEU 122          2HD2      LEU 122   9.445 -13.199  -5.815
  743   3HD2  LEU 122          3HD2      LEU 122   9.909 -12.702  -4.186
  744    H    LYS 123           H        LYS 123   6.750  -8.478  -5.430
  745    HA   LYS 123           HA       LYS 123   6.774  -8.433  -8.238
  746   1HB   LYS 123          1HB       LYS 123   4.840  -7.221  -6.219
  747   2HB   LYS 123          2HB       LYS 123   4.511  -7.209  -7.955
  748   1HG   LYS 123          1HG       LYS 123   4.267  -9.525  -8.094
  749   2HG   LYS 123          2HG       LYS 123   5.235  -9.839  -6.658
  750   1HD   LYS 123          1HD       LYS 123   2.914 -10.369  -6.238
  751   2HD   LYS 123          2HD       LYS 123   3.460  -9.068  -5.190
  752   1HE   LYS 123          1HE       LYS 123   2.324  -7.405  -6.675
  753   2HE   LYS 123          2HE       LYS 123   1.774  -8.741  -7.702
  754   1HZ   LYS 123          1HZ       LYS 123   1.015  -8.247  -4.872
  755   2HZ   LYS 123          2HZ       LYS 123   0.031  -8.223  -6.172
  756   3HZ   LYS 123          3HZ       LYS 123   0.658  -9.657  -5.678
  757    H    VAL 124           H        VAL 124   6.959  -5.666  -5.943
  758    HA   VAL 124           HA       VAL 124   6.974  -3.559  -7.861
  759    HB   VAL 124           HB       VAL 124   8.108  -3.880  -5.086
  760   1HG1  VAL 124          1HG1      VAL 124   8.406  -1.367  -6.752
  761   2HG1  VAL 124          2HG1      VAL 124   8.554  -1.447  -4.981
  762   3HG1  VAL 124          3HG1      VAL 124   9.711  -2.311  -5.993
  763   1HG2  VAL 124          1HG2      VAL 124   6.208  -1.813  -5.977
  764   2HG2  VAL 124          2HG2      VAL 124   5.601  -3.474  -5.812
  765   3HG2  VAL 124          3HG2      VAL 124   6.321  -2.697  -4.418
  766    H    HIS 125           H        HIS 125   9.661  -5.564  -6.553
  767    HA   HIS 125           HA       HIS 125  11.731  -4.088  -7.829
  768   1HB   HIS 125          1HB       HIS 125  12.172  -5.500  -5.942
  769   2HB   HIS 125          2HB       HIS 125  11.580  -6.939  -6.773
  770    HD1  HIS 125           HD1      HIS 125  14.565  -4.493  -6.979
  771    HD2  HIS 125           HD2      HIS 125  13.198  -8.260  -8.280
  772    HE1  HIS 125           HE1      HIS 125  16.572  -5.650  -8.036
  773    H    GLN 126           H        GLN 126   9.992  -7.107  -8.806
  774    HA   GLN 126           HA       GLN 126  11.574  -7.586 -11.137
  775   1HB   GLN 126          1HB       GLN 126   8.748  -8.475 -10.391
  776   2HB   GLN 126          2HB       GLN 126   9.615  -8.989 -11.872
  777   1HG   GLN 126          1HG       GLN 126  11.594  -9.591 -10.364
  778   2HG   GLN 126          2HG       GLN 126  10.561  -9.356  -8.963
  779   1HE2  GLN 126          1HE2      GLN 126  12.013 -11.660  -9.595
  780   2HE2  GLN 126          2HE2      GLN 126  10.843 -12.971  -9.898
  781    H    PHE 127           H        PHE 127   8.721  -5.542 -10.605
  782    HA   PHE 127           HA       PHE 127   8.014  -4.996 -13.286
  783   1HB   PHE 127          1HB       PHE 127   6.582  -3.742 -12.312
  784   2HB   PHE 127          2HB       PHE 127   7.284  -4.094 -10.785
  785    HD1  PHE 127           HD1      PHE 127   7.170  -2.350  -9.433
  786    HD2  PHE 127           HD2      PHE 127   8.086  -1.482 -13.534
  787    HE1  PHE 127           HE1      PHE 127   7.649  -0.104  -8.760
  788    HE2  PHE 127           HE2      PHE 127   8.454   0.864 -12.959
  789    HZ   PHE 127           HZ       PHE 127   8.355   1.605 -10.547
  790    H    SER 128           H        SER 128  10.822  -3.946 -11.407
  791    HA   SER 128           HA       SER 128  11.637  -1.790 -13.182
  792   1HB   SER 128          1HB       SER 128  12.385  -2.158 -10.788
  793   2HB   SER 128          2HB       SER 128  13.426  -3.477 -11.380
  794    HG   SER 128           HG       SER 128  14.518  -1.438 -11.266
  795    H    HIS 129           H        HIS 129  12.567  -5.293 -12.892
  796    HA   HIS 129           HA       HIS 129  14.461  -5.279 -15.064
  797   1HB   HIS 129          1HB       HIS 129  12.740  -7.531 -13.939
  798   2HB   HIS 129          2HB       HIS 129  14.008  -7.714 -15.127
  799    HD1  HIS 129           HD1      HIS 129  16.604  -7.220 -14.206
  800    HD2  HIS 129           HD2      HIS 129  13.465  -8.239 -11.634
  801    HE1  HIS 129           HE1      HIS 129  17.658  -8.283 -12.121
  802    H    THR 130           H        THR 130  10.933  -5.819 -14.913
  803    HA   THR 130           HA       THR 130  10.725  -6.523 -17.755
  804    HB   THR 130           HB       THR 130   8.281  -6.432 -17.330
  805    HG1  THR 130           HG1      THR 130   9.096  -5.395 -14.872
  806   1HG2  THR 130          1HG2      THR 130   9.668  -8.492 -16.509
  807   2HG2  THR 130          2HG2      THR 130   9.490  -7.824 -14.874
  808   3HG2  THR 130          3HG2      THR 130   8.054  -8.247 -15.800
  809    H    GLN 131           H        GLN 131  10.796  -3.604 -15.899
  810    HA   GLN 131           HA       GLN 131  10.443  -1.398 -16.349
  811   1HB   GLN 131          1HB       GLN 131  11.949  -2.234 -18.424
  812   2HB   GLN 131          2HB       GLN 131  10.498  -1.810 -19.334
  813   1HG   GLN 131          1HG       GLN 131  11.392   0.300 -19.272
  814   2HG   GLN 131          2HG       GLN 131  10.682   0.387 -17.659
  815   1HE2  GLN 131          1HE2      GLN 131  12.547  -1.086 -16.022
  816   2HE2  GLN 131          2HE2      GLN 131  14.080  -0.268 -16.181
  817    H    GLN 132           H        GLN 132   8.092  -3.208 -16.163
  818    HA   GLN 132           HA       GLN 132   6.165  -1.222 -17.317
  819   1HB   GLN 132          1HB       GLN 132   4.513  -2.949 -17.725
  820   2HB   GLN 132          2HB       GLN 132   5.954  -3.176 -18.702
  821   1HG   GLN 132          1HG       GLN 132   5.180  -5.328 -18.085
  822   2HG   GLN 132          2HG       GLN 132   6.660  -5.010 -17.205
  823   1HE2  GLN 132          1HE2      GLN 132   6.595  -5.427 -15.043
  824   2HE2  GLN 132          2HE2      GLN 132   5.121  -5.533 -14.070
  825    H    LEU 133           H        LEU 133   4.170  -1.030 -16.050
  826    HA   LEU 133           HA       LEU 133   4.898  -1.190 -13.203
  827   1HB   LEU 133          1HB       LEU 133   2.901   0.416 -14.792
  828   2HB   LEU 133          2HB       LEU 133   2.810   0.404 -13.020
  829    HG   LEU 133           HG       LEU 133   5.444   1.017 -14.511
  830   1HD1  LEU 133          1HD1      LEU 133   3.374   3.008 -13.491
  831   2HD1  LEU 133          2HD1      LEU 133   4.972   3.391 -14.164
  832   3HD1  LEU 133          3HD1      LEU 133   3.728   2.673 -15.200
  833   1HD2  LEU 133          1HD2      LEU 133   5.612   0.378 -12.114
  834   2HD2  LEU 133          2HD2      LEU 133   6.129   2.030 -12.465
  835   3HD2  LEU 133          3HD2      LEU 133   4.546   1.749 -11.731
  836    HA   PRO 134           HA       PRO 134   2.277  -4.651 -12.651
  837   1HB   PRO 134          1HB       PRO 134   2.381  -4.638  -9.821
  838   2HB   PRO 134          2HB       PRO 134   3.548  -5.420 -10.925
  839   1HG   PRO 134          1HG       PRO 134   3.885  -3.026  -9.258
  840   2HG   PRO 134          2HG       PRO 134   5.101  -3.970 -10.129
  841   1HD   PRO 134          1HD       PRO 134   3.973  -1.423 -10.835
  842   2HD   PRO 134          2HD       PRO 134   5.134  -2.406 -11.722
  843    H    TYR 135           H        TYR 135   1.553  -1.764 -10.664
  844    HA   TYR 135           HA       TYR 135  -1.116  -2.861  -9.994
  845   1HB   TYR 135          1HB       TYR 135   0.313  -0.375  -8.933
  846   2HB   TYR 135          2HB       TYR 135  -1.149  -1.086  -8.291
  847    HD1  TYR 135           HD1      TYR 135  -1.134  -3.340  -7.254
  848    HD2  TYR 135           HD2      TYR 135   2.497  -1.266  -8.304
  849    HE1  TYR 135           HE1      TYR 135   0.230  -4.992  -5.911
  850    HE2  TYR 135           HE2      TYR 135   3.825  -2.787  -6.817
  851    HH   TYR 135           HH       TYR 135   3.779  -4.766  -5.623
  852    H    GLU 136           H        GLU 136  -2.476  -2.512 -11.715
  853    HA   GLU 136           HA       GLU 136  -2.468   0.194 -12.981
  854   1HB   GLU 136          1HB       GLU 136  -3.786  -0.894 -14.774
  855   2HB   GLU 136          2HB       GLU 136  -2.203  -1.614 -14.520
  856   1HG   GLU 136          1HG       GLU 136  -3.240  -3.530 -13.324
  857   2HG   GLU 136          2HG       GLU 136  -4.836  -2.813 -13.569
  858    H    CYS 137           H        CYS 137  -4.313   1.456 -13.075
  859    HA   CYS 137           HA       CYS 137  -6.402   0.962 -11.085
  860   1HB   CYS 137          1HB       CYS 137  -5.610   3.215 -11.445
  861   2HB   CYS 137          2HB       CYS 137  -5.983   3.144 -13.152
  862    HA   PRO 138           HA       PRO 138  -8.752  -1.261 -14.175
  863   1HB   PRO 138          1HB       PRO 138 -10.464  -2.588 -12.548
  864   2HB   PRO 138          2HB       PRO 138  -8.698  -2.858 -12.432
  865   1HG   PRO 138          1HG       PRO 138 -10.408  -1.000 -10.730
  866   2HG   PRO 138          2HG       PRO 138  -9.241  -2.237 -10.172
  867   1HD   PRO 138          1HD       PRO 138  -8.601   0.443 -10.469
  868   2HD   PRO 138          2HD       PRO 138  -7.416  -0.884 -10.676
  869    H    HIS 139           H        HIS 139  -9.735   1.565 -12.719
  870    HA   HIS 139           HA       HIS 139 -12.599   1.450 -12.836
  871   1HB   HIS 139          1HB       HIS 139 -11.196   3.152 -11.598
  872   2HB   HIS 139          2HB       HIS 139 -10.835   3.912 -13.153
  873    HD2  HIS 139           HD2      HIS 139 -12.595   5.654 -14.011
  874    HE1  HIS 139           HE1      HIS 139 -15.875   4.692 -11.461
  875    HE2  HIS 139           HE2      HIS 139 -15.043   6.286 -13.267
  876    H    GLU 140           H        GLU 140 -14.081   2.300 -14.356
  877    HA   GLU 140           HA       GLU 140 -13.474   1.762 -17.110
  878   1HB   GLU 140          1HB       GLU 140 -15.796   3.226 -15.780
  879   2HB   GLU 140          2HB       GLU 140 -15.736   2.844 -17.499
  880   1HG   GLU 140          1HG       GLU 140 -15.630   0.760 -15.273
  881   2HG   GLU 140          2HG       GLU 140 -17.086   1.249 -16.123
  882    H    GLY 141           H        GLY 141 -12.418   2.985 -18.559
  883   1HA   GLY 141          1HA       GLY 141 -12.050   4.933 -19.840
  884   2HA   GLY 141          2HA       GLY 141 -12.852   5.907 -18.596
  885    H    CYS 142           H        CYS 142 -10.683   3.956 -16.959
  886    HA   CYS 142           HA       CYS 142  -8.567   6.074 -17.010
  887   1HB   CYS 142          1HB       CYS 142  -9.886   5.481 -14.855
  888   2HB   CYS 142          2HB       CYS 142  -8.974   3.975 -14.851
  889    H    ASP 143           H        ASP 143  -6.346   5.428 -16.995
  890    HA   ASP 143           HA       ASP 143  -5.731   2.593 -17.677
  891   1HB   ASP 143          1HB       ASP 143  -6.254   3.920 -19.791
  892   2HB   ASP 143          2HB       ASP 143  -4.866   4.939 -19.423
  893    H    LYS 144           H        LYS 144  -5.119   4.939 -15.583
  894    HA   LYS 144           HA       LYS 144  -2.249   5.352 -15.723
  895   1HB   LYS 144          1HB       LYS 144  -4.360   5.694 -13.556
  896   2HB   LYS 144          2HB       LYS 144  -2.648   5.841 -13.199
  897   1HG   LYS 144          1HG       LYS 144  -3.602   8.013 -13.476
  898   2HG   LYS 144          2HG       LYS 144  -2.357   7.706 -14.685
  899   1HD   LYS 144          1HD       LYS 144  -4.024   7.377 -16.415
  900   2HD   LYS 144          2HD       LYS 144  -5.345   7.469 -15.248
  901   1HE   LYS 144          1HE       LYS 144  -3.395   9.758 -15.733
  902   2HE   LYS 144          2HE       LYS 144  -4.868   9.537 -16.677
  903   1HZ   LYS 144          1HZ       LYS 144  -4.769  10.086 -13.751
  904   2HZ   LYS 144          2HZ       LYS 144  -5.356  11.039 -14.953
  905   3HZ   LYS 144          3HZ       LYS 144  -6.127   9.649 -14.565
  906    H    ARG 145           H        ARG 145  -0.576   4.344 -14.594
  907    HA   ARG 145           HA       ARG 145  -1.233   1.869 -13.036
  908   1HB   ARG 145          1HB       ARG 145   1.190   1.989 -14.834
  909   2HB   ARG 145          2HB       ARG 145   0.384   0.596 -14.064
  910   1HG   ARG 145          1HG       ARG 145  -1.467   0.762 -15.683
  911   2HG   ARG 145          2HG       ARG 145  -0.698   2.171 -16.432
  912   1HD   ARG 145          1HD       ARG 145  -0.141   0.311 -17.809
  913   2HD   ARG 145          2HD       ARG 145   1.317   0.789 -16.953
  914    HE   ARG 145           HE       ARG 145   1.278  -1.239 -15.717
  915   1HH1  ARG 145          1HH1      ARG 145  -1.676  -1.118 -17.667
  916   2HH1  ARG 145          2HH1      ARG 145  -2.122  -2.721 -17.073
  917   1HH2  ARG 145          1HH2      ARG 145   0.617  -3.241 -15.197
  918   2HH2  ARG 145          2HH2      ARG 145  -0.962  -3.808 -15.785
  919    H    PHE 146           H        PHE 146   0.272   1.325 -11.437
  920    HA   PHE 146           HA       PHE 146   2.048   3.587 -10.610
  921   1HB   PHE 146          1HB       PHE 146   0.185   1.975  -8.797
  922   2HB   PHE 146          2HB       PHE 146   1.150   3.346  -8.346
  923    HD1  PHE 146           HD1      PHE 146   0.689   5.632  -9.145
  924    HD2  PHE 146           HD2      PHE 146  -1.921   2.328 -10.129
  925    HE1  PHE 146           HE1      PHE 146  -1.002   7.211 -10.058
  926    HE2  PHE 146           HE2      PHE 146  -3.624   3.892 -10.898
  927    HZ   PHE 146           HZ       PHE 146  -3.112   6.343 -11.002
  928    H    SER 147           H        SER 147   3.653   3.082  -9.036
  929    HA   SER 147           HA       SER 147   4.956   0.565  -9.688
  930   1HB   SER 147          1HB       SER 147   6.695   1.573  -8.022
  931   2HB   SER 147          2HB       SER 147   6.384   2.445  -9.540
  932    HG   SER 147           HG       SER 147   6.400   3.832  -7.718
  933    H    LEU 148           H        LEU 148   3.041   1.825  -6.998
  934    HA   LEU 148           HA       LEU 148   3.588  -0.705  -5.489
  935   1HB   LEU 148          1HB       LEU 148   3.668   2.162  -4.554
  936   2HB   LEU 148          2HB       LEU 148   3.036   0.974  -3.455
  937    HG   LEU 148           HG       LEU 148   5.307   1.453  -2.921
  938   1HD1  LEU 148          1HD1      LEU 148   4.835  -1.332  -3.999
  939   2HD1  LEU 148          2HD1      LEU 148   6.265  -0.894  -3.017
  940   3HD1  LEU 148          3HD1      LEU 148   4.650  -0.742  -2.331
  941   1HD2  LEU 148          1HD2      LEU 148   7.202   0.960  -4.285
  942   2HD2  LEU 148          2HD2      LEU 148   6.185   0.319  -5.577
  943   3HD2  LEU 148          3HD2      LEU 148   6.133   2.053  -5.191
  944    HA   PRO 149           HA       PRO 149  -0.814  -1.160  -5.254
  945   1HB   PRO 149          1HB       PRO 149  -1.103  -2.351  -2.745
  946   2HB   PRO 149          2HB       PRO 149  -0.575  -3.183  -4.218
  947   1HG   PRO 149          1HG       PRO 149   1.099  -2.194  -1.931
  948   2HG   PRO 149          2HG       PRO 149   1.290  -3.673  -2.946
  949   1HD   PRO 149          1HD       PRO 149   2.804  -1.395  -3.316
  950   2HD   PRO 149          2HD       PRO 149   2.418  -2.523  -4.565
  951    H    SER 150           H        SER 150   0.822   0.259  -2.400
  952    HA   SER 150           HA       SER 150  -1.452   1.582  -1.271
  953   1HB   SER 150          1HB       SER 150   0.307   3.088  -0.235
  954   2HB   SER 150          2HB       SER 150   0.549   1.352   0.039
  955    HG   SER 150           HG       SER 150   2.449   2.614  -0.670
  956    H    ARG 151           H        ARG 151   0.760   2.447  -3.922
  957    HA   ARG 151           HA       ARG 151  -0.112   5.232  -4.107
  958   1HB   ARG 151          1HB       ARG 151   1.473   3.419  -5.991
  959   2HB   ARG 151          2HB       ARG 151   1.095   5.117  -6.343
  960   1HG   ARG 151          1HG       ARG 151   2.166   5.810  -4.224
  961   2HG   ARG 151          2HG       ARG 151   2.586   4.132  -3.868
  962   1HD   ARG 151          1HD       ARG 151   4.035   4.058  -5.862
  963   2HD   ARG 151          2HD       ARG 151   3.559   5.719  -6.273
  964    HE   ARG 151           HE       ARG 151   4.810   5.057  -3.623
  965   1HH1  ARG 151          1HH1      ARG 151   5.331   6.715  -6.669
  966   2HH1  ARG 151          2HH1      ARG 151   6.410   7.876  -5.945
  967   1HH2  ARG 151          1HH2      ARG 151   5.933   6.696  -2.743
  968   2HH2  ARG 151          2HH2      ARG 151   6.822   7.802  -3.758
  969    H    LEU 152           H        LEU 152  -0.985   2.146  -5.697
  970    HA   LEU 152           HA       LEU 152  -2.880   3.288  -7.580
  971   1HB   LEU 152          1HB       LEU 152  -2.003   1.079  -7.941
  972   2HB   LEU 152          2HB       LEU 152  -2.479   0.551  -6.326
  973    HG   LEU 152           HG       LEU 152  -4.831   0.567  -6.927
  974   1HD1  LEU 152          1HD1      LEU 152  -3.928   1.385  -9.719
  975   2HD1  LEU 152          2HD1      LEU 152  -5.581   0.982  -9.189
  976   3HD1  LEU 152          3HD1      LEU 152  -4.803   2.451  -8.607
  977   1HD2  LEU 152          1HD2      LEU 152  -4.804  -1.324  -8.424
  978   2HD2  LEU 152          2HD2      LEU 152  -3.237  -0.850  -9.093
  979   3HD2  LEU 152          3HD2      LEU 152  -3.332  -1.440  -7.428
  980    H    LYS 153           H        LYS 153  -3.161   1.786  -4.296
  981    HA   LYS 153           HA       LYS 153  -5.958   2.031  -3.974
  982   1HB   LYS 153          1HB       LYS 153  -4.406   0.780  -2.471
  983   2HB   LYS 153          2HB       LYS 153  -3.803   2.309  -1.822
  984   1HG   LYS 153          1HG       LYS 153  -6.061   2.834  -0.943
  985   2HG   LYS 153          2HG       LYS 153  -6.696   1.344  -1.668
  986   1HD   LYS 153          1HD       LYS 153  -5.166   0.006  -0.236
  987   2HD   LYS 153          2HD       LYS 153  -4.530   1.505   0.480
  988   1HE   LYS 153          1HE       LYS 153  -6.808   2.074   1.297
  989   2HE   LYS 153          2HE       LYS 153  -7.441   0.587   0.582
  990   1HZ   LYS 153          1HZ       LYS 153  -5.987  -0.674   2.082
  991   2HZ   LYS 153          2HZ       LYS 153  -5.399   0.703   2.742
  992   3HZ   LYS 153          3HZ       LYS 153  -6.966   0.301   2.948
  993    H    ARG 154           H        ARG 154  -3.363   4.430  -3.297
  994    HA   ARG 154           HA       ARG 154  -5.176   6.437  -2.250
  995   1HB   ARG 154          1HB       ARG 154  -2.600   6.235  -1.941
  996   2HB   ARG 154          2HB       ARG 154  -2.484   7.006  -3.533
  997   1HG   ARG 154          1HG       ARG 154  -3.956   8.877  -2.588
  998   2HG   ARG 154          2HG       ARG 154  -3.901   8.063  -1.025
  999   1HD   ARG 154          1HD       ARG 154  -2.266   9.865  -1.028
 1000   2HD   ARG 154          2HD       ARG 154  -1.450   8.309  -0.988
 1001    HE   ARG 154           HE       ARG 154  -1.692  10.093  -3.372
 1002   1HH1  ARG 154          1HH1      ARG 154   0.064   7.393  -1.898
 1003   2HH1  ARG 154          2HH1      ARG 154   1.154   7.347  -3.265
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.418   9.945  -4.922
 1005   2HH2  ARG 154          2HH2      ARG 154   0.946   8.828  -4.969
 1006    H    HIS 155           H        HIS 155  -3.842   5.719  -5.505
 1007    HA   HIS 155           HA       HIS 155  -4.867   8.004  -6.882
 1008   1HB   HIS 155          1HB       HIS 155  -3.323   6.576  -8.017
 1009   2HB   HIS 155          2HB       HIS 155  -4.337   5.147  -7.805
 1010    HD1  HIS 155           HD1      HIS 155  -4.341   8.427  -9.852
 1011    HD2  HIS 155           HD2      HIS 155  -6.305   4.718  -9.519
 1012    HE1  HIS 155           HE1      HIS 155  -6.159   8.458 -11.601
 1013    H    GLU 156           H        GLU 156  -6.412   4.937  -5.888
 1014    HA   GLU 156           HA       GLU 156  -8.815   5.138  -7.333
 1015   1HB   GLU 156          1HB       GLU 156  -7.888   3.295  -5.675
 1016   2HB   GLU 156          2HB       GLU 156  -8.827   4.181  -4.458
 1017   1HG   GLU 156          1HG       GLU 156 -10.853   3.938  -5.923
 1018   2HG   GLU 156          2HG       GLU 156  -9.873   3.037  -7.084
 1019    H    LYS 157           H        LYS 157  -7.736   6.970  -4.500
 1020    HA   LYS 157           HA       LYS 157 -10.273   7.956  -3.564
 1021   1HB   LYS 157          1HB       LYS 157  -8.073   8.066  -2.363
 1022   2HB   LYS 157          2HB       LYS 157  -7.561   9.317  -3.512
 1023   1HG   LYS 157          1HG       LYS 157  -9.086  10.908  -2.661
 1024   2HG   LYS 157          2HG       LYS 157  -9.971   9.696  -1.733
 1025   1HD   LYS 157          1HD       LYS 157  -8.378  11.191  -0.388
 1026   2HD   LYS 157          2HD       LYS 157  -8.277   9.454  -0.138
 1027   1HE   LYS 157          1HE       LYS 157  -6.035  10.200  -0.163
 1028   2HE   LYS 157          2HE       LYS 157  -6.301   9.356  -1.685
 1029   1HZ   LYS 157          1HZ       LYS 157  -5.202  11.274  -2.326
 1030   2HZ   LYS 157          2HZ       LYS 157  -6.716  11.687  -2.634
 1031   3HZ   LYS 157          3HZ       LYS 157  -5.976  12.257  -1.264
 1032    H    VAL 158           H        VAL 158  -8.227   8.821  -6.343
 1033    HA   VAL 158           HA       VAL 158  -9.354  11.391  -6.945
 1034    HB   VAL 158           HB       VAL 158  -8.328   9.279  -8.924
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.547  11.163 -10.014
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.499  12.300  -9.106
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.806  11.233 -10.339
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.511   9.950  -7.292
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.214  10.658  -8.905
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.946  11.641  -7.629
 1041    H    HIS 159           H        HIS 159 -10.380   8.063  -7.805
 1042    HA   HIS 159           HA       HIS 159 -12.664   8.982  -9.379
 1043   1HB   HIS 159          1HB       HIS 159 -11.856   6.247  -8.287
 1044   2HB   HIS 159          2HB       HIS 159 -13.287   6.529  -9.295
 1045    HD1  HIS 159           HD1      HIS 159 -12.444   8.128 -11.675
 1046    HD2  HIS 159           HD2      HIS 159  -9.767   5.557  -9.693
 1047    HE1  HIS 159           HE1      HIS 159 -10.490   7.739 -13.271
 1048    H    ALA 160           H        ALA 160 -12.064   8.072  -5.995
 1049    HA   ALA 160           HA       ALA 160 -14.853   7.898  -5.220
 1050   1HB   ALA 160          1HB       ALA 160 -12.935   6.908  -3.920
 1051   2HB   ALA 160          2HB       ALA 160 -12.428   8.562  -3.491
 1052   3HB   ALA 160          3HB       ALA 160 -13.994   7.945  -2.944
 1053    H    GLY 161           H        GLY 161 -12.508  10.546  -5.602
 1054   1HA   GLY 161          1HA       GLY 161 -13.089  12.811  -5.939
 1055   2HA   GLY 161          2HA       GLY 161 -14.691  12.498  -5.311
 1056    H    TYR 162           H        TYR 162 -13.623  14.758  -4.489
 1057    HA   TYR 162           HA       TYR 162 -12.655  14.199  -1.707
 1058   1HB   TYR 162          1HB       TYR 162 -11.952  16.491  -3.576
 1059   2HB   TYR 162          2HB       TYR 162 -11.471  16.389  -1.868
 1060    HD1  TYR 162           HD1      TYR 162  -9.611  15.032  -1.205
 1061    HD2  TYR 162           HD2      TYR 162 -11.178  14.776  -5.217
 1062    HE1  TYR 162           HE1      TYR 162  -7.694  13.614  -1.877
 1063    HE2  TYR 162           HE2      TYR 162  -9.494  13.124  -5.795
 1064    HH   TYR 162           HH       TYR 162  -7.213  12.456  -5.188
 1065    HA   PRO 163           HA       PRO 163 -16.585  16.400  -1.384
 1066   1HB   PRO 163          1HB       PRO 163 -17.562  15.166   0.857
 1067   2HB   PRO 163          2HB       PRO 163 -17.521  14.349  -0.731
 1068   1HG   PRO 163          1HG       PRO 163 -15.536  14.072   1.539
 1069   2HG   PRO 163          2HG       PRO 163 -16.313  12.778   0.573
 1070   1HD   PRO 163          1HD       PRO 163 -13.805  13.770   0.031
 1071   2HD   PRO 163          2HD       PRO 163 -14.899  13.158  -1.252
 1072    H    CYS 164           H        CYS 164 -17.072  18.252  -0.304
 1073    HA   CYS 164           HA       CYS 164 -15.081  19.407   1.437
 1074   1HB   CYS 164          1HB       CYS 164 -16.715  20.577  -0.208
 1075   2HB   CYS 164          2HB       CYS 164 -17.912  20.450   1.103
 1076    H    LYS 165           H        LYS 165 -15.080  19.809   3.587
 1077    HA   LYS 165           HA       LYS 165 -17.396  18.980   5.241
 1078   1HB   LYS 165          1HB       LYS 165 -14.544  17.992   5.719
 1079   2HB   LYS 165          2HB       LYS 165 -15.877  17.816   6.866
 1080   1HG   LYS 165          1HG       LYS 165 -17.145  16.475   5.195
 1081   2HG   LYS 165          2HG       LYS 165 -15.755  16.540   4.102
 1082   1HD   LYS 165          1HD       LYS 165 -15.727  15.327   6.898
 1083   2HD   LYS 165          2HD       LYS 165 -15.910  14.424   5.387
 1084   1HE   LYS 165          1HE       LYS 165 -13.697  15.266   4.613
 1085   2HE   LYS 165          2HE       LYS 165 -13.488  16.121   6.147
 1086   1HZ   LYS 165          1HZ       LYS 165 -13.583  13.966   7.285
 1087   2HZ   LYS 165          2HZ       LYS 165 -13.769  13.176   5.867
 1088   3HZ   LYS 165          3HZ       LYS 165 -12.378  13.964   6.184
 1089    H    LYS 166           H        LYS 166 -15.557  21.399   4.266
 1090    HA   LYS 166           HA       LYS 166 -14.493  22.554   6.724
 1091   1HB   LYS 166          1HB       LYS 166 -15.241  23.681   4.019
 1092   2HB   LYS 166          2HB       LYS 166 -14.610  24.709   5.299
 1093   1HG   LYS 166          1HG       LYS 166 -13.101  22.265   4.282
 1094   2HG   LYS 166          2HG       LYS 166 -12.948  23.875   3.566
 1095   1HD   LYS 166          1HD       LYS 166 -12.182  24.845   5.626
 1096   2HD   LYS 166          2HD       LYS 166 -12.393  23.328   6.510
 1097   1HE   LYS 166          1HE       LYS 166 -10.482  23.744   4.169
 1098   2HE   LYS 166          2HE       LYS 166 -10.029  23.870   5.870
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.735  21.522   6.131
 1100   2HZ   LYS 166          2HZ       LYS 166 -10.998  21.408   4.512
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.499  21.685   5.081
 1102    H    ASP 167           H        ASP 167 -17.689  22.323   5.328
 1103    HA   ASP 167           HA       ASP 167 -18.792  23.719   7.687
 1104   1HB   ASP 167          1HB       ASP 167 -18.500  25.461   5.849
 1105   2HB   ASP 167          2HB       ASP 167 -19.639  24.537   4.873
 1106    H    ASP 168           H        ASP 168 -20.776  22.896   8.314
 1107    HA   ASP 168           HA       ASP 168 -21.399  20.281   7.373
 1108   1HB   ASP 168          1HB       ASP 168 -23.185  20.304   8.987
 1109   2HB   ASP 168          2HB       ASP 168 -21.773  21.064   9.690
 1110    H    SER 169           H        SER 169 -22.592  23.439   6.344
 1111    HA   SER 169           HA       SER 169 -24.883  22.199   4.889
 1112   1HB   SER 169          1HB       SER 169 -24.059  25.114   5.262
 1113   2HB   SER 169          2HB       SER 169 -25.494  24.568   4.388
 1114    HG   SER 169           HG       SER 169 -25.944  25.150   6.572
 1115    H    CYS 170           H        CYS 170 -21.851  21.986   4.179
 1116    HA   CYS 170           HA       CYS 170 -21.934  23.110   1.411
 1117   1HB   CYS 170          1HB       CYS 170 -19.848  23.128   3.127
 1118   2HB   CYS 170          2HB       CYS 170 -19.592  21.520   2.470
 1119    H    SER 171           H        SER 171 -21.392  21.604  -0.385
 1120    HA   SER 171           HA       SER 171 -21.984  18.729   0.107
 1121   1HB   SER 171          1HB       SER 171 -23.834  18.731  -1.538
 1122   2HB   SER 171          2HB       SER 171 -24.199  19.749  -0.140
 1123    HG   SER 171           HG       SER 171 -24.728  20.784  -2.125
 1124    H    PHE 172           H        PHE 172 -20.077  20.984  -1.383
 1125    HA   PHE 172           HA       PHE 172 -19.859  20.043  -4.076
 1126   1HB   PHE 172          1HB       PHE 172 -18.949  22.182  -3.560
 1127   2HB   PHE 172          2HB       PHE 172 -18.039  21.563  -2.192
 1128    HD1  PHE 172           HD1      PHE 172 -15.943  20.337  -2.443
 1129    HD2  PHE 172           HD2      PHE 172 -18.069  21.780  -5.894
 1130    HE1  PHE 172           HE1      PHE 172 -13.970  19.853  -3.856
 1131    HE2  PHE 172           HE2      PHE 172 -16.013  21.494  -7.275
 1132    HZ   PHE 172           HZ       PHE 172 -13.942  20.573  -6.236
 1133    H    VAL 173           H        VAL 173 -18.693  18.419  -5.014
 1134    HA   VAL 173           HA       VAL 173 -16.648  17.016  -3.350
 1135    HB   VAL 173           HB       VAL 173 -18.529  15.676  -5.330
 1136   1HG1  VAL 173          1HG1      VAL 173 -16.220  14.588  -5.208
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.403  14.489  -3.450
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.474  13.567  -4.514
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.828  16.101  -3.379
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.281  14.433  -3.196
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.486  15.750  -2.288
 1142    H    GLY 174           H        GLY 174 -14.704  17.280  -4.204
 1143   1HA   GLY 174          1HA       GLY 174 -14.465  18.255  -6.981
 1144   2HA   GLY 174          2HA       GLY 174 -13.154  18.065  -5.802
 1145    H    LYS 175           H        LYS 175 -13.825  17.149  -8.771
 1146    HA   LYS 175           HA       LYS 175 -13.645  14.304  -8.779
 1147   1HB   LYS 175          1HB       LYS 175 -13.541  14.513 -11.038
 1148   2HB   LYS 175          2HB       LYS 175 -14.006  16.173 -10.717
 1149   1HG   LYS 175          1HG       LYS 175 -11.502  16.736 -10.790
 1150   2HG   LYS 175          2HG       LYS 175 -11.229  15.083 -11.356
 1151   1HD   LYS 175          1HD       LYS 175 -12.826  15.590 -13.261
 1152   2HD   LYS 175          2HD       LYS 175 -12.769  17.286 -12.765
 1153   1HE   LYS 175          1HE       LYS 175 -10.417  15.534 -13.643
 1154   2HE   LYS 175          2HE       LYS 175 -11.176  16.813 -14.589
 1155   1HZ   LYS 175          1HZ       LYS 175 -10.427  18.388 -12.840
 1156   2HZ   LYS 175          2HZ       LYS 175  -9.579  17.181 -12.110
 1157   3HZ   LYS 175          3HZ       LYS 175  -9.214  17.687 -13.648
 1158    H    THR 176           H        THR 176 -11.264  16.693  -7.957
 1159    HA   THR 176           HA       THR 176  -9.209  14.596  -7.625
 1160    HB   THR 176           HB       THR 176  -7.592  16.499  -8.681
 1161    HG1  THR 176           HG1      THR 176  -8.764  17.841  -9.746
 1162   1HG2  THR 176          1HG2      THR 176  -8.960  14.266 -10.201
 1163   2HG2  THR 176          2HG2      THR 176  -7.535  15.118 -10.749
 1164   3HG2  THR 176          3HG2      THR 176  -7.450  14.166  -9.248
 1165    H    TRP 177           H        TRP 177  -7.336  15.367  -6.386
 1166    HA   TRP 177           HA       TRP 177  -8.148  16.655  -4.034
 1167   1HB   TRP 177          1HB       TRP 177  -6.258  15.191  -4.068
 1168   2HB   TRP 177          2HB       TRP 177  -5.424  16.158  -5.257
 1169    HD1  TRP 177           HD1      TRP 177  -3.415  17.076  -4.302
 1170    HE1  TRP 177           HE1      TRP 177  -2.636  18.230  -2.137
 1171    HE3  TRP 177           HE3      TRP 177  -7.646  16.433  -1.569
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.447  17.950   0.617
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.547  16.679   0.897
 1174    HH2  TRP 177           HH2      TRP 177  -5.444  17.398   2.003
 1175    H    THR 178           H        THR 178  -6.387  18.063  -6.855
 1176    HA   THR 178           HA       THR 178  -5.885  20.634  -5.795
 1177    HB   THR 178           HB       THR 178  -6.168  21.400  -8.225
 1178    HG1  THR 178           HG1      THR 178  -6.046  18.803  -9.105
 1179   1HG2  THR 178          1HG2      THR 178  -4.192  19.150  -7.823
 1180   2HG2  THR 178          2HG2      THR 178  -4.149  20.413  -9.064
 1181   3HG2  THR 178          3HG2      THR 178  -3.960  20.845  -7.356
 1182    H    LEU 179           H        LEU 179  -8.794  19.461  -7.572
 1183    HA   LEU 179           HA       LEU 179 -10.117  21.947  -7.645
 1184   1HB   LEU 179          1HB       LEU 179 -11.291  19.122  -7.586
 1185   2HB   LEU 179          2HB       LEU 179 -12.195  20.589  -7.942
 1186    HG   LEU 179           HG       LEU 179 -10.029  19.306  -9.602
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.390  18.526  -9.772
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.891  20.169 -10.211
 1189   3HD1  LEU 179          3HD1      LEU 179 -11.812  19.254 -11.282
 1190   1HD2  LEU 179          1HD2      LEU 179 -11.228  22.074 -10.005
 1191   2HD2  LEU 179          2HD2      LEU 179  -9.506  21.668  -9.775
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.333  21.163 -11.245
 1193    H    TYR 180           H        TYR 180  -9.989  19.521  -5.043
 1194    HA   TYR 180           HA       TYR 180 -12.119  20.750  -3.467
 1195   1HB   TYR 180          1HB       TYR 180 -11.773  18.554  -2.914
 1196   2HB   TYR 180          2HB       TYR 180 -10.016  18.638  -3.013
 1197    HD1  TYR 180           HD1      TYR 180 -12.862  20.081  -0.971
 1198    HD2  TYR 180           HD2      TYR 180  -8.786  18.661  -1.030
 1199    HE1  TYR 180           HE1      TYR 180 -12.670  20.499   1.478
 1200    HE2  TYR 180           HE2      TYR 180  -8.630  18.998   1.425
 1201    HH   TYR 180           HH       TYR 180  -9.713  19.617   3.311
 1202    H    LEU 181           H        LEU 181  -8.512  20.745  -3.308
 1203    HA   LEU 181           HA       LEU 181  -8.268  22.598  -1.183
 1204   1HB   LEU 181          1HB       LEU 181  -6.513  22.049  -3.613
 1205   2HB   LEU 181          2HB       LEU 181  -6.047  23.144  -2.347
 1206    HG   LEU 181           HG       LEU 181  -6.596  20.134  -2.042
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.059  21.777  -2.283
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.068  20.199  -1.502
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.550  20.316  -3.195
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.725  22.153   0.040
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.140  21.091   0.073
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.532  20.383   0.248
 1213    H    LYS 182           H        LYS 182  -8.550  23.197  -4.715
 1214    HA   LYS 182           HA       LYS 182  -8.338  26.063  -4.639
 1215   1HB   LYS 182          1HB       LYS 182  -8.095  24.867  -6.713
 1216   2HB   LYS 182          2HB       LYS 182  -9.691  24.133  -6.569
 1217   1HG   LYS 182          1HG       LYS 182 -10.806  26.215  -7.012
 1218   2HG   LYS 182          2HG       LYS 182  -9.280  27.126  -6.917
 1219   1HD   LYS 182          1HD       LYS 182  -8.453  26.130  -8.940
 1220   2HD   LYS 182          2HD       LYS 182  -9.699  24.880  -8.931
 1221   1HE   LYS 182          1HE       LYS 182 -10.116  26.572 -10.652
 1222   2HE   LYS 182          2HE       LYS 182 -11.434  26.461  -9.479
 1223   1HZ   LYS 182          1HZ       LYS 182  -9.307  28.535  -9.352
 1224   2HZ   LYS 182          2HZ       LYS 182 -10.786  28.774 -10.020
 1225   3HZ   LYS 182          3HZ       LYS 182 -10.670  28.461  -8.425
 1226    H    HIS 183           H        HIS 183 -11.182  23.855  -4.458
 1227    HA   HIS 183           HA       HIS 183 -13.193  25.873  -4.368
 1228   1HB   HIS 183          1HB       HIS 183 -13.867  23.615  -4.763
 1229   2HB   HIS 183          2HB       HIS 183 -13.037  23.022  -3.334
 1230    HD1  HIS 183           HD1      HIS 183 -16.313  24.842  -4.220
 1231    HD2  HIS 183           HD2      HIS 183 -14.228  23.160  -0.976
 1232    HE1  HIS 183           HE1      HIS 183 -17.942  24.812  -2.250
 1233    H    VAL 184           H        VAL 184 -11.236  24.347  -1.775
 1234    HA   VAL 184           HA       VAL 184 -12.618  25.500   0.441
 1235    HB   VAL 184           HB       VAL 184  -9.814  24.420   0.044
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.519  26.165   1.751
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.913  25.519   2.659
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.422  24.550   2.448
 1239   1HG2  VAL 184          1HG2      VAL 184 -10.811  22.778   1.761
 1240   2HG2  VAL 184          2HG2      VAL 184 -12.394  23.577   1.419
 1241   3HG2  VAL 184          3HG2      VAL 184 -11.461  22.745   0.144
 1242    H    ALA 185           H        ALA 185  -9.777  26.653  -1.413
 1243    HA   ALA 185           HA       ALA 185  -9.258  28.873   0.279
 1244   1HB   ALA 185          1HB       ALA 185  -8.630  28.514  -2.694
 1245   2HB   ALA 185          2HB       ALA 185  -7.860  29.681  -1.597
 1246   3HB   ALA 185          3HB       ALA 185  -7.627  27.938  -1.343
 1247    H    GLU 186           H        GLU 186 -11.525  28.474  -2.429
 1248    HA   GLU 186           HA       GLU 186 -12.064  31.385  -2.593
 1249   1HB   GLU 186          1HB       GLU 186 -13.143  28.959  -4.100
 1250   2HB   GLU 186          2HB       GLU 186 -13.753  30.607  -4.330
 1251   1HG   GLU 186          1HG       GLU 186 -11.458  31.379  -4.914
 1252   2HG   GLU 186          2HG       GLU 186 -10.865  29.726  -4.758
 1253    H    CYS 187           H        CYS 187 -13.752  28.374  -1.580
 1254    HA   CYS 187           HA       CYS 187 -16.208  29.896  -0.985
 1255   1HB   CYS 187          1HB       CYS 187 -16.032  27.595  -2.171
 1256   2HB   CYS 187          2HB       CYS 187 -15.788  26.913  -0.554
 1257    HG   CYS 187           HG       CYS 187 -17.963  28.029   0.488
 1258    H    HIS 188           H        HIS 188 -13.476  28.639   0.811
 1259    HA   HIS 188           HA       HIS 188 -14.887  29.313   3.366
 1260   1HB   HIS 188          1HB       HIS 188 -12.961  26.971   2.981
 1261   2HB   HIS 188          2HB       HIS 188 -13.749  27.447   4.493
 1262    HD1  HIS 188           HD1      HIS 188 -16.602  27.268   4.368
 1263    HD2  HIS 188           HD2      HIS 188 -14.261  25.342   1.455
 1264    HE1  HIS 188           HE1      HIS 188 -18.142  25.580   3.211
 1265    H    GLN 189           H        GLN 189 -13.437  31.189   1.983
 1266    HA   GLN 189           HA       GLN 189 -10.696  31.493   2.435
 1267   1HB   GLN 189          1HB       GLN 189 -12.917  33.570   2.611
 1268   2HB   GLN 189          2HB       GLN 189 -11.202  33.973   2.532
 1269   1HG   GLN 189          1HG       GLN 189 -10.986  33.182   0.311
 1270   2HG   GLN 189          2HG       GLN 189 -12.518  32.302   0.370
 1271   1HE2  GLN 189          1HE2      GLN 189 -13.981  33.272  -0.995
 1272   2HE2  GLN 189          2HE2      GLN 189 -14.174  35.021  -1.136
 1273    H    ASP 190           H        ASP 190 -13.381  31.970   4.756
 1274    HA   ASP 190           HA       ASP 190 -11.456  31.863   7.002
 1275   1HB   ASP 190          1HB       ASP 190 -11.663  34.294   6.439
 1276   2HB   ASP 190          2HB       ASP 190 -13.411  34.187   6.659
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -6.358  30.434 -15.197
    2   2H5*    G   1          2H5*        G   1  -7.357  29.011 -14.861
    3    H4*    G   1           H4*        G   1  -6.462  28.905 -17.111
    4    H3*    G   1           H3*        G   1  -5.175  26.893 -15.252
    5    H2*    G   1           H2*        G   1  -4.201  25.942 -17.273
    6   2HO*    G   1          2HO*        G   1  -6.188  26.586 -18.611
    7    H1*    G   1           H1*        G   1  -3.321  28.342 -18.156
    8    H8     G   1           H8         G   1  -3.117  28.833 -14.431
    9    H1     G   1           H1         G   1   1.703  25.378 -16.891
   10   1H2     G   1          1H2         G   1   1.113  24.500 -18.797
   11   2H2     G   1          2H2         G   1  -0.348  25.018 -19.615
   12   1H5*    G   2          1H5*        G   2  -6.498  24.591 -18.486
   13   2H5*    G   2          2H5*        G   2  -7.316  23.126 -17.932
   14    H4*    G   2           H4*        G   2  -5.545  22.590 -19.518
   15    H3*    G   2           H3*        G   2  -4.932  21.714 -16.682
   16    H2*    G   2           H2*        G   2  -3.093  20.473 -17.679
   17   2HO*    G   2          2HO*        G   2  -4.413  20.071 -19.740
   18    H1*    G   2           H1*        G   2  -2.256  22.599 -19.155
   19    H8     G   2           H8         G   2  -3.615  24.206 -16.009
   20    H1     G   2           H1         G   2   2.134  21.430 -15.201
   21   1H2     G   2          1H2         G   2   2.506  20.019 -16.793
   22   2H2     G   2          2H2         G   2   1.448  19.888 -18.184
   23   1H5*    G   3          1H5*        G   3  -4.495  18.212 -18.906
   24   2H5*    G   3          2H5*        G   3  -5.314  16.854 -18.122
   25    H4*    G   3           H4*        G   3  -2.968  16.320 -18.581
   26    H3*    G   3           H3*        G   3  -3.619  16.664 -15.634
   27    H2*    G   3           H2*        G   3  -1.418  15.746 -15.246
   28   2HO*    G   3          2HO*        G   3  -1.674  14.269 -17.236
   29    H1*    G   3           H1*        G   3  -0.226  17.274 -17.182
   30    H8     G   3           H8         G   3  -2.828  19.521 -15.565
   31    H1     G   3           H1         G   3   2.537  18.790 -12.082
   32   1H2     G   3          1H2         G   3   3.616  17.045 -12.744
   33   2H2     G   3          2H2         G   3   3.160  16.170 -14.192
   34   1H5*    C   4          1H5*        C   4  -1.883  12.969 -15.600
   35   2H5*    C   4          2H5*        C   4  -2.787  11.837 -14.592
   36    H4*    C   4           H4*        C   4  -0.479  11.999 -13.837
   37    H3*    C   4           H3*        C   4  -2.510  13.205 -11.922
   38    H2*    C   4           H2*        C   4  -0.690  13.443 -10.399
   39   2HO*    C   4          2HO*        C   4   0.189  11.241 -11.125
   40    H1*    C   4           H1*        C   4   1.187  14.148 -12.349
   41   1H4     C   4          1H4         C   4  -0.897  19.230  -9.102
   42   2H4     C   4          2H4         C   4  -2.364  19.286 -10.051
   43    H5     C   4           H5         C   4  -2.861  17.716 -11.800
   44    H6     C   4           H6         C   4  -2.087  15.682 -12.922
   45   1H5*    C   5          1H5*        C   5  -1.640  11.651  -8.912
   46   2H5*    C   5          2H5*        C   5  -2.846  10.553  -8.249
   47    H4*    C   5           H4*        C   5  -2.198  12.471  -6.819
   48    H3*    C   5           H3*        C   5  -4.727  11.383  -6.822
   49    H2*    C   5           H2*        C   5  -5.479  12.953  -8.530
   50   2HO*    C   5          2HO*        C   5  -6.825  13.220  -6.460
   51    H1*    C   5           H1*        C   5  -4.249  15.122  -6.903
   52   1H4     C   5          1H4         C   5  -5.837  18.675 -11.881
   53   2H4     C   5          2H4         C   5  -5.606  17.354 -12.997
   54    H5     C   5           H5         C   5  -4.974  15.154 -12.296
   55    H6     C   5           H6         C   5  -4.531  13.733 -10.351
   56   1H5*    A   6          1H5*        A   6  -2.415  14.462  -4.635
   57   2H5*    A   6          2H5*        A   6  -1.247  13.147  -4.510
   58    H4*    A   6           H4*        A   6  -0.385  15.062  -3.572
   59    H3*    A   6           H3*        A   6  -0.952  12.927  -1.567
   60    H2*    A   6           H2*        A   6  -0.238  14.383   0.213
   61   2HO*    A   6          2HO*        A   6   1.428  15.258  -1.507
   62    H1*    A   6           H1*        A   6  -1.439  16.692  -0.621
   63    H8     A   6           H8         A   6  -4.162  14.694  -1.860
   64   1H6     A   6          1H6         A   6  -6.040  13.734   3.976
   65   2H6     A   6          2H6         A   6  -6.407  13.450   2.290
   66    H2     A   6           H2         A   6  -2.062  15.688   4.148
   67   1H5*    U   7          1H5*        U   7   2.770  12.159   0.886
   68   2H5*    U   7          2H5*        U   7   1.876  13.520   0.245
   69    H4*    U   7           H4*        U   7   3.680  14.272   1.616
   70    H3*    U   7           H3*        U   7   3.188  15.454  -0.829
   71    H2*    U   7           H2*        U   7   4.825  14.090  -1.929
   72   2HO*    U   7          2HO*        U   7   5.865  16.612  -1.169
   73    H1*    U   7           H1*        U   7   6.681  14.677   0.419
   74    H3     U   7           H3         U   7  10.157  12.583  -1.478
   75    H5     U   7           H5         U   7   7.130   9.698  -1.484
   76    H6     U   7           H6         U   7   5.522  11.454  -0.900
   77   1H5*    A   8          1H5*        A   8   4.266  19.119  -1.022
   78   2H5*    A   8          2H5*        A   8   3.617  20.026   0.344
   79    H4*    A   8           H4*        A   8   2.891  21.131  -1.580
   80    H3*    A   8           H3*        A   8   1.048  20.324   0.252
   81    H2*    A   8           H2*        A   8   0.495  18.334  -1.048
   82   2HO*    A   8          2HO*        A   8  -1.520  19.425  -0.507
   83    H1*    A   8           H1*        A   8   0.342  20.282  -3.348
   84    H8     A   8           H8         A   8   2.279  16.971  -3.274
   85   1H6     A   8          1H6         A   8  -1.579  15.301  -7.828
   86   2H6     A   8          2H6         A   8  -0.028  14.994  -7.088
   87    H2     A   8           H2         A   8  -3.205  18.983  -5.940
   88   1H5*    C   9          1H5*        C   9  -2.122  21.827  -0.641
   89   2H5*    C   9          2H5*        C   9  -2.369  23.372   0.182
   90    H4*    C   9           H4*        C   9  -4.003  21.845   0.964
   91    H3*    C   9           H3*        C   9  -1.902  22.410   3.040
   92    H2*    C   9           H2*        C   9  -3.182  21.010   4.541
   93   2HO*    C   9          2HO*        C   9  -5.276  21.804   3.322
   94    H1*    C   9           H1*        C   9  -3.617  18.994   2.785
   95   1H4     C   9          1H4         C   9   2.040  17.806   5.597
   96   2H4     C   9          2H4         C   9   2.819  18.238   4.089
   97    H5     C   9           H5         C   9   1.660  19.324   2.300
   98    H6     C   9           H6         C   9  -0.515  20.109   1.528
   99   1H5*    C  10          1H5*        C  10  -5.313  22.708   5.108
  100   2H5*    C  10          2H5*        C  10  -5.461  24.148   6.115
  101    H4*    C  10           H4*        C  10  -5.645  22.087   7.453
  102    H3*    C  10           H3*        C  10  -3.116  23.698   7.965
  103    H2*    C  10           H2*        C  10  -2.780  22.227   9.840
  104   2HO*    C  10          2HO*        C  10  -5.139  22.039  10.341
  105    H1*    C  10           H1*        C  10  -3.292  19.955   8.354
  106   1H4     C  10          1H4         C  10   2.938  20.587   7.643
  107   2H4     C  10          2H4         C  10   2.673  21.364   6.098
  108    H5     C  10           H5         C  10   0.507  22.065   5.333
  109    H6     C  10           H6         C  10  -1.874  22.124   5.899
  110   1H5*    U  11          1H5*        U  11  -4.412  24.120  11.847
  111   2H5*    U  11          2H5*        U  11  -3.990  25.738  12.421
  112    H4*    U  11           H4*        U  11  -2.758  23.805  13.487
  113    H3*    U  11           H3*        U  11  -1.154  25.924  12.066
  114    H2*    U  11           H2*        U  11   0.761  24.958  13.147
  115   2HO*    U  11          2HO*        U  11  -0.549  24.508  15.188
  116    H1*    U  11           H1*        U  11  -0.046  22.376  12.650
  117    H3     U  11           H3         U  11   3.557  23.156   9.924
  118    H5     U  11           H5         U  11   0.367  24.992   7.925
  119    H6     U  11           H6         U  11  -1.044  24.559   9.889
  120   1H5*    C  12          1H5*        C  12   0.536  26.781  16.266
  121   2H5*    C  12          2H5*        C  12   1.544  28.141  15.772
  122    H4*    C  12           H4*        C  12   2.051  25.173  15.654
  123    H3*    C  12           H3*        C  12   3.112  27.198  17.155
  124    H2*    C  12           H2*        C  12   3.843  28.468  15.263
  125   2HO*    C  12          2HO*        C  12   5.744  27.443  16.782
  126    H1*    C  12           H1*        C  12   5.022  25.905  14.137
  127   1H4     C  12          1H4         C  12   6.241  30.080   9.480
  128   2H4     C  12          2H4         C  12   4.579  30.615   9.444
  129    H5     C  12           H5         C  12   2.898  29.774  10.938
  130    H6     C  12           H6         C  12   2.471  28.228  12.795
  131   1H5*    U  13          1H5*        U  13   4.142  22.657  18.003
  132   2H5*    U  13          2H5*        U  13   4.897  22.600  19.599
  133    H4*    U  13           H4*        U  13   5.986  20.820  18.661
  134    H3*    U  13           H3*        U  13   7.746  23.000  18.687
  135    H2*    U  13           H2*        U  13   7.200  23.591  16.423
  136   2HO*    U  13          2HO*        U  13   9.513  21.933  16.485
  137    H1*    U  13           H1*        U  13   7.426  20.612  15.801
  138    H3     U  13           H3         U  13   7.233  21.567  11.371
  139    H5     U  13           H5         U  13   4.234  24.005  12.961
  140    H6     U  13           H6         U  13   4.859  23.227  15.204
  141   1H5*    U  14          1H5*        U  14  10.490  18.199  19.234
  142   2H5*    U  14          2H5*        U  14  11.960  19.023  18.719
  143    H4*    U  14           H4*        U  14   9.333  18.820  17.210
  144    H3*    U  14           H3*        U  14  11.754  17.248  17.175
  145    H2*    U  14           H2*        U  14  12.919  18.873  15.980
  146   2HO*    U  14          2HO*        U  14  11.516  17.230  14.137
  147    H1*    U  14           H1*        U  14  10.296  19.559  14.569
  148    H3     U  14           H3         U  14  12.704  22.165  11.696
  149    H5     U  14           H5         U  14  14.081  23.377  15.457
  150    H6     U  14           H6         U  14  12.698  21.619  16.473
  151   1H5*    G  15          1H5*        G  15   6.947  14.776  15.514
  152   2H5*    G  15          2H5*        G  15   7.486  16.266  14.724
  153    H4*    G  15           H4*        G  15   5.504  16.385  17.009
  154    H3*    G  15           H3*        G  15   4.953  15.701  14.112
  155    H2*    G  15           H2*        G  15   2.786  16.739  14.448
  156   2HO*    G  15          2HO*        G  15   2.664  16.045  16.793
  157    H1*    G  15           H1*        G  15   3.886  18.961  15.515
  158    H8     G  15           H8         G  15   6.677  18.092  13.216
  159    H1     G  15           H1         G  15   1.453  20.110  10.062
  160   1H2     G  15          1H2         G  15  -0.285  19.946  11.333
  161   2H2     G  15          2H2         G  15  -0.156  19.586  13.043
  162   1H5*    G  16          1H5*        G  16   1.322  14.623  15.838
  163   2H5*    G  16          2H5*        G  16   0.846  12.996  15.338
  164    H4*    G  16           H4*        G  16  -0.942  14.589  14.924
  165    H3*    G  16           H3*        G  16   0.343  13.554  12.381
  166    H2*    G  16           H2*        G  16  -1.508  14.645  11.247
  167   2HO*    G  16          2HO*        G  16  -3.061  14.142  13.071
  168    H1*    G  16           H1*        G  16  -1.227  16.965  12.613
  169    H8     G  16           H8         G  16   2.354  15.905  12.433
  170    H1     G  16           H1         G  16   0.034  17.368   6.644
  171   1H2     G  16          1H2         G  16  -2.105  17.744   6.740
  172   2H2     G  16          2H2         G  16  -3.017  17.429   8.205
  173   1H5*    G  17          1H5*        G  17  -3.539  12.681  11.394
  174   2H5*    G  17          2H5*        G  17  -3.658  11.075  10.663
  175    H4*    G  17           H4*        G  17  -4.428  12.847   9.150
  176    H3*    G  17           H3*        G  17  -1.912  11.432   8.231
  177    H2*    G  17           H2*        G  17  -2.205  12.697   6.152
  178   2HO*    G  17          2HO*        G  17  -4.623  12.626   6.342
  179    H1*    G  17           H1*        G  17  -2.421  15.040   7.376
  180    H8     G  17           H8         G  17  -0.297  13.388   9.939
  181    H1     G  17           H1         G  17   2.901  15.132   4.649
  182   1H2     G  17          1H2         G  17   1.502  15.585   3.046
  183   2H2     G  17          2H2         G  17  -0.220  15.303   3.218
  184   1H5*    C  18          1H5*        C  18  -3.767  10.949   4.796
  185   2H5*    C  18          2H5*        C  18  -3.675   9.296   4.162
  186    H4*    C  18           H4*        C  18  -2.588  10.786   2.616
  187    H3*    C  18           H3*        C  18  -0.485   9.237   4.180
  188    H2*    C  18           H2*        C  18   1.071  10.156   2.484
  189   2HO*    C  18          2HO*        C  18  -0.094  10.519   0.570
  190    H1*    C  18           H1*        C  18   0.271  12.607   2.990
  191   1H4     C  18          1H4         C  18   4.351  11.307   7.698
  192   2H4     C  18          2H4         C  18   3.005  10.978   8.760
  193    H5     C  18           H5         C  18   0.718  10.986   8.028
  194    H6     C  18           H6         C  18  -0.731  11.205   6.083
  195   1H5*    C  19          1H5*        C  19   0.819   8.592   0.547
  196   2H5*    C  19          2H5*        C  19   1.177   6.883   0.241
  197    H4*    C  19           H4*        C  19   3.044   8.272  -0.386
  198    H3*    C  19           H3*        C  19   3.633   6.648   2.102
  199    H2*    C  19           H2*        C  19   5.938   7.256   1.620
  200   2HO*    C  19          2HO*        C  19   5.533   7.250  -0.801
  201    H1*    C  19           H1*        C  19   5.320   9.890   1.356
  202   1H4     C  19          1H4         C  19   6.274   8.657   7.571
  203   2H4     C  19          2H4         C  19   4.575   8.297   7.780
  204    H5     C  19           H5         C  19   3.010   8.232   5.969
  205    H6     C  19           H6         C  19   2.736   8.582   3.561
  206   1H5*    U  20          1H5*        U  20   6.522   5.557  -0.619
  207   2H5*    U  20          2H5*        U  20   6.705   3.807  -0.759
  208    H4*    U  20           H4*        U  20   8.866   4.877  -0.388
  209    H3*    U  20           H3*        U  20   7.864   3.267   1.977
  210    H2*    U  20           H2*        U  20  10.133   3.494   2.821
  211   2HO*    U  20          2HO*        U  20  11.143   3.442   0.617
  212    H1*    U  20           H1*        U  20  10.176   6.165   2.378
  213    H3     U  20           H3         U  20   9.387   5.467   6.863
  214    H5     U  20           H5         U  20   5.591   5.597   5.117
  215    H6     U  20           H6         U  20   6.665   5.549   2.912
  216   1H5*    G  21          1H5*        G  21  11.545   1.530   0.763
  217   2H5*    G  21          2H5*        G  21  11.506  -0.232   0.848
  218    H4*    G  21           H4*        G  21  13.408   0.674   2.087
  219    H3*    G  21           H3*        G  21  11.279  -0.568   3.856
  220    H2*    G  21           H2*        G  21  12.910  -0.302   5.650
  221   2HO*    G  21          2HO*        G  21  14.770  -0.674   4.020
  222    H1*    G  21           H1*        G  21  13.479   2.270   4.997
  223    H8     G  21           H8         G  21   9.798   1.827   4.126
  224    H1     G  21           H1         G  21  10.908   2.513  10.425
  225   1H2     G  21          1H2         G  21  12.998   2.192  10.850
  226   2H2     G  21          2H2         G  21  14.183   1.974   9.578
  227   1H5*    G  22          1H5*        G  22  14.823  -2.422   4.947
  228   2H5*    G  22          2H5*        G  22  14.662  -4.170   5.113
  229    H4*    G  22           H4*        G  22  15.647  -3.187   7.111
  230    H3*    G  22           H3*        G  22  12.853  -4.302   7.542
  231    H2*    G  22           H2*        G  22  13.166  -3.831   9.856
  232   2HO*    G  22          2HO*        G  22  15.434  -4.548   9.905
  233    H1*    G  22           H1*        G  22  14.384  -1.391   9.498
  234    H8     G  22           H8         G  22  11.597  -1.559   6.931
  235    H1     G  22           H1         G  22   9.493  -0.468  12.909
  236   1H2     G  22          1H2         G  22  11.032  -0.950  14.338
  237   2H2     G  22          2H2         G  22  12.652  -1.408  13.848
  238   1H5*    U  23          1H5*        U  23  12.505  -8.221  10.316
  239   2H5*    U  23          2H5*        U  23  11.583  -6.856   9.652
  240    H4*    U  23           H4*        U  23  13.011  -6.849  12.327
  241    H3*    U  23           H3*        U  23  10.093  -6.910  11.466
  242    H2*    U  23           H2*        U  23   9.610  -6.153  13.681
  243   2HO*    U  23          2HO*        U  23  11.441  -7.314  14.740
  244    H1*    U  23           H1*        U  23  11.467  -4.155  13.424
  245    H3     U  23           H3         U  23   7.012  -2.818  12.784
  246    H5     U  23           H5         U  23   8.525  -3.589   8.964
  247    H6     U  23           H6         U  23  10.577  -4.459  10.004
  248   1H5*    U  24          1H5*        U  24   9.546  -8.810  14.547
  249   2H5*    U  24          2H5*        U  24   8.794 -10.407  14.504
  250    H4*    U  24           H4*        U  24   7.477  -8.981  15.908
  251    H3*    U  24           H3*        U  24   6.188  -9.324  13.202
  252    H2*    U  24           H2*        U  24   4.207  -8.485  14.153
  253   2HO*    U  24          2HO*        U  24   4.425  -9.516  16.292
  254    H1*    U  24           H1*        U  24   5.582  -6.443  15.423
  255    H3     U  24           H3         U  24   3.113  -4.851  11.823
  256    H5     U  24           H5         U  24   6.740  -6.130  10.156
  257    H6     U  24           H6         U  24   7.398  -6.986  12.362
  258   1H5*    A  25          1H5*        A  25   4.742 -13.259  11.639
  259   2H5*    A  25          2H5*        A  25   6.457 -13.549  11.422
  260    H4*    A  25           H4*        A  25   5.563 -12.989   9.283
  261    H3*    A  25           H3*        A  25   7.691 -11.456  10.210
  262    H2*    A  25           H2*        A  25   6.177  -9.677  10.941
  263   2HO*    A  25          2HO*        A  25   7.865  -8.788   9.661
  264    H1*    A  25           H1*        A  25   4.947 -10.265   8.181
  265    H8     A  25           H8         A  25   3.363  -9.373  11.666
  266   1H6     A  25          1H6         A  25   0.595  -4.777   8.473
  267   2H6     A  25          2H6         A  25   0.531  -5.727   9.946
  268    H2     A  25           H2         A  25   3.594  -6.714   5.823
  269   1H5*    G  26          1H5*        G  26   7.845 -14.139   5.000
  270   2H5*    G  26          2H5*        G  26   7.767 -12.393   4.827
  271    H4*    G  26           H4*        G  26   5.788 -13.196   6.801
  272    H3*    G  26           H3*        G  26   6.101 -15.378   5.094
  273    H2*    G  26           H2*        G  26   5.997 -13.822   3.271
  274   2HO*    G  26          2HO*        G  26   3.527 -15.266   3.444
  275    H1*    G  26           H1*        G  26   3.403 -12.956   4.619
  276    H8     G  26           H8         G  26   5.568 -12.594   1.536
  277    H1     G  26           H1         G  26   0.954  -8.180   2.057
  278   1H2     G  26          1H2         G  26   0.400  -7.982   4.135
  279   2H2     G  26          2H2         G  26   0.896  -9.143   5.356
  280   1H5*    U  27          1H5*        U  27   4.650 -15.991   8.191
  281   2H5*    U  27          2H5*        U  27   3.884 -17.571   8.461
  282    H4*    U  27           H4*        U  27   3.561 -16.561  10.509
  283    H3*    U  27           H3*        U  27   1.075 -15.725   8.943
  284    H2*    U  27           H2*        U  27   0.420 -14.468  10.890
  285   2HO*    U  27          2HO*        U  27   1.526 -16.205  12.331
  286    H1*    U  27           H1*        U  27   2.786 -13.275  11.290
  287    H3     U  27           H3         U  27   0.130 -10.242   9.082
  288    H5     U  27           H5         U  27   2.921 -11.704   6.353
  289    H6     U  27           H6         U  27   3.297 -13.619   7.841
  290   1H5*    A  28          1H5*        A  28  -0.571 -16.032  12.647
  291   2H5*    A  28          2H5*        A  28  -1.845 -17.248  12.609
  292    H4*    A  28           H4*        A  28  -2.742 -15.186  13.505
  293    H3*    A  28           H3*        A  28  -3.739 -15.793  10.694
  294    H2*    A  28           H2*        A  28  -5.148 -13.838  10.925
  295   2HO*    A  28          2HO*        A  28  -5.477 -14.300  13.326
  296    H1*    A  28           H1*        A  28  -3.190 -12.257  11.944
  297    H8     A  28           H8         A  28  -1.095 -14.150   9.550
  298   1H6     A  28          1H6         A  28  -3.336 -10.327   5.180
  299   2H6     A  28          2H6         A  28  -2.094 -11.513   5.538
  300    H2     A  28           H2         A  28  -6.248 -10.462   8.518
  301   1H5*    C  29          1H5*        C  29  -7.289 -15.037  11.984
  302   2H5*    C  29          2H5*        C  29  -8.499 -16.256  11.553
  303    H4*    C  29           H4*        C  29  -8.993 -14.170  10.419
  304    H3*    C  29           H3*        C  29  -7.946 -16.286   8.524
  305    H2*    C  29           H2*        C  29  -8.465 -14.704   6.743
  306   2HO*    C  29          2HO*        C  29 -10.453 -13.888   7.911
  307    H1*    C  29           H1*        C  29  -7.320 -12.609   7.935
  308   1H4     C  29          1H4         C  29  -2.540 -15.330   4.732
  309   2H4     C  29          2H4         C  29  -2.063 -16.183   6.181
  310    H5     C  29           H5         C  29  -3.379 -16.226   8.176
  311    H6     C  29           H6         C  29  -5.407 -15.365   9.229
  312   1H5*    C  30          1H5*        C  30 -11.536 -15.356   6.679
  313   2H5*    C  30          2H5*        C  30 -12.374 -16.801   6.094
  314    H4*    C  30           H4*        C  30 -11.844 -15.259   4.262
  315    H3*    C  30           H3*        C  30 -10.187 -17.794   4.163
  316    H2*    C  30           H2*        C  30  -9.534 -17.021   1.952
  317   2HO*    C  30          2HO*        C  30 -11.773 -15.973   1.630
  318    H1*    C  30           H1*        C  30  -9.053 -14.474   2.841
  319   1H4     C  30          1H4         C  30  -3.723 -17.991   3.169
  320   2H4     C  30          2H4         C  30  -4.120 -18.488   4.799
  321    H5     C  30           H5         C  30  -6.166 -17.877   5.899
  322    H6     C  30           H6         C  30  -8.295 -16.697   5.616
  323   1H5*    U  31          1H5*        U  31 -12.215 -17.405   0.379
  324   2H5*    U  31          2H5*        U  31 -13.122 -18.865  -0.010
  325    H4*    U  31           H4*        U  31 -12.003 -18.028  -1.979
  326    H3*    U  31           H3*        U  31 -10.748 -20.589  -0.973
  327    H2*    U  31           H2*        U  31  -9.495 -20.597  -3.018
  328   2HO*    U  31          2HO*        U  31 -11.366 -19.697  -4.296
  329    H1*    U  31           H1*        U  31  -8.847 -17.940  -2.886
  330    H3     U  31           H3         U  31  -5.012 -20.259  -1.785
  331    H5     U  31           H5         U  31  -7.066 -19.726   1.830
  332    H6     U  31           H6         U  31  -9.026 -18.988   0.556
  333   1H5*    C  32          1H5*        C  32 -11.810 -21.894  -4.562
  334   2H5*    C  32          2H5*        C  32 -12.528 -23.509  -4.580
  335    H4*    C  32           H4*        C  32 -10.450 -23.505  -5.839
  336    H3*    C  32           H3*        C  32 -10.127 -24.957  -3.191
  337    H2*    C  32           H2*        C  32  -7.914 -25.523  -3.965
  338   2HO*    C  32          2HO*        C  32  -8.805 -25.711  -6.300
  339    H1*    C  32           H1*        C  32  -7.377 -23.017  -4.980
  340   1H4     C  32          1H4         C  32  -5.053 -23.484   0.946
  341   2H4     C  32          2H4         C  32  -6.621 -23.125   1.634
  342    H5     C  32           H5         C  32  -8.589 -22.776   0.307
  343    H6     C  32           H6         C  32  -9.466 -22.771  -1.981
  344   1H5*    U  33          1H5*        U  33  -8.189 -27.532  -5.236
  345   2H5*    U  33          2H5*        U  33  -8.876 -29.157  -5.187
  346    H4*    U  33           H4*        U  33  -6.566 -29.313  -4.492
  347    H3*    U  33           H3*        U  33  -8.463 -29.462  -2.130
  348    H2*    U  33           H2*        U  33  -6.690 -29.839  -0.759
  349   2HO*    U  33          2HO*        U  33  -4.676 -30.328  -2.748
  350    H1*    U  33           H1*        U  33  -4.862 -28.236  -2.210
  351    H3     U  33           H3         U  33  -4.934 -26.622   2.066
  352    H5     U  33           H5         U  33  -8.836 -25.933   0.729
  353    H6     U  33           H6         U  33  -8.239 -26.990  -1.406
  354   1H5*    U  34          1H5*        U  34  -8.561 -35.088  -1.498
  355   2H5*    U  34          2H5*        U  34  -7.869 -34.142  -0.175
  356    H4*    U  34           H4*        U  34  -6.693 -36.261  -0.472
  357    H3*    U  34           H3*        U  34  -5.329 -33.916  -0.066
  358    H2*    U  34           H2*        U  34  -4.987 -33.492  -2.404
  359   2HO*    U  34          2HO*        U  34  -2.741 -34.933  -1.380
  360    H1*    U  34           H1*        U  34  -4.239 -36.430  -2.671
  361    H3     U  34           H3         U  34  -3.164 -35.868  -7.021
  362    H5     U  34           H5         U  34  -6.557 -33.453  -6.631
  363    H6     U  34           H6         U  34  -6.649 -34.056  -4.251
  364   1H5*    C  35          1H5*        C  35  -1.880 -34.096   0.716
  365   2H5*    C  35          2H5*        C  35  -1.544 -35.000   2.192
  366    H4*    C  35           H4*        C  35  -0.543 -32.787   2.242
  367    H3*    C  35           H3*        C  35  -1.784 -33.861   4.426
  368    H2*    C  35           H2*        C  35  -3.916 -32.895   3.915
  369   2HO*    C  35          2HO*        C  35  -2.502 -31.187   5.703
  370    H1*    C  35           H1*        C  35  -2.568 -30.234   3.348
  371   1H4     C  35          1H4         C  35  -8.733 -29.371   1.922
  372   2H4     C  35          2H4         C  35  -8.676 -30.660   0.732
  373    H5     C  35           H5         C  35  -6.766 -32.054   0.435
  374    H6     C  35           H6         C  35  -4.414 -32.356   1.010
  375   1H5*    G  36          1H5*        G  36   2.677 -30.568   4.530
  376   2H5*    G  36          2H5*        G  36   1.143 -30.624   3.646
  377    H4*    G  36           H4*        G  36   3.717 -31.993   2.769
  378    H3*    G  36           H3*        G  36   2.235 -29.535   1.754
  379    H2*    G  36           H2*        G  36   3.087 -30.062  -0.396
  380   2HO*    G  36          2HO*        G  36   5.295 -30.577   0.718
  381    H1*    G  36           H1*        G  36   3.122 -32.865   0.079
  382    H8     G  36           H8         G  36   1.862 -33.303  -2.185
  383    H1     G  36           H1         G  36  -2.813 -29.120  -0.728
  384   1H2     G  36          1H2         G  36  -2.414 -28.156   1.135
  385   2H2     G  36          2H2         G  36  -0.962 -28.461   2.060
  386   1H5*    G  37          1H5*        G  37   4.829 -28.491  -0.195
  387   2H5*    G  37          2H5*        G  37   5.290 -26.790  -0.216
  388    H4*    G  37           H4*        G  37   4.020 -27.700  -2.246
  389    H3*    G  37           H3*        G  37   2.871 -25.293  -0.785
  390    H2*    G  37           H2*        G  37   1.375 -25.196  -2.741
  391   2HO*    G  37          2HO*        G  37   3.177 -26.156  -4.204
  392    H1*    G  37           H1*        G  37   0.736 -27.804  -2.581
  393    H8     G  37           H8         G  37   1.421 -26.562   0.986
  394    H1     G  37           H1         G  37  -4.109 -24.435  -1.495
  395   1H2     G  37          1H2         G  37  -4.224 -24.952  -3.586
  396   2H2     G  37          2H2         G  37  -3.047 -25.996  -4.353
  397   1H5*    U  38          1H5*        U  38   2.450 -24.267  -4.629
  398   2H5*    U  38          2H5*        U  38   3.143 -22.724  -5.105
  399    H4*    U  38           H4*        U  38   0.838 -22.914  -5.833
  400    H3*    U  38           H3*        U  38   1.173 -20.881  -3.649
  401    H2*    U  38           H2*        U  38  -1.039 -20.124  -4.219
  402   2HO*    U  38          2HO*        U  38  -0.941 -20.476  -6.538
  403    H1*    U  38           H1*        U  38  -2.054 -22.649  -4.158
  404    H3     U  38           H3         U  38  -3.262 -20.897  -0.088
  405    H5     U  38           H5         U  38   0.618 -22.337   0.502
  406    H6     U  38           H6         U  38   0.788 -22.722  -1.910
  407   1H5*    G  39          1H5*        G  39   0.207 -18.553  -6.916
  408   2H5*    G  39          2H5*        G  39   1.053 -17.008  -6.876
  409    H4*    G  39           H4*        G  39  -1.310 -16.673  -7.018
  410    H3*    G  39           H3*        G  39  -0.380 -15.928  -4.240
  411    H2*    G  39           H2*        G  39  -2.648 -15.031  -4.008
  412   2HO*    G  39          2HO*        G  39  -2.777 -14.457  -6.410
  413    H1*    G  39           H1*        G  39  -3.757 -17.329  -4.871
  414    H8     G  39           H8         G  39  -0.440 -18.263  -3.190
  415    H1     G  39           H1         G  39  -5.150 -16.831   0.936
  416   1H2     G  39          1H2         G  39  -6.771 -15.862  -0.113
  417   2H2     G  39          2H2         G  39  -6.816 -15.754  -1.859
  418   1H5*    G  40          1H5*        G  40  -2.445 -12.682  -5.650
  419   2H5*    G  40          2H5*        G  40  -1.711 -11.136  -5.203
  420    H4*    G  40           H4*        G  40  -4.085 -11.202  -4.638
  421    H3*    G  40           H3*        G  40  -2.136 -11.009  -2.316
  422    H2*    G  40           H2*        G  40  -4.109 -10.754  -0.907
  423   2HO*    G  40          2HO*        G  40  -5.263  -9.498  -2.725
  424    H1*    G  40           H1*        G  40  -5.490 -12.778  -2.026
  425    H8     G  40           H8         G  40  -1.954 -14.059  -2.195
  426    H1     G  40           H1         G  40  -4.290 -13.947   3.790
  427   1H2     G  40          1H2         G  40  -6.108 -12.790   3.861
  428   2H2     G  40          2H2         G  40  -6.785 -12.035   2.433
  429   1H5*    G  41          1H5*        G  41  -4.488  -8.549  -0.744
  430   2H5*    G  41          2H5*        G  41  -3.727  -7.017  -0.311
  431    H4*    G  41           H4*        G  41  -4.480  -8.061   1.723
  432    H3*    G  41           H3*        G  41  -1.480  -8.357   1.398
  433    H2*    G  41           H2*        G  41  -1.507  -9.154   3.712
  434   2HO*    G  41          2HO*        G  41  -3.314  -7.892   4.514
  435    H1*    G  41           H1*        G  41  -3.421 -10.968   3.158
  436    H8     G  41           H8         G  41  -1.637 -10.550  -0.168
  437    H1     G  41           H1         G  41   1.469 -14.375   3.953
  438   1H2     G  41          1H2         G  41   0.628 -14.212   5.920
  439   2H2     G  41          2H2         G  41  -0.720 -13.160   6.300
  440   1H5*    A  42          1H5*        A  42  -0.434  -4.529   5.094
  441   2H5*    A  42          2H5*        A  42  -0.292  -5.915   6.179
  442    H4*    A  42           H4*        A  42  -2.848  -4.867   4.907
  443    H3*    A  42           H3*        A  42  -1.809  -5.123   7.740
  444    H2*    A  42           H2*        A  42  -4.080  -5.449   8.495
  445   2HO*    A  42          2HO*        A  42  -4.969  -3.960   6.727
  446    H1*    A  42           H1*        A  42  -4.605  -7.379   6.714
  447    H8     A  42           H8         A  42  -1.091  -8.255   6.776
  448   1H6     A  42          1H6         A  42  -1.784 -10.343  12.605
  449   2H6     A  42          2H6         A  42  -0.793 -10.432  11.167
  450    H2     A  42           H2         A  42  -5.366  -7.936  11.594
  451   1H5*    A  43          1H5*        A  43  -4.488  -2.531   8.154
  452   2H5*    A  43          2H5*        A  43  -4.453  -0.963   8.924
  453    H4*    A  43           H4*        A  43  -5.887  -2.409  10.213
  454    H3*    A  43           H3*        A  43  -3.202  -2.046  11.606
  455    H2*    A  43           H2*        A  43  -4.070  -3.443  13.385
  456   2HO*    A  43          2HO*        A  43  -6.320  -2.452  13.078
  457    H1*    A  43           H1*        A  43  -5.184  -5.316  11.682
  458    H8     A  43           H8         A  43  -2.087  -4.561   9.827
  459   1H6     A  43          1H6         A  43   0.927  -8.278  13.765
  460   2H6     A  43          2H6         A  43   0.963  -7.552  12.169
  461    H2     A  43           H2         A  43  -2.953  -7.173  15.632
  462   1H5*    U  44          1H5*        U  44  -5.217  -1.316  14.835
  463   2H5*    U  44          2H5*        U  44  -4.695   0.172  15.648
  464    H4*    U  44           H4*        U  44  -4.148  -1.722  17.051
  465    H3*    U  44           H3*        U  44  -1.694  -0.566  15.692
  466    H2*    U  44           H2*        U  44  -0.417  -2.031  17.113
  467   2HO*    U  44          2HO*        U  44  -2.061  -1.758  18.949
  468    H1*    U  44           H1*        U  44  -1.997  -4.210  16.633
  469    H3     U  44           H3         U  44   1.925  -4.682  14.197
  470    H5     U  44           H5         U  44  -0.582  -2.394  11.751
  471    H6     U  44           H6         U  44  -2.141  -2.191  13.629
  472   1H5*    A  45          1H5*        A  45  -0.603  -0.461  19.630
  473   2H5*    A  45          2H5*        A  45   0.243   1.029  20.067
  474    H4*    A  45           H4*        A  45   1.619  -0.929  20.510
  475    H3*    A  45           H3*        A  45   2.684   0.718  18.182
  476    H2*    A  45           H2*        A  45   4.647  -0.668  18.382
  477   2HO*    A  45          2HO*        A  45   4.380  -0.873  20.829
  478    H1*    A  45           H1*        A  45   3.208  -2.967  18.430
  479    H8     A  45           H8         A  45   1.184  -0.547  16.296
  480   1H6     A  45          1H6         A  45   4.897  -2.193  11.580
  481   2H6     A  45          2H6         A  45   3.383  -1.422  12.011
  482    H2     A  45           H2         A  45   6.618  -3.832  15.316
  483   1H5*    C  46          1H5*        C  46   5.783   0.514  20.920
  484   2H5*    C  46          2H5*        C  46   6.550   2.088  21.151
  485    H4*    C  46           H4*        C  46   8.194   0.394  20.585
  486    H3*    C  46           H3*        C  46   7.764   2.394  18.334
  487    H2*    C  46           H2*        C  46   9.781   1.436  17.415
  488   2HO*    C  46          2HO*        C  46  10.745   1.070  19.649
  489    H1*    C  46           H1*        C  46   8.944  -1.135  17.874
  490   1H4     C  46          1H4         C  46   6.981   0.339  11.995
  491   2H4     C  46          2H4         C  46   5.441   0.875  12.629
  492    H5     C  46           H5         C  46   4.983   1.081  14.978
  493    H6     C  46           H6         C  46   5.909   0.742  17.224
  494   1H5*    C  47          1H5*        C  47  11.816   2.737  19.303
  495   2H5*    C  47          2H5*        C  47  12.335   4.425  19.298
  496    H4*    C  47           H4*        C  47  13.713   3.077  17.809
  497    H3*    C  47           H3*        C  47  11.897   4.979  16.305
  498    H2*    C  47           H2*        C  47  13.305   4.433  14.398
  499   2HO*    C  47          2HO*        C  47  15.316   4.227  15.753
  500    H1*    C  47           H1*        C  47  13.199   1.747  14.934
  501   1H4     C  47          1H4         C  47   8.349   2.989  10.991
  502   2H4     C  47          2H4         C  47   7.322   3.414  12.341
  503    H5     C  47           H5         C  47   8.103   3.532  14.608
  504    H6     C  47           H6         C  47  10.056   3.224  16.057
  505   1H5*    A  48          1H5*        A  48  15.873   6.079  15.240
  506   2H5*    A  48          2H5*        A  48  16.033   7.830  15.084
  507    H4*    A  48           H4*        A  48  16.795   6.688  13.075
  508    H3*    A  48           H3*        A  48  14.219   8.216  12.615
  509    H2*    A  48           H2*        A  48  14.661   7.787  10.253
  510   2HO*    A  48          2HO*        A  48  17.120   7.849  10.624
  511    H1*    A  48           H1*        A  48  15.073   5.147  10.686
  512    H8     A  48           H8         A  48  12.578   6.201  13.351
  513   1H6     A  48          1H6         A  48   8.202   5.809   8.954
  514   2H6     A  48          2H6         A  48   8.503   5.985  10.671
  515    H2     A  48           H2         A  48  12.162   5.492   6.971
  516   1H5*    G  49          1H5*        G  49  16.853   9.600   9.790
  517   2H5*    G  49          2H5*        G  49  16.815  11.344   9.555
  518    H4*    G  49           H4*        G  49  16.572  10.148   7.449
  519    H3*    G  49           H3*        G  49  14.011  11.588   8.244
  520    H2*    G  49           H2*        G  49  13.294  11.026   5.976
  521   2HO*    G  49          2HO*        G  49  15.672  11.166   5.174
  522    H1*    G  49           H1*        G  49  14.022   8.437   6.224
  523    H8     G  49           H8         G  49  13.012   9.329   9.751
  524    H1     G  49           H1         G  49   8.011   8.854   5.738
  525   1H2     G  49          1H2         G  49   8.698   8.975   3.696
  526   2H2     G  49          2H2         G  49  10.398   8.909   3.283
  527   1H5*    G  50          1H5*        G  50  14.641  12.690   4.397
  528   2H5*    G  50          2H5*        G  50  14.590  14.427   4.126
  529    H4*    G  50           H4*        G  50  13.163  13.221   2.543
  530    H3*    G  50           H3*        G  50  11.618  14.920   4.534
  531    H2*    G  50           H2*        G  50   9.683  14.421   3.116
  532   2HO*    G  50          2HO*        G  50  11.142  14.390   1.104
  533    H1*    G  50           H1*        G  50  10.269  11.760   2.946
  534    H8     G  50           H8         G  50  11.321  12.340   6.469
  535    H1     G  50           H1         G  50   4.922  12.336   5.712
  536   1H2     G  50          1H2         G  50   4.434  12.437   3.623
  537   2H2     G  50          2H2         G  50   5.647  12.727   2.393
  538   1H5*    U  51          1H5*        U  51  10.216  16.074   0.877
  539   2H5*    U  51          2H5*        U  51  10.490  17.774   0.490
  540    H4*    U  51           H4*        U  51   8.189  17.146  -0.008
  541    H3*    U  51           H3*        U  51   8.936  19.345   1.591
  542    H2*    U  51           H2*        U  51   8.204  18.555   3.569
  543   2HO*    U  51          2HO*        U  51   5.521  19.041   2.728
  544    H1*    U  51           H1*        U  51   5.942  16.978   2.352
  545    H3     U  51           H3         U  51   4.878  15.608   6.462
  546    H5     U  51           H5         U  51   9.048  15.925   6.699
  547    H6     U  51           H6         U  51   9.092  16.431   4.297
  548   1H5*    G  52          1H5*        G  52   7.968  21.568  -2.425
  549   2H5*    G  52          2H5*        G  52   6.353  21.850  -3.055
  550    H4*    G  52           H4*        G  52   7.594  19.114  -2.563
  551    H3*    G  52           H3*        G  52   6.865  20.719  -5.047
  552    H2*    G  52           H2*        G  52   6.685  18.601  -6.182
  553   2HO*    G  52          2HO*        G  52   8.530  17.654  -4.842
  554    H1*    G  52           H1*        G  52   5.227  17.483  -4.159
  555    H8     G  52           H8         G  52   4.132  21.119  -4.296
  556    H1     G  52           H1         G  52   1.419  17.364  -8.755
  557   1H2     G  52          1H2         G  52   2.621  15.592  -9.050
  558   2H2     G  52          2H2         G  52   3.970  15.196  -8.007
  559   1H5*    C  53          1H5*        C  53   9.545  17.980  -6.642
  560   2H5*    C  53          2H5*        C  53  10.644  18.754  -7.784
  561    H4*    C  53           H4*        C  53   9.489  16.886  -8.812
  562    H3*    C  53           H3*        C  53   8.530  19.543  -9.933
  563    H2*    C  53           H2*        C  53   7.476  18.172 -11.630
  564   2HO*    C  53          2HO*        C  53   9.318  16.521 -11.530
  565    H1*    C  53           H1*        C  53   6.446  16.424  -9.800
  566   1H4     C  53          1H4         C  53   1.969  20.885 -10.466
  567   2H4     C  53          2H4         C  53   2.700  21.836  -9.193
  568    H5     C  53           H5         C  53   4.843  21.334  -8.239
  569    H6     C  53           H6         C  53   6.656  19.687  -8.188
  570   1H5*    C  54          1H5*        C  54   9.841  17.391 -13.258
  571   2H5*    C  54          2H5*        C  54  10.746  18.405 -14.383
  572    H4*    C  54           H4*        C  54   8.893  17.290 -15.503
  573    H3*    C  54           H3*        C  54   8.448  20.283 -15.225
  574    H2*    C  54           H2*        C  54   6.633  19.930 -16.788
  575   2HO*    C  54          2HO*        C  54   7.886  18.142 -17.946
  576    H1*    C  54           H1*        C  54   5.697  17.737 -15.442
  577   1H4     C  54          1H4         C  54   2.610  22.695 -12.923
  578   2H4     C  54          2H4         C  54   3.879  22.910 -11.738
  579    H5     C  54           H5         C  54   5.956  21.708 -11.799
  580    H6     C  54           H6         C  54   7.197  19.945 -12.963
  581   1H5*    C  55          1H5*        C  55   8.130  19.597 -19.340
  582   2H5*    C  55          2H5*        C  55   9.009  20.826 -20.254
  583    H4*    C  55           H4*        C  55   6.687  20.697 -20.990
  584    H3*    C  55           H3*        C  55   7.354  23.247 -19.487
  585    H2*    C  55           H2*        C  55   5.205  24.039 -20.164
  586   2HO*    C  55          2HO*        C  55   5.388  23.040 -22.372
  587    H1*    C  55           H1*        C  55   3.923  21.625 -19.701
  588   1H4     C  55          1H4         C  55   3.117  25.388 -14.604
  589   2H4     C  55          2H4         C  55   4.662  24.890 -13.954
  590    H5     C  55           H5         C  55   6.171  23.429 -15.115
  591    H6     C  55           H6         C  55   6.512  22.154 -17.180
  592   1H    MET 104          1H        MET 104  10.682 -15.552   3.044
  593    HA   MET 104           HA       MET 104  11.350 -12.705   2.583
  594   1HB   MET 104          1HB       MET 104  13.278 -13.810   3.839
  595   2HB   MET 104          2HB       MET 104  13.498 -14.869   2.456
  596   1HG   MET 104          1HG       MET 104  14.807 -13.347   1.522
  597   2HG   MET 104          2HG       MET 104  13.472 -12.215   1.401
  598   1HE   MET 104          1HE       MET 104  13.462  -9.880   2.785
  599   2HE   MET 104          2HE       MET 104  12.689 -11.019   3.926
  600   3HE   MET 104          3HE       MET 104  13.918  -9.883   4.497
  601    H    TYR 105           H        TYR 105  11.034 -12.184   0.500
  602    HA   TYR 105           HA       TYR 105  10.597 -14.418  -1.454
  603   1HB   TYR 105          1HB       TYR 105   9.332 -11.687  -1.091
  604   2HB   TYR 105          2HB       TYR 105   9.243 -12.521  -2.633
  605    HD1  TYR 105           HD1      TYR 105   8.500 -13.234   1.107
  606    HD2  TYR 105           HD2      TYR 105   7.630 -14.125  -3.061
  607    HE1  TYR 105           HE1      TYR 105   6.847 -14.900   1.797
  608    HE2  TYR 105           HE2      TYR 105   5.815 -15.654  -2.315
  609    HH   TYR 105           HH       TYR 105   5.071 -16.178   1.145
  610    H    VAL 106           H        VAL 106  11.989 -14.648  -3.076
  611    HA   VAL 106           HA       VAL 106  14.014 -12.476  -3.466
  612    HB   VAL 106           HB       VAL 106  14.172 -15.465  -4.001
  613   1HG1  VAL 106          1HG1      VAL 106  16.629 -15.130  -4.116
  614   2HG1  VAL 106          2HG1      VAL 106  15.800 -14.283  -5.409
  615   3HG1  VAL 106          3HG1      VAL 106  16.396 -13.374  -4.001
  616   1HG2  VAL 106          1HG2      VAL 106  15.635 -15.565  -2.064
  617   2HG2  VAL 106          2HG2      VAL 106  15.344 -13.825  -1.739
  618   3HG2  VAL 106          3HG2      VAL 106  14.015 -15.014  -1.602
  619    H    CYS 107           H        CYS 107  14.533 -11.668  -5.437
  620    HA   CYS 107           HA       CYS 107  12.877 -12.306  -7.765
  621   1HB   CYS 107          1HB       CYS 107  13.616  -9.978  -7.276
  622   2HB   CYS 107          2HB       CYS 107  15.298 -10.493  -7.418
  623    H    HIS 108           H        HIS 108  13.369 -13.717  -9.329
  624    HA   HIS 108           HA       HIS 108  16.063 -15.004  -9.241
  625   1HB   HIS 108          1HB       HIS 108  13.392 -16.107 -10.229
  626   2HB   HIS 108          2HB       HIS 108  14.932 -16.978 -10.250
  627    HD2  HIS 108           HD2      HIS 108  11.988 -17.160  -8.305
  628    HE1  HIS 108           HE1      HIS 108  14.911 -17.222  -5.190
  629    HE2  HIS 108           HE2      HIS 108  12.466 -17.674  -5.767
  630    H    PHE 109           H        PHE 109  15.195 -12.483 -10.724
  631    HA   PHE 109           HA       PHE 109  15.259 -13.049 -13.557
  632   1HB   PHE 109          1HB       PHE 109  14.756 -10.798 -12.250
  633   2HB   PHE 109          2HB       PHE 109  16.494 -10.560 -12.313
  634    HD1  PHE 109           HD1      PHE 109  17.614 -10.148 -14.462
  635    HD2  PHE 109           HD2      PHE 109  13.346 -10.594 -14.109
  636    HE1  PHE 109           HE1      PHE 109  17.309  -9.289 -16.812
  637    HE2  PHE 109           HE2      PHE 109  13.034  -9.773 -16.440
  638    HZ   PHE 109           HZ       PHE 109  15.008  -9.102 -17.784
  639    H    GLU 110           H        GLU 110  17.105 -12.806 -14.997
  640    HA   GLU 110           HA       GLU 110  19.190 -14.530 -14.320
  641   1HB   GLU 110          1HB       GLU 110  19.121 -12.337 -16.439
  642   2HB   GLU 110          2HB       GLU 110  20.356 -13.593 -16.360
  643   1HG   GLU 110          1HG       GLU 110  17.367 -14.100 -16.722
  644   2HG   GLU 110          2HG       GLU 110  18.552 -14.045 -18.018
  645    H    ASN 111           H        ASN 111  20.674 -14.311 -12.751
  646    HA   ASN 111           HA       ASN 111  22.611 -13.575 -11.727
  647   1HB   ASN 111          1HB       ASN 111  23.183 -12.809 -14.153
  648   2HB   ASN 111          2HB       ASN 111  22.742 -11.185 -13.618
  649   1HD2  ASN 111          1HD2      ASN 111  24.796 -10.255 -13.725
  650   2HD2  ASN 111          2HD2      ASN 111  26.122 -10.804 -12.711
  651    H    CYS 112           H        CYS 112  19.719 -12.338 -11.313
  652    HA   CYS 112           HA       CYS 112  20.353  -9.748 -10.078
  653   1HB   CYS 112          1HB       CYS 112  18.259 -10.083 -11.291
  654   2HB   CYS 112          2HB       CYS 112  17.742 -11.339 -10.141
  655    H    GLY 113           H        GLY 113  18.369 -12.420  -8.685
  656   1HA   GLY 113          1HA       GLY 113  18.488 -13.543  -6.665
  657   2HA   GLY 113          2HA       GLY 113  20.191 -13.058  -6.569
  658    H    LYS 114           H        LYS 114  17.972 -10.369  -6.845
  659    HA   LYS 114           HA       LYS 114  18.643  -9.385  -4.194
  660   1HB   LYS 114          1HB       LYS 114  17.999  -8.117  -6.367
  661   2HB   LYS 114          2HB       LYS 114  16.323  -8.367  -5.858
  662   1HG   LYS 114          1HG       LYS 114  16.712  -7.066  -3.828
  663   2HG   LYS 114          2HG       LYS 114  18.475  -7.090  -4.088
  664   1HD   LYS 114          1HD       LYS 114  18.219  -5.776  -6.162
  665   2HD   LYS 114          2HD       LYS 114  16.474  -5.825  -5.958
  666   1HE   LYS 114          1HE       LYS 114  17.220  -3.680  -5.394
  667   2HE   LYS 114          2HE       LYS 114  16.591  -4.475  -3.939
  668   1HZ   LYS 114          1HZ       LYS 114  19.480  -4.198  -4.620
  669   2HZ   LYS 114          2HZ       LYS 114  18.697  -3.314  -3.498
  670   3HZ   LYS 114          3HZ       LYS 114  18.901  -4.914  -3.265
  671    H    ALA 115           H        ALA 115  17.422  -9.286  -2.309
  672    HA   ALA 115           HA       ALA 115  15.026 -11.086  -2.252
  673   1HB   ALA 115          1HB       ALA 115  17.014 -12.077  -1.228
  674   2HB   ALA 115          2HB       ALA 115  17.174 -10.682  -0.126
  675   3HB   ALA 115          3HB       ALA 115  15.761 -11.762  -0.022
  676    H    PHE 116           H        PHE 116  13.204 -10.438  -1.257
  677    HA   PHE 116           HA       PHE 116  13.227  -7.763   0.090
  678   1HB   PHE 116          1HB       PHE 116  10.970  -8.941  -1.577
  679   2HB   PHE 116          2HB       PHE 116  11.115  -7.327  -0.931
  680    HD1  PHE 116           HD1      PHE 116  12.476  -9.707  -3.438
  681    HD2  PHE 116           HD2      PHE 116  12.303  -5.597  -2.147
  682    HE1  PHE 116           HE1      PHE 116  13.886  -9.078  -5.348
  683    HE2  PHE 116           HE2      PHE 116  13.754  -4.961  -4.092
  684    HZ   PHE 116           HZ       PHE 116  14.573  -6.759  -5.644
  685    H    LYS 117           H        LYS 117  11.608  -7.382   1.668
  686    HA   LYS 117           HA       LYS 117  11.137  -9.504   3.474
  687   1HB   LYS 117          1HB       LYS 117  11.127  -7.036   3.966
  688   2HB   LYS 117          2HB       LYS 117   9.521  -6.911   3.231
  689   1HG   LYS 117          1HG       LYS 117   8.542  -8.337   4.902
  690   2HG   LYS 117          2HG       LYS 117  10.153  -8.868   5.424
  691   1HD   LYS 117          1HD       LYS 117  10.506  -6.348   6.071
  692   2HD   LYS 117          2HD       LYS 117   8.753  -6.208   5.892
  693   1HE   LYS 117          1HE       LYS 117   9.511  -6.621   8.236
  694   2HE   LYS 117          2HE       LYS 117   8.378  -7.842   7.635
  695   1HZ   LYS 117          1HZ       LYS 117  10.146  -9.351   7.328
  696   2HZ   LYS 117          2HZ       LYS 117  11.295  -8.195   7.717
  697   3HZ   LYS 117          3HZ       LYS 117  10.230  -8.794   8.859
  698    H    LYS 118           H        LYS 118   9.006  -8.044   0.970
  699    HA   LYS 118           HA       LYS 118   7.092 -10.330   1.348
  700   1HB   LYS 118          1HB       LYS 118   6.365  -7.344   1.232
  701   2HB   LYS 118          2HB       LYS 118   5.212  -8.669   1.310
  702   1HG   LYS 118          1HG       LYS 118   6.840  -9.372   3.354
  703   2HG   LYS 118          2HG       LYS 118   7.128  -7.641   3.388
  704   1HD   LYS 118          1HD       LYS 118   5.065  -7.280   4.395
  705   2HD   LYS 118          2HD       LYS 118   4.315  -8.631   3.534
  706   1HE   LYS 118          1HE       LYS 118   4.504  -9.518   5.798
  707   2HE   LYS 118          2HE       LYS 118   5.816 -10.199   4.848
  708   1HZ   LYS 118          1HZ       LYS 118   5.934  -8.335   7.034
  709   2HZ   LYS 118          2HZ       LYS 118   6.972  -9.554   6.631
  710   3HZ   LYS 118          3HZ       LYS 118   7.052  -8.125   5.838
  711    H    HIS 119           H        HIS 119   5.641 -10.733  -0.432
  712    HA   HIS 119           HA       HIS 119   7.067 -10.770  -2.897
  713   1HB   HIS 119          1HB       HIS 119   5.014 -11.726  -3.867
  714   2HB   HIS 119          2HB       HIS 119   5.522 -12.498  -2.397
  715    HD1  HIS 119           HD1      HIS 119   2.721  -9.815  -3.187
  716    HD2  HIS 119           HD2      HIS 119   3.662 -13.349  -1.065
  717    HE1  HIS 119           HE1      HIS 119   0.550 -10.553  -1.953
  718    HE2  HIS 119           HE2      HIS 119   1.156 -12.675  -0.703
  719    H    ASN 120           H        ASN 120   4.672  -8.469  -1.661
  720    HA   ASN 120           HA       ASN 120   4.003  -7.257  -4.173
  721   1HB   ASN 120          1HB       ASN 120   3.786  -6.492  -1.255
  722   2HB   ASN 120          2HB       ASN 120   3.724  -5.183  -2.433
  723   1HD2  ASN 120          1HD2      ASN 120   1.694  -7.418  -0.835
  724   2HD2  ASN 120          2HD2      ASN 120   0.419  -7.399  -2.050
  725    H    GLN 121           H        GLN 121   6.757  -6.805  -1.931
  726    HA   GLN 121           HA       GLN 121   7.814  -4.466  -3.366
  727   1HB   GLN 121          1HB       GLN 121   9.397  -6.286  -1.572
  728   2HB   GLN 121          2HB       GLN 121   9.625  -4.559  -1.954
  729   1HG   GLN 121          1HG       GLN 121   7.682  -3.997  -0.596
  730   2HG   GLN 121          2HG       GLN 121   7.483  -5.716  -0.160
  731   1HE2  GLN 121          1HE2      GLN 121   8.657  -2.902   1.133
  732   2HE2  GLN 121          2HE2      GLN 121   9.914  -3.591   2.155
  733    H    LEU 122           H        LEU 122   8.334  -8.030  -3.314
  734    HA   LEU 122           HA       LEU 122  10.510  -8.125  -5.127
  735   1HB   LEU 122          1HB       LEU 122   9.844 -10.072  -3.861
  736   2HB   LEU 122          2HB       LEU 122   8.228 -10.048  -4.539
  737    HG   LEU 122           HG       LEU 122   9.004 -10.758  -6.707
  738   1HD1  LEU 122          1HD1      LEU 122  11.257  -9.657  -6.641
  739   2HD1  LEU 122          2HD1      LEU 122  11.746 -10.865  -5.426
  740   3HD1  LEU 122          3HD1      LEU 122  11.275 -11.354  -7.083
  741   1HD2  LEU 122          1HD2      LEU 122  10.249 -12.513  -4.520
  742   2HD2  LEU 122          2HD2      LEU 122   8.534 -12.523  -4.995
  743   3HD2  LEU 122          3HD2      LEU 122   9.791 -13.006  -6.152
  744    H    LYS 123           H        LYS 123   6.954  -8.373  -5.799
  745    HA   LYS 123           HA       LYS 123   7.130  -8.366  -8.620
  746   1HB   LYS 123          1HB       LYS 123   4.973  -7.448  -6.672
  747   2HB   LYS 123          2HB       LYS 123   4.770  -7.256  -8.423
  748   1HG   LYS 123          1HG       LYS 123   5.237  -9.652  -8.774
  749   2HG   LYS 123          2HG       LYS 123   5.388  -9.902  -7.030
  750   1HD   LYS 123          1HD       LYS 123   3.047  -9.410  -6.678
  751   2HD   LYS 123          2HD       LYS 123   2.860  -8.822  -8.349
  752   1HE   LYS 123          1HE       LYS 123   3.425 -11.057  -9.227
  753   2HE   LYS 123          2HE       LYS 123   3.623 -11.678  -7.584
  754   1HZ   LYS 123          1HZ       LYS 123   1.058 -10.545  -8.561
  755   2HZ   LYS 123          2HZ       LYS 123   1.416 -12.138  -8.625
  756   3HZ   LYS 123          3HZ       LYS 123   1.307 -11.416  -7.180
  757    H    VAL 124           H        VAL 124   7.043  -5.612  -6.324
  758    HA   VAL 124           HA       VAL 124   6.961  -3.495  -8.233
  759    HB   VAL 124           HB       VAL 124   8.036  -3.780  -5.433
  760   1HG1  VAL 124          1HG1      VAL 124   8.264  -1.234  -7.075
  761   2HG1  VAL 124          2HG1      VAL 124   8.367  -1.324  -5.302
  762   3HG1  VAL 124          3HG1      VAL 124   9.593  -2.121  -6.286
  763   1HG2  VAL 124          1HG2      VAL 124   6.051  -1.825  -6.463
  764   2HG2  VAL 124          2HG2      VAL 124   5.554  -3.525  -6.273
  765   3HG2  VAL 124          3HG2      VAL 124   6.121  -2.665  -4.866
  766    H    HIS 125           H        HIS 125   9.752  -5.337  -6.880
  767    HA   HIS 125           HA       HIS 125  11.753  -3.778  -8.173
  768   1HB   HIS 125          1HB       HIS 125  12.287  -5.150  -6.294
  769   2HB   HIS 125          2HB       HIS 125  11.718  -6.618  -7.084
  770    HD1  HIS 125           HD1      HIS 125  14.640  -4.114  -7.370
  771    HD2  HIS 125           HD2      HIS 125  13.344  -7.930  -8.606
  772    HE1  HIS 125           HE1      HIS 125  16.656  -5.237  -8.441
  773    H    GLN 126           H        GLN 126  10.137  -6.871  -9.124
  774    HA   GLN 126           HA       GLN 126  11.720  -7.307 -11.460
  775   1HB   GLN 126          1HB       GLN 126   8.950  -8.297 -10.658
  776   2HB   GLN 126          2HB       GLN 126   9.773  -8.771 -12.177
  777   1HG   GLN 126          1HG       GLN 126  11.808  -9.373 -10.818
  778   2HG   GLN 126          2HG       GLN 126  10.920  -9.073  -9.332
  779   1HE2  GLN 126          1HE2      GLN 126  12.257 -11.390  -9.840
  780   2HE2  GLN 126          2HE2      GLN 126  11.074 -12.713 -10.033
  781    H    PHE 127           H        PHE 127   8.789  -5.367 -10.941
  782    HA   PHE 127           HA       PHE 127   8.053  -4.883 -13.626
  783   1HB   PHE 127          1HB       PHE 127   6.580  -3.646 -12.676
  784   2HB   PHE 127          2HB       PHE 127   7.278  -3.984 -11.146
  785    HD1  PHE 127           HD1      PHE 127   8.003  -1.369 -13.906
  786    HD2  PHE 127           HD2      PHE 127   7.142  -2.241  -9.794
  787    HE1  PHE 127           HE1      PHE 127   8.337   0.983 -13.347
  788    HE2  PHE 127           HE2      PHE 127   7.565   0.014  -9.132
  789    HZ   PHE 127           HZ       PHE 127   8.265   1.727 -10.932
  790    H    SER 128           H        SER 128  10.830  -3.702 -11.778
  791    HA   SER 128           HA       SER 128  11.556  -1.539 -13.580
  792   1HB   SER 128          1HB       SER 128  12.344  -1.873 -11.184
  793   2HB   SER 128          2HB       SER 128  13.416  -3.154 -11.790
  794    HG   SER 128           HG       SER 128  13.433  -0.378 -12.418
  795    H    HIS 129           H        HIS 129  12.607  -5.006 -13.277
  796    HA   HIS 129           HA       HIS 129  14.481  -4.939 -15.467
  797   1HB   HIS 129          1HB       HIS 129  12.857  -7.250 -14.319
  798   2HB   HIS 129          2HB       HIS 129  14.137  -7.386 -15.501
  799    HD1  HIS 129           HD1      HIS 129  16.707  -6.791 -14.575
  800    HD2  HIS 129           HD2      HIS 129  13.598  -7.918 -12.014
  801    HE1  HIS 129           HE1      HIS 129  17.791  -7.810 -12.484
  802    H    THR 130           H        THR 130  10.978  -5.614 -15.276
  803    HA   THR 130           HA       THR 130  10.767  -6.354 -18.109
  804    HB   THR 130           HB       THR 130   8.329  -6.351 -17.661
  805    HG1  THR 130           HG1      THR 130   9.125  -5.244 -15.226
  806   1HG2  THR 130          1HG2      THR 130   9.621  -7.661 -15.201
  807   2HG2  THR 130          2HG2      THR 130   8.176  -8.138 -16.087
  808   3HG2  THR 130          3HG2      THR 130   9.780  -8.349 -16.831
  809    H    GLN 131           H        GLN 131  10.762  -3.416 -16.283
  810    HA   GLN 131           HA       GLN 131  10.335  -1.228 -16.751
  811   1HB   GLN 131          1HB       GLN 131  11.855  -2.041 -18.829
  812   2HB   GLN 131          2HB       GLN 131  10.389  -1.665 -19.733
  813   1HG   GLN 131          1HG       GLN 131  11.214   0.470 -19.694
  814   2HG   GLN 131          2HG       GLN 131  10.518   0.551 -18.075
  815   1HE2  GLN 131          1HE2      GLN 131  12.431  -0.837 -16.435
  816   2HE2  GLN 131          2HE2      GLN 131  13.944   0.014 -16.620
  817    H    GLN 132           H        GLN 132   8.038  -3.127 -16.563
  818    HA   GLN 132           HA       GLN 132   6.047  -1.205 -17.724
  819   1HB   GLN 132          1HB       GLN 132   4.444  -2.993 -18.064
  820   2HB   GLN 132          2HB       GLN 132   5.876  -3.180 -19.064
  821   1HG   GLN 132          1HG       GLN 132   5.203  -5.352 -18.415
  822   2HG   GLN 132          2HG       GLN 132   6.673  -4.965 -17.543
  823   1HE2  GLN 132          1HE2      GLN 132   6.630  -5.348 -15.379
  824   2HE2  GLN 132          2HE2      GLN 132   5.162  -5.500 -14.397
  825    H    LEU 133           H        LEU 133   4.053  -1.050 -16.447
  826    HA   LEU 133           HA       LEU 133   4.826  -1.109 -13.607
  827   1HB   LEU 133          1HB       LEU 133   2.793   0.447 -15.211
  828   2HB   LEU 133          2HB       LEU 133   2.753   0.496 -13.442
  829    HG   LEU 133           HG       LEU 133   5.361   1.046 -15.009
  830   1HD1  LEU 133          1HD1      LEU 133   4.890   3.434 -14.747
  831   2HD1  LEU 133          2HD1      LEU 133   3.635   2.676 -15.739
  832   3HD1  LEU 133          3HD1      LEU 133   3.301   3.076 -14.038
  833   1HD2  LEU 133          1HD2      LEU 133   5.551   0.500 -12.590
  834   2HD2  LEU 133          2HD2      LEU 133   6.097   2.122 -13.035
  835   3HD2  LEU 133          3HD2      LEU 133   4.525   1.916 -12.256
  836    HA   PRO 134           HA       PRO 134   2.178  -4.536 -12.912
  837   1HB   PRO 134          1HB       PRO 134   2.352  -4.454 -10.089
  838   2HB   PRO 134          2HB       PRO 134   3.487  -5.273 -11.202
  839   1HG   PRO 134          1HG       PRO 134   3.881  -2.842  -9.600
  840   2HG   PRO 134          2HG       PRO 134   5.073  -3.818 -10.469
  841   1HD   PRO 134          1HD       PRO 134   3.980  -1.275 -11.231
  842   2HD   PRO 134          2HD       PRO 134   5.089  -2.320 -12.117
  843    H    TYR 135           H        TYR 135   1.554  -1.587 -10.981
  844    HA   TYR 135           HA       TYR 135  -1.094  -2.620 -10.175
  845   1HB   TYR 135          1HB       TYR 135   0.393  -0.084  -9.334
  846   2HB   TYR 135          2HB       TYR 135  -1.067  -0.707  -8.606
  847    HD1  TYR 135           HD1      TYR 135   2.577  -0.998  -8.693
  848    HD2  TYR 135           HD2      TYR 135  -1.089  -2.906  -7.439
  849    HE1  TYR 135           HE1      TYR 135   3.886  -2.488  -7.176
  850    HE2  TYR 135           HE2      TYR 135   0.247  -4.504  -6.032
  851    HH   TYR 135           HH       TYR 135   2.313  -5.144  -5.341
  852    H    GLU 136           H        GLU 136  -2.426  -2.425 -11.967
  853    HA   GLU 136           HA       GLU 136  -2.561   0.219 -13.346
  854   1HB   GLU 136          1HB       GLU 136  -2.369  -1.702 -14.815
  855   2HB   GLU 136          2HB       GLU 136  -3.682  -2.545 -13.997
  856   1HG   GLU 136          1HG       GLU 136  -5.318  -0.945 -14.846
  857   2HG   GLU 136          2HG       GLU 136  -4.043   0.036 -15.572
  858    H    CYS 137           H        CYS 137  -4.392   1.502 -13.294
  859    HA   CYS 137           HA       CYS 137  -6.392   1.047 -11.213
  860   1HB   CYS 137          1HB       CYS 137  -5.649   3.302 -11.707
  861   2HB   CYS 137          2HB       CYS 137  -6.107   3.145 -13.392
  862    HA   PRO 138           HA       PRO 138  -8.847  -1.343 -14.091
  863   1HB   PRO 138          1HB       PRO 138 -10.453  -2.627 -12.327
  864   2HB   PRO 138          2HB       PRO 138  -8.680  -2.868 -12.293
  865   1HG   PRO 138          1HG       PRO 138 -10.331  -0.962 -10.583
  866   2HG   PRO 138          2HG       PRO 138  -9.121  -2.162 -10.031
  867   1HD   PRO 138          1HD       PRO 138  -8.528   0.507 -10.465
  868   2HD   PRO 138          2HD       PRO 138  -7.340  -0.814 -10.692
  869    H    HIS 139           H        HIS 139  -9.804   1.531 -12.731
  870    HA   HIS 139           HA       HIS 139 -12.669   1.375 -12.689
  871   1HB   HIS 139          1HB       HIS 139 -11.250   3.165 -11.623
  872   2HB   HIS 139          2HB       HIS 139 -10.942   3.826 -13.234
  873    HD2  HIS 139           HD2      HIS 139 -12.737   5.488 -14.165
  874    HE1  HIS 139           HE1      HIS 139 -15.919   4.724 -11.429
  875    HE2  HIS 139           HE2      HIS 139 -15.156   6.177 -13.380
  876    H    GLU 140           H        GLU 140 -14.244   2.035 -14.184
  877    HA   GLU 140           HA       GLU 140 -13.723   1.385 -16.938
  878   1HB   GLU 140          1HB       GLU 140 -16.088   2.776 -15.595
  879   2HB   GLU 140          2HB       GLU 140 -16.053   2.261 -17.288
  880   1HG   GLU 140          1HG       GLU 140 -15.668  -0.088 -16.563
  881   2HG   GLU 140          2HG       GLU 140 -15.771   0.418 -14.876
  882    H    GLY 141           H        GLY 141 -12.725   2.597 -18.435
  883   1HA   GLY 141          1HA       GLY 141 -12.570   4.511 -19.838
  884   2HA   GLY 141          2HA       GLY 141 -13.325   5.502 -18.576
  885    H    CYS 142           H        CYS 142 -10.985   3.647 -17.046
  886    HA   CYS 142           HA       CYS 142  -8.935   5.814 -17.311
  887   1HB   CYS 142          1HB       CYS 142 -10.146   5.326 -15.063
  888   2HB   CYS 142          2HB       CYS 142  -9.194   3.851 -15.007
  889    H    ASP 143           H        ASP 143  -6.694   5.193 -17.315
  890    HA   ASP 143           HA       ASP 143  -6.068   2.332 -17.843
  891   1HB   ASP 143          1HB       ASP 143  -5.075   2.722 -19.945
  892   2HB   ASP 143          2HB       ASP 143  -6.638   3.507 -20.039
  893    H    LYS 144           H        LYS 144  -5.448   4.764 -15.891
  894    HA   LYS 144           HA       LYS 144  -2.615   5.277 -16.095
  895   1HB   LYS 144          1HB       LYS 144  -4.471   5.329 -13.681
  896   2HB   LYS 144          2HB       LYS 144  -2.853   6.013 -13.722
  897   1HG   LYS 144          1HG       LYS 144  -4.916   7.013 -15.700
  898   2HG   LYS 144          2HG       LYS 144  -4.996   7.514 -14.011
  899   1HD   LYS 144          1HD       LYS 144  -2.765   8.471 -14.093
  900   2HD   LYS 144          2HD       LYS 144  -2.519   7.844 -15.731
  901   1HE   LYS 144          1HE       LYS 144  -3.029  10.201 -15.854
  902   2HE   LYS 144          2HE       LYS 144  -4.333   9.275 -16.589
  903   1HZ   LYS 144          1HZ       LYS 144  -4.466  10.367 -13.810
  904   2HZ   LYS 144          2HZ       LYS 144  -5.074  11.119 -15.127
  905   3HZ   LYS 144          3HZ       LYS 144  -5.685   9.666 -14.656
  906    H    ARG 145           H        ARG 145  -0.851   4.318 -15.067
  907    HA   ARG 145           HA       ARG 145  -1.361   1.886 -13.398
  908   1HB   ARG 145          1HB       ARG 145   0.885   2.004 -15.446
  909   2HB   ARG 145          2HB       ARG 145   0.316   0.645 -14.429
  910   1HG   ARG 145          1HG       ARG 145  -1.779   0.550 -15.684
  911   2HG   ARG 145          2HG       ARG 145  -1.212   1.834 -16.770
  912   1HD   ARG 145          1HD       ARG 145   0.605   0.476 -17.568
  913   2HD   ARG 145          2HD       ARG 145   0.302  -0.771 -16.341
  914    HE   ARG 145           HE       ARG 145  -2.089  -0.769 -17.586
  915   1HH1  ARG 145          1HH1      ARG 145   1.075  -0.946 -19.125
  916   2HH1  ARG 145          2HH1      ARG 145   0.432  -1.902 -20.434
  917   1HH2  ARG 145          1HH2      ARG 145  -2.771  -1.916 -19.106
  918   2HH2  ARG 145          2HH2      ARG 145  -1.759  -2.453 -20.455
  919    H    PHE 146           H        PHE 146   0.223   1.431 -11.860
  920    HA   PHE 146           HA       PHE 146   2.007   3.752 -11.235
  921   1HB   PHE 146          1HB       PHE 146   0.205   2.252  -9.269
  922   2HB   PHE 146          2HB       PHE 146   1.234   3.619  -8.934
  923    HD1  PHE 146           HD1      PHE 146   0.733   5.886  -9.797
  924    HD2  PHE 146           HD2      PHE 146  -1.913   2.555 -10.543
  925    HE1  PHE 146           HE1      PHE 146  -1.015   7.442 -10.638
  926    HE2  PHE 146           HE2      PHE 146  -3.657   4.094 -11.302
  927    HZ   PHE 146           HZ       PHE 146  -3.175   6.551 -11.446
  928    H    SER 147           H        SER 147   3.633   3.334  -9.613
  929    HA   SER 147           HA       SER 147   4.961   0.792 -10.204
  930   1HB   SER 147          1HB       SER 147   6.802   1.912  -8.780
  931   2HB   SER 147          2HB       SER 147   6.311   2.773 -10.255
  932    HG   SER 147           HG       SER 147   6.458   4.160  -8.426
  933    H    LEU 148           H        LEU 148   3.075   2.149  -7.570
  934    HA   LEU 148           HA       LEU 148   3.620  -0.309  -5.974
  935   1HB   LEU 148          1HB       LEU 148   3.920   2.576  -5.119
  936   2HB   LEU 148          2HB       LEU 148   3.390   1.401  -3.930
  937    HG   LEU 148           HG       LEU 148   5.960   1.082  -5.534
  938   1HD1  LEU 148          1HD1      LEU 148   6.117   3.061  -4.086
  939   2HD1  LEU 148          2HD1      LEU 148   5.550   2.110  -2.696
  940   3HD1  LEU 148          3HD1      LEU 148   7.115   1.736  -3.455
  941   1HD2  LEU 148          1HD2      LEU 148   6.511  -0.627  -3.857
  942   2HD2  LEU 148          2HD2      LEU 148   5.024  -0.288  -2.966
  943   3HD2  LEU 148          3HD2      LEU 148   4.929  -1.006  -4.589
  944    HA   PRO 149           HA       PRO 149  -0.749  -0.509  -5.543
  945   1HB   PRO 149          1HB       PRO 149  -1.022  -1.644  -3.014
  946   2HB   PRO 149          2HB       PRO 149  -0.529  -2.525  -4.475
  947   1HG   PRO 149          1HG       PRO 149   1.210  -1.476  -2.252
  948   2HG   PRO 149          2HG       PRO 149   1.330  -3.024  -3.164
  949   1HD   PRO 149          1HD       PRO 149   2.933  -0.874  -3.729
  950   2HD   PRO 149          2HD       PRO 149   2.405  -2.010  -4.921
  951    H    SER 150           H        SER 150   1.083   1.000  -2.896
  952    HA   SER 150           HA       SER 150  -1.084   2.373  -1.625
  953   1HB   SER 150          1HB       SER 150   0.728   3.863  -0.747
  954   2HB   SER 150          2HB       SER 150   1.113   2.138  -0.567
  955    HG   SER 150           HG       SER 150   2.886   3.230  -1.433
  956    H    ARG 151           H        ARG 151   0.992   3.174  -4.428
  957    HA   ARG 151           HA       ARG 151   0.019   5.918  -4.666
  958   1HB   ARG 151          1HB       ARG 151   2.188   4.530  -5.667
  959   2HB   ARG 151          2HB       ARG 151   1.156   4.610  -7.079
  960   1HG   ARG 151          1HG       ARG 151   2.148   6.948  -5.398
  961   2HG   ARG 151          2HG       ARG 151   2.753   6.454  -6.967
  962   1HD   ARG 151          1HD       ARG 151   1.434   8.037  -7.830
  963   2HD   ARG 151          2HD       ARG 151   0.128   6.888  -7.617
  964    HE   ARG 151           HE       ARG 151  -0.807   8.333  -6.081
  965   1HH1  ARG 151          1HH1      ARG 151   2.633   9.191  -6.146
  966   2HH1  ARG 151          2HH1      ARG 151   2.346  10.509  -5.014
  967   1HH2  ARG 151          1HH2      ARG 151  -0.997  10.312  -4.879
  968   2HH2  ARG 151          2HH2      ARG 151   0.523  11.041  -4.372
  969    H    LEU 152           H        LEU 152  -0.804   2.753  -6.128
  970    HA   LEU 152           HA       LEU 152  -2.784   3.749  -7.987
  971   1HB   LEU 152          1HB       LEU 152  -1.879   1.519  -8.227
  972   2HB   LEU 152          2HB       LEU 152  -2.333   1.105  -6.570
  973    HG   LEU 152           HG       LEU 152  -4.683   1.066  -7.121
  974   1HD1  LEU 152          1HD1      LEU 152  -4.698   2.846  -8.922
  975   2HD1  LEU 152          2HD1      LEU 152  -3.920   1.678 -10.003
  976   3HD1  LEU 152          3HD1      LEU 152  -5.543   1.364  -9.341
  977   1HD2  LEU 152          1HD2      LEU 152  -3.221  -0.962  -7.562
  978   2HD2  LEU 152          2HD2      LEU 152  -4.714  -0.890  -8.526
  979   3HD2  LEU 152          3HD2      LEU 152  -3.164  -0.460  -9.262
  980    H    LYS 153           H        LYS 153  -2.939   2.490  -4.593
  981    HA   LYS 153           HA       LYS 153  -5.741   2.738  -4.283
  982   1HB   LYS 153          1HB       LYS 153  -4.201   1.521  -2.732
  983   2HB   LYS 153          2HB       LYS 153  -3.599   3.064  -2.127
  984   1HG   LYS 153          1HG       LYS 153  -5.269   2.078  -0.615
  985   2HG   LYS 153          2HG       LYS 153  -5.840   3.619  -1.249
  986   1HD   LYS 153          1HD       LYS 153  -7.277   2.409  -2.893
  987   2HD   LYS 153          2HD       LYS 153  -6.675   0.859  -2.268
  988   1HE   LYS 153          1HE       LYS 153  -7.659   1.419  -0.049
  989   2HE   LYS 153          2HE       LYS 153  -8.202   2.977  -0.690
  990   1HZ   LYS 153          1HZ       LYS 153  -9.115   0.314  -1.628
  991   2HZ   LYS 153          2HZ       LYS 153 -10.011   1.404  -0.808
  992   3HZ   LYS 153          3HZ       LYS 153  -9.538   1.713  -2.350
  993    H    ARG 154           H        ARG 154  -3.140   5.156  -3.727
  994    HA   ARG 154           HA       ARG 154  -4.935   7.235  -2.773
  995   1HB   ARG 154          1HB       ARG 154  -2.098   7.289  -3.919
  996   2HB   ARG 154          2HB       ARG 154  -2.995   8.746  -3.458
  997   1HG   ARG 154          1HG       ARG 154  -3.443   7.555  -1.195
  998   2HG   ARG 154          2HG       ARG 154  -2.130   6.495  -1.624
  999   1HD   ARG 154          1HD       ARG 154  -2.107   9.479  -1.112
 1000   2HD   ARG 154          2HD       ARG 154  -1.313   8.231  -0.184
 1001    HE   ARG 154           HE       ARG 154  -0.056   9.773  -1.961
 1002   1HH1  ARG 154          1HH1      ARG 154  -0.313   6.265  -1.971
 1003   2HH1  ARG 154          2HH1      ARG 154   1.363   6.106  -2.434
 1004   1HH2  ARG 154          1HH2      ARG 154   1.889   9.496  -2.730
 1005   2HH2  ARG 154          2HH2      ARG 154   2.560   7.894  -2.927
 1006    H    HIS 155           H        HIS 155  -3.800   6.200  -5.999
 1007    HA   HIS 155           HA       HIS 155  -4.981   8.371  -7.479
 1008   1HB   HIS 155          1HB       HIS 155  -3.386   6.943  -8.571
 1009   2HB   HIS 155          2HB       HIS 155  -4.336   5.490  -8.271
 1010    HD1  HIS 155           HD1      HIS 155  -4.548   8.701 -10.340
 1011    HD2  HIS 155           HD2      HIS 155  -6.381   4.940  -9.901
 1012    HE1  HIS 155           HE1      HIS 155  -6.423   8.643 -12.050
 1013    H    GLU 156           H        GLU 156  -6.255   5.207  -6.312
 1014    HA   GLU 156           HA       GLU 156  -8.753   5.252  -7.562
 1015   1HB   GLU 156          1HB       GLU 156  -7.601   3.503  -5.949
 1016   2HB   GLU 156          2HB       GLU 156  -8.493   4.356  -4.678
 1017   1HG   GLU 156          1HG       GLU 156 -10.609   3.942  -5.959
 1018   2HG   GLU 156          2HG       GLU 156  -9.656   3.080  -7.180
 1019    H    LYS 157           H        LYS 157  -7.632   7.160  -4.774
 1020    HA   LYS 157           HA       LYS 157 -10.185   8.048  -3.793
 1021   1HB   LYS 157          1HB       LYS 157  -7.540   9.560  -3.777
 1022   2HB   LYS 157          2HB       LYS 157  -8.931   9.903  -2.797
 1023   1HG   LYS 157          1HG       LYS 157  -7.203   7.409  -2.619
 1024   2HG   LYS 157          2HG       LYS 157  -7.233   8.743  -1.484
 1025   1HD   LYS 157          1HD       LYS 157  -9.457   6.732  -2.021
 1026   2HD   LYS 157          2HD       LYS 157  -8.448   6.817  -0.590
 1027   1HE   LYS 157          1HE       LYS 157 -10.441   8.967  -1.457
 1028   2HE   LYS 157          2HE       LYS 157 -10.756   7.711  -0.259
 1029   1HZ   LYS 157          1HZ       LYS 157  -8.671   9.811   0.007
 1030   2HZ   LYS 157          2HZ       LYS 157 -10.087   9.765   0.814
 1031   3HZ   LYS 157          3HZ       LYS 157  -8.956   8.628   1.100
 1032    H    VAL 158           H        VAL 158  -8.259   8.944  -6.626
 1033    HA   VAL 158           HA       VAL 158  -9.445  11.473  -7.188
 1034    HB   VAL 158           HB       VAL 158  -8.493   9.404  -9.237
 1035   1HG1  VAL 158          1HG1      VAL 158  -7.996  11.366 -10.613
 1036   2HG1  VAL 158          2HG1      VAL 158  -9.720  11.338 -10.214
 1037   3HG1  VAL 158          3HG1      VAL 158  -8.603  12.438  -9.339
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.354  10.667  -9.226
 1039   2HG2  VAL 158          2HG2      VAL 158  -7.052  11.737  -7.980
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.650  10.062  -7.569
 1041    H    HIS 159           H        HIS 159 -10.439   8.137  -8.017
 1042    HA   HIS 159           HA       HIS 159 -12.794   9.002  -9.511
 1043   1HB   HIS 159          1HB       HIS 159 -11.852   6.294  -8.461
 1044   2HB   HIS 159          2HB       HIS 159 -13.337   6.525  -9.410
 1045    HD1  HIS 159           HD1      HIS 159 -12.625   8.138 -11.833
 1046    HD2  HIS 159           HD2      HIS 159  -9.808   5.671  -9.922
 1047    HE1  HIS 159           HE1      HIS 159 -10.730   7.760 -13.505
 1048    H    ALA 160           H        ALA 160 -12.065   7.998  -6.164
 1049    HA   ALA 160           HA       ALA 160 -14.826   7.719  -5.326
 1050   1HB   ALA 160          1HB       ALA 160 -12.844   6.710  -4.137
 1051   2HB   ALA 160          2HB       ALA 160 -12.368   8.351  -3.632
 1052   3HB   ALA 160          3HB       ALA 160 -13.901   7.663  -3.072
 1053    H    GLY 161           H        GLY 161 -12.560  10.446  -5.610
 1054   1HA   GLY 161          1HA       GLY 161 -13.278  12.704  -5.846
 1055   2HA   GLY 161          2HA       GLY 161 -14.792  12.312  -5.034
 1056    H    TYR 162           H        TYR 162 -13.557  14.578  -4.285
 1057    HA   TYR 162           HA       TYR 162 -12.365  13.900  -1.613
 1058   1HB   TYR 162          1HB       TYR 162 -11.701  16.305  -3.362
 1059   2HB   TYR 162          2HB       TYR 162 -11.010  15.950  -1.772
 1060    HD1  TYR 162           HD1      TYR 162 -11.334  14.818  -5.276
 1061    HD2  TYR 162           HD2      TYR 162  -9.095  14.355  -1.626
 1062    HE1  TYR 162           HE1      TYR 162  -9.899  13.196  -6.388
 1063    HE2  TYR 162           HE2      TYR 162  -7.465  12.890  -2.840
 1064    HH   TYR 162           HH       TYR 162  -6.852  12.023  -4.968
 1065    HA   PRO 163           HA       PRO 163 -16.239  16.127  -1.016
 1066   1HB   PRO 163          1HB       PRO 163 -17.091  14.883   1.266
 1067   2HB   PRO 163          2HB       PRO 163 -17.099  14.061  -0.324
 1068   1HG   PRO 163          1HG       PRO 163 -15.004  13.849   1.855
 1069   2HG   PRO 163          2HG       PRO 163 -15.805  12.524   0.954
 1070   1HD   PRO 163          1HD       PRO 163 -13.352  13.529   0.254
 1071   2HD   PRO 163          2HD       PRO 163 -14.519  12.922  -0.966
 1072    H    CYS 164           H        CYS 164 -16.841  17.899   0.179
 1073    HA   CYS 164           HA       CYS 164 -14.840  19.160   1.858
 1074   1HB   CYS 164          1HB       CYS 164 -16.618  20.253   0.295
 1075   2HB   CYS 164          2HB       CYS 164 -17.742  20.019   1.655
 1076    H    LYS 165           H        LYS 165 -14.800  19.504   4.022
 1077    HA   LYS 165           HA       LYS 165 -17.055  18.568   5.699
 1078   1HB   LYS 165          1HB       LYS 165 -15.129  16.770   5.423
 1079   2HB   LYS 165          2HB       LYS 165 -14.232  17.808   6.530
 1080   1HG   LYS 165          1HG       LYS 165 -16.088  17.538   8.209
 1081   2HG   LYS 165          2HG       LYS 165 -16.978  16.545   7.038
 1082   1HD   LYS 165          1HD       LYS 165 -15.126  14.890   7.045
 1083   2HD   LYS 165          2HD       LYS 165 -14.232  15.894   8.209
 1084   1HE   LYS 165          1HE       LYS 165 -16.106  15.671   9.830
 1085   2HE   LYS 165          2HE       LYS 165 -16.993  14.670   8.671
 1086   1HZ   LYS 165          1HZ       LYS 165 -15.803  13.304  10.284
 1087   2HZ   LYS 165          2HZ       LYS 165 -15.182  13.040   8.798
 1088   3HZ   LYS 165          3HZ       LYS 165 -14.368  13.963   9.875
 1089    H    LYS 166           H        LYS 166 -15.371  21.079   4.727
 1090    HA   LYS 166           HA       LYS 166 -14.259  22.235   7.156
 1091   1HB   LYS 166          1HB       LYS 166 -15.246  23.457   4.569
 1092   2HB   LYS 166          2HB       LYS 166 -14.431  24.388   5.824
 1093   1HG   LYS 166          1HG       LYS 166 -13.162  22.000   4.412
 1094   2HG   LYS 166          2HG       LYS 166 -13.006  23.679   3.878
 1095   1HD   LYS 166          1HD       LYS 166 -11.876  24.344   5.875
 1096   2HD   LYS 166          2HD       LYS 166 -12.159  22.766   6.650
 1097   1HE   LYS 166          1HE       LYS 166 -10.821  21.657   4.886
 1098   2HE   LYS 166          2HE       LYS 166 -10.521  23.218   4.121
 1099   1HZ   LYS 166          1HZ       LYS 166  -8.674  22.563   5.555
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.363  23.918   6.158
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.647  22.468   6.861
 1102    H    ASP 167           H        ASP 167 -17.510  21.887   5.910
 1103    HA   ASP 167           HA       ASP 167 -18.559  23.188   8.347
 1104   1HB   ASP 167          1HB       ASP 167 -18.392  25.003   6.561
 1105   2HB   ASP 167          2HB       ASP 167 -19.540  24.077   5.596
 1106    H    ASP 168           H        ASP 168 -20.566  22.380   8.977
 1107    HA   ASP 168           HA       ASP 168 -21.198  19.758   8.097
 1108   1HB   ASP 168          1HB       ASP 168 -21.648  20.702  10.370
 1109   2HB   ASP 168          2HB       ASP 168 -22.931  21.699   9.688
 1110    H    SER 169           H        SER 169 -22.477  22.920   7.080
 1111    HA   SER 169           HA       SER 169 -24.709  21.631   5.587
 1112   1HB   SER 169          1HB       SER 169 -23.994  24.571   5.995
 1113   2HB   SER 169          2HB       SER 169 -25.450  23.966   5.189
 1114    HG   SER 169           HG       SER 169 -25.815  24.498   7.402
 1115    H    CYS 170           H        CYS 170 -21.699  21.519   4.851
 1116    HA   CYS 170           HA       CYS 170 -21.995  22.528   2.050
 1117   1HB   CYS 170          1HB       CYS 170 -20.137  23.527   3.478
 1118   2HB   CYS 170          2HB       CYS 170 -19.427  21.921   3.538
 1119    H    SER 171           H        SER 171 -21.932  21.012   0.442
 1120    HA   SER 171           HA       SER 171 -21.231  18.191   1.196
 1121   1HB   SER 171          1HB       SER 171 -23.627  19.125  -0.443
 1122   2HB   SER 171          2HB       SER 171 -23.210  17.443  -0.070
 1123    HG   SER 171           HG       SER 171 -24.815  18.280   1.345
 1124    H    PHE 172           H        PHE 172 -19.990  20.525  -0.542
 1125    HA   PHE 172           HA       PHE 172 -19.952  19.670  -3.267
 1126   1HB   PHE 172          1HB       PHE 172 -19.093  21.835  -2.764
 1127   2HB   PHE 172          2HB       PHE 172 -18.043  21.220  -1.500
 1128    HD1  PHE 172           HD1      PHE 172 -15.933  20.067  -1.975
 1129    HD2  PHE 172           HD2      PHE 172 -18.385  21.571  -5.174
 1130    HE1  PHE 172           HE1      PHE 172 -14.084  19.667  -3.575
 1131    HE2  PHE 172           HE2      PHE 172 -16.454  21.380  -6.737
 1132    HZ   PHE 172           HZ       PHE 172 -14.283  20.470  -5.921
 1133    H    VAL 173           H        VAL 173 -18.788  18.151  -4.372
 1134    HA   VAL 173           HA       VAL 173 -16.577  16.754  -2.931
 1135    HB   VAL 173           HB       VAL 173 -18.583  15.431  -4.801
 1136   1HG1  VAL 173          1HG1      VAL 173 -16.297  14.397  -4.922
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.273  14.268  -3.150
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.433  13.325  -4.105
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.278  15.390  -1.771
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.718  15.762  -2.728
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.134  14.099  -2.662
 1142    H    GLY 174           H        GLY 174 -14.701  17.087  -3.934
 1143   1HA   GLY 174          1HA       GLY 174 -14.714  18.135  -6.702
 1144   2HA   GLY 174          2HA       GLY 174 -13.312  17.988  -5.626
 1145    H    LYS 175           H        LYS 175 -14.005  17.136  -8.546
 1146    HA   LYS 175           HA       LYS 175 -13.728  14.282  -8.609
 1147   1HB   LYS 175          1HB       LYS 175 -12.976  16.380 -10.702
 1148   2HB   LYS 175          2HB       LYS 175 -13.072  14.642 -10.985
 1149   1HG   LYS 175          1HG       LYS 175 -15.478  14.655 -10.365
 1150   2HG   LYS 175          2HG       LYS 175 -15.407  16.413 -10.134
 1151   1HD   LYS 175          1HD       LYS 175 -14.738  16.707 -12.505
 1152   2HD   LYS 175          2HD       LYS 175 -14.825  14.947 -12.745
 1153   1HE   LYS 175          1HE       LYS 175 -17.230  14.982 -12.107
 1154   2HE   LYS 175          2HE       LYS 175 -17.142  16.731 -11.869
 1155   1HZ   LYS 175          1HZ       LYS 175 -16.675  15.341 -14.455
 1156   2HZ   LYS 175          2HZ       LYS 175 -18.018  16.182 -14.068
 1157   3HZ   LYS 175          3HZ       LYS 175 -16.593  16.958 -14.236
 1158    H    THR 176           H        THR 176 -11.422  16.792  -7.924
 1159    HA   THR 176           HA       THR 176  -9.297  14.742  -7.675
 1160    HB   THR 176           HB       THR 176  -7.742  16.734  -8.668
 1161    HG1  THR 176           HG1      THR 176  -8.925  18.050  -9.727
 1162   1HG2  THR 176          1HG2      THR 176  -7.598  14.378  -9.300
 1163   2HG2  THR 176          2HG2      THR 176  -9.059  14.544 -10.306
 1164   3HG2  THR 176          3HG2      THR 176  -7.598  15.420 -10.740
 1165    H    TRP 177           H        TRP 177  -7.466  15.478  -6.386
 1166    HA   TRP 177           HA       TRP 177  -8.308  16.693  -4.000
 1167   1HB   TRP 177          1HB       TRP 177  -6.416  15.233  -4.048
 1168   2HB   TRP 177          2HB       TRP 177  -5.578  16.225  -5.212
 1169    HD1  TRP 177           HD1      TRP 177  -3.580  17.110  -4.222
 1170    HE1  TRP 177           HE1      TRP 177  -2.833  18.313  -2.068
 1171    HE3  TRP 177           HE3      TRP 177  -7.830  16.457  -1.505
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.678  18.116   0.676
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.752  16.791   0.959
 1174    HH2  TRP 177           HH2      TRP 177  -5.674  17.556   2.058
 1175    H    THR 178           H        THR 178  -6.584  18.169  -6.801
 1176    HA   THR 178           HA       THR 178  -6.087  20.730  -5.696
 1177    HB   THR 178           HB       THR 178  -6.440  21.520  -8.126
 1178    HG1  THR 178           HG1      THR 178  -6.171  18.963  -9.041
 1179   1HG2  THR 178          1HG2      THR 178  -4.361  19.370  -7.699
 1180   2HG2  THR 178          2HG2      THR 178  -4.373  20.608  -8.965
 1181   3HG2  THR 178          3HG2      THR 178  -4.211  21.081  -7.263
 1182    H    LEU 179           H        LEU 179  -9.006  19.541  -7.456
 1183    HA   LEU 179           HA       LEU 179 -10.387  22.004  -7.476
 1184   1HB   LEU 179          1HB       LEU 179 -11.513  19.168  -7.414
 1185   2HB   LEU 179          2HB       LEU 179 -12.437  20.613  -7.795
 1186    HG   LEU 179           HG       LEU 179 -10.117  19.512  -9.398
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.839  19.068 -11.096
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.187  18.225  -9.585
 1189   3HD1  LEU 179          3HD1      LEU 179 -13.095  19.699 -10.006
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.772  21.214 -11.117
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.865  21.956  -9.927
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.103  21.945  -9.658
 1193    H    TYR 180           H        TYR 180 -10.172  19.529  -4.929
 1194    HA   TYR 180           HA       TYR 180 -12.287  20.672  -3.279
 1195   1HB   TYR 180          1HB       TYR 180 -11.834  18.443  -2.799
 1196   2HB   TYR 180          2HB       TYR 180 -10.086  18.640  -2.877
 1197    HD1  TYR 180           HD1      TYR 180  -8.872  18.747  -0.890
 1198    HD2  TYR 180           HD2      TYR 180 -13.030  19.898  -0.851
 1199    HE1  TYR 180           HE1      TYR 180  -8.748  19.099   1.568
 1200    HE2  TYR 180           HE2      TYR 180 -12.866  20.354   1.591
 1201    HH   TYR 180           HH       TYR 180  -9.876  19.694   3.456
 1202    H    LEU 181           H        LEU 181  -8.680  20.766  -3.202
 1203    HA   LEU 181           HA       LEU 181  -8.431  22.589  -1.056
 1204   1HB   LEU 181          1HB       LEU 181  -6.719  22.102  -3.531
 1205   2HB   LEU 181          2HB       LEU 181  -6.251  23.214  -2.278
 1206    HG   LEU 181           HG       LEU 181  -6.754  20.200  -1.927
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.235  21.851  -2.261
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.217  20.293  -1.435
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.731  20.359  -3.121
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.884  22.281   0.091
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.269  21.182   0.176
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.647  20.522   0.331
 1213    H    LYS 182           H        LYS 182  -8.824  23.248  -4.565
 1214    HA   LYS 182           HA       LYS 182  -8.679  26.122  -4.426
 1215   1HB   LYS 182          1HB       LYS 182  -8.521  24.698  -6.483
 1216   2HB   LYS 182          2HB       LYS 182 -10.248  24.396  -6.416
 1217   1HG   LYS 182          1HG       LYS 182  -9.123  27.226  -6.545
 1218   2HG   LYS 182          2HG       LYS 182  -9.243  26.218  -7.983
 1219   1HD   LYS 182          1HD       LYS 182 -11.708  25.976  -7.605
 1220   2HD   LYS 182          2HD       LYS 182 -11.589  27.147  -6.277
 1221   1HE   LYS 182          1HE       LYS 182 -10.606  28.815  -7.831
 1222   2HE   LYS 182          2HE       LYS 182 -10.736  27.651  -9.155
 1223   1HZ   LYS 182          1HZ       LYS 182 -13.176  27.665  -8.787
 1224   2HZ   LYS 182          2HZ       LYS 182 -13.019  28.824  -7.635
 1225   3HZ   LYS 182          3HZ       LYS 182 -12.620  29.148  -9.180
 1226    H    HIS 183           H        HIS 183 -11.441  23.821  -4.197
 1227    HA   HIS 183           HA       HIS 183 -13.515  25.771  -3.995
 1228   1HB   HIS 183          1HB       HIS 183 -14.146  23.518  -4.417
 1229   2HB   HIS 183          2HB       HIS 183 -13.223  22.888  -3.070
 1230    HD1  HIS 183           HD1      HIS 183 -16.596  24.630  -3.678
 1231    HD2  HIS 183           HD2      HIS 183 -14.255  22.936  -0.619
 1232    HE1  HIS 183           HE1      HIS 183 -18.093  24.488  -1.620
 1233    H    VAL 184           H        VAL 184 -11.421  24.235  -1.514
 1234    HA   VAL 184           HA       VAL 184 -12.732  25.314   0.783
 1235    HB   VAL 184           HB       VAL 184  -9.937  24.288   0.239
 1236   1HG1  VAL 184          1HG1      VAL 184 -10.901  25.352   2.917
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.405  24.420   2.610
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.578  26.041   1.938
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.419  23.408   1.762
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.604  22.617   0.394
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.814  22.603   1.948
 1242    H    ALA 185           H        ALA 185  -9.998  26.560  -1.171
 1243    HA   ALA 185           HA       ALA 185  -9.471  28.800   0.494
 1244   1HB   ALA 185          1HB       ALA 185  -9.003  28.461  -2.511
 1245   2HB   ALA 185          2HB       ALA 185  -8.226  29.668  -1.462
 1246   3HB   ALA 185          3HB       ALA 185  -7.899  27.938  -1.221
 1247    H    GLU 186           H        GLU 186 -11.909  28.273  -2.021
 1248    HA   GLU 186           HA       GLU 186 -12.566  31.145  -2.250
 1249   1HB   GLU 186          1HB       GLU 186 -12.556  29.542  -4.187
 1250   2HB   GLU 186          2HB       GLU 186 -13.947  28.715  -3.480
 1251   1HG   GLU 186          1HG       GLU 186 -15.252  30.848  -3.636
 1252   2HG   GLU 186          2HG       GLU 186 -13.852  31.633  -4.376
 1253    H    CYS 187           H        CYS 187 -14.091  28.132  -1.005
 1254    HA   CYS 187           HA       CYS 187 -16.519  29.639  -0.223
 1255   1HB   CYS 187          1HB       CYS 187 -15.852  26.660  -0.250
 1256   2HB   CYS 187          2HB       CYS 187 -17.415  27.326   0.241
 1257    HG   CYS 187           HG       CYS 187 -17.904  28.653  -1.977
 1258    H    HIS 188           H        HIS 188 -13.645  28.427   1.330
 1259    HA   HIS 188           HA       HIS 188 -14.874  28.996   3.999
 1260   1HB   HIS 188          1HB       HIS 188 -12.992  26.661   3.425
 1261   2HB   HIS 188          2HB       HIS 188 -13.718  27.076   4.987
 1262    HD1  HIS 188           HD1      HIS 188 -16.565  26.865   4.986
 1263    HD2  HIS 188           HD2      HIS 188 -14.346  25.098   1.876
 1264    HE1  HIS 188           HE1      HIS 188 -18.130  25.191   3.850
 1265    H    GLN 189           H        GLN 189 -13.362  30.774   2.361
 1266    HA   GLN 189           HA       GLN 189 -10.571  30.821   2.919
 1267   1HB   GLN 189          1HB       GLN 189 -12.022  32.207   1.245
 1268   2HB   GLN 189          2HB       GLN 189 -12.260  33.329   2.578
 1269   1HG   GLN 189          1HG       GLN 189  -9.859  33.737   2.744
 1270   2HG   GLN 189          2HG       GLN 189  -9.509  32.427   1.609
 1271   1HE2  GLN 189          1HE2      GLN 189 -10.527  32.675  -0.635
 1272   2HE2  GLN 189          2HE2      GLN 189 -10.518  34.316  -1.304
 1273    H    ASP 190           H        ASP 190 -13.358  31.854   4.854
 1274    HA   ASP 190           HA       ASP 190 -11.583  32.287   7.183
 1275   1HB   ASP 190          1HB       ASP 190 -11.781  34.530   6.085
 1276   2HB   ASP 190          2HB       ASP 190 -13.535  34.431   6.215
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  -8.553  30.179 -13.464
    2   2H5*    G   1          2H5*        G   1  -9.413  28.697 -13.006
    3    H4*    G   1           H4*        G   1  -8.926  28.562 -15.338
    4    H3*    G   1           H3*        G   1  -7.031  26.818 -13.744
    5    H2*    G   1           H2*        G   1  -6.364  25.903 -15.888
    6   2HO*    G   1          2HO*        G   1  -8.614  26.219 -16.847
    7    H1*    G   1           H1*        G   1  -5.945  28.347 -16.952
    8    H8     G   1           H8         G   1  -5.214  29.042 -13.328
    9    H1     G   1           H1         G   1  -0.461  25.959 -16.369
   10   1H2     G   1          1H2         G   1  -1.186  25.076 -18.206
   11   2H2     G   1          2H2         G   1  -2.809  25.381 -18.798
   12   1H5*    G   2          1H5*        G   2  -8.709  24.255 -16.465
   13   2H5*    G   2          2H5*        G   2  -9.180  22.709 -15.758
   14    H4*    G   2           H4*        G   2  -7.742  22.397 -17.695
   15    H3*    G   2           H3*        G   2  -6.382  21.646 -15.096
   16    H2*    G   2           H2*        G   2  -4.660  20.669 -16.531
   17   2HO*    G   2          2HO*        G   2  -6.359  20.153 -18.289
   18    H1*    G   2           H1*        G   2  -4.432  22.920 -18.000
   19    H8     G   2           H8         G   2  -5.441  24.322 -14.645
   20    H1     G   2           H1         G   2   0.646  22.264 -14.782
   21   1H2     G   2          1H2         G   2   0.956  20.962 -16.471
   22   2H2     G   2          2H2         G   2  -0.281  20.699 -17.685
   23   1H5*    G   3          1H5*        G   3  -6.070  18.373 -17.606
   24   2H5*    G   3          2H5*        G   3  -6.550  16.858 -16.841
   25    H4*    G   3           H4*        G   3  -4.330  16.642 -17.914
   26    H3*    G   3           H3*        G   3  -4.493  16.495 -14.876
   27    H2*    G   3           H2*        G   3  -2.120  16.056 -14.876
   28   2HO*    G   3          2HO*        G   3  -2.477  14.741 -16.995
   29    H1*    G   3           H1*        G   3  -1.443  17.852 -16.834
   30    H8     G   3           H8         G   3  -4.036  19.646 -14.731
   31    H1     G   3           H1         G   3   1.813  19.496 -12.060
   32   1H2     G   3          1H2         G   3   2.960  17.877 -12.894
   33   2H2     G   3          2H2         G   3   2.403  16.959 -14.279
   34   1H5*    C   4          1H5*        C   4  -2.078  13.196 -15.537
   35   2H5*    C   4          2H5*        C   4  -2.678  11.794 -14.650
   36    H4*    C   4           H4*        C   4  -0.443  12.203 -13.936
   37    H3*    C   4           H3*        C   4  -2.398  13.165 -11.822
   38    H2*    C   4           H2*        C   4  -0.490  13.455 -10.427
   39   2HO*    C   4          2HO*        C   4   0.494  11.368 -11.290
   40    H1*    C   4           H1*        C   4   1.158  14.378 -12.490
   41   1H4     C   4          1H4         C   4  -0.873  19.295  -8.975
   42   2H4     C   4          2H4         C   4  -2.373  19.348  -9.870
   43    H5     C   4           H5         C   4  -2.898  17.825 -11.638
   44    H6     C   4           H6         C   4  -2.191  15.774 -12.765
   45   1H5*    C   5          1H5*        C   5  -1.300  11.813  -8.922
   46   2H5*    C   5          2H5*        C   5  -2.398  10.676  -8.154
   47    H4*    C   5           H4*        C   5  -1.867  12.645  -6.804
   48    H3*    C   5           H3*        C   5  -4.371  11.498  -6.824
   49    H2*    C   5           H2*        C   5  -5.164  13.031  -8.531
   50   2HO*    C   5          2HO*        C   5  -6.476  13.296  -6.429
   51    H1*    C   5           H1*        C   5  -3.955  15.249  -6.936
   52   1H4     C   5          1H4         C   5  -5.918  18.562 -11.948
   53   2H4     C   5          2H4         C   5  -5.629  17.230 -13.030
   54    H5     C   5           H5         C   5  -4.767  15.124 -12.300
   55    H6     C   5           H6         C   5  -4.200  13.778 -10.340
   56   1H5*    A   6          1H5*        A   6  -2.240  14.678  -4.586
   57   2H5*    A   6          2H5*        A   6  -1.039  13.403  -4.423
   58    H4*    A   6           H4*        A   6  -0.221  15.328  -3.488
   59    H3*    A   6           H3*        A   6  -0.828  13.251  -1.438
   60    H2*    A   6           H2*        A   6  -0.156  14.788   0.309
   61   2HO*    A   6          2HO*        A   6   1.501  15.634  -1.452
   62    H1*    A   6           H1*        A   6  -1.354  17.052  -0.631
   63    H8     A   6           H8         A   6  -4.021  14.949  -1.853
   64   1H6     A   6          1H6         A   6  -6.043  14.301   3.978
   65   2H6     A   6          2H6         A   6  -6.394  13.990   2.295
   66    H2     A   6           H2         A   6  -2.057  16.232   4.151
   67   1H5*    U   7          1H5*        U   7   2.978  12.795   1.079
   68   2H5*    U   7          2H5*        U   7   2.008  14.066   0.370
   69    H4*    U   7           H4*        U   7   3.813  14.969   1.661
   70    H3*    U   7           H3*        U   7   3.216  16.039  -0.804
   71    H2*    U   7           H2*        U   7   4.861  14.680  -1.902
   72   2HO*    U   7          2HO*        U   7   5.830  17.279  -1.301
   73    H1*    U   7           H1*        U   7   6.758  15.475   0.342
   74    H3     U   7           H3         U   7  10.291  13.452  -1.496
   75    H5     U   7           H5         U   7   7.419  10.424  -1.244
   76    H6     U   7           H6         U   7   5.727  12.133  -0.775
   77   1H5*    A   8          1H5*        A   8   4.244  19.737  -1.049
   78   2H5*    A   8          2H5*        A   8   3.541  20.663   0.283
   79    H4*    A   8           H4*        A   8   2.788  21.667  -1.700
   80    H3*    A   8           H3*        A   8   0.960  20.840   0.153
   81    H2*    A   8           H2*        A   8   0.512  18.778  -1.061
   82   2HO*    A   8          2HO*        A   8  -1.552  19.782  -0.607
   83    H1*    A   8           H1*        A   8   0.332  20.606  -3.459
   84    H8     A   8           H8         A   8   2.386  17.372  -3.171
   85   1H6     A   8          1H6         A   8  -1.285  15.343  -7.731
   86   2H6     A   8          2H6         A   8   0.254  15.126  -6.931
   87    H2     A   8           H2         A   8  -3.086  19.051  -6.069
   88   1H5*    C   9          1H5*        C   9  -2.271  22.166  -0.809
   89   2H5*    C   9          2H5*        C   9  -2.594  23.725  -0.047
   90    H4*    C   9           H4*        C   9  -4.164  22.147   0.750
   91    H3*    C   9           H3*        C   9  -2.183  22.938   2.855
   92    H2*    C   9           H2*        C   9  -3.372  21.478   4.376
   93   2HO*    C   9          2HO*        C   9  -5.491  22.096   3.093
   94    H1*    C   9           H1*        C   9  -3.671  19.382   2.682
   95   1H4     C   9          1H4         C   9   1.988  18.498   5.583
   96   2H4     C   9          2H4         C   9   2.762  18.929   4.074
   97    H5     C   9           H5         C   9   1.583  19.937   2.252
   98    H6     C   9           H6         C   9  -0.611  20.615   1.441
   99   1H5*    C  10          1H5*        C  10  -5.686  23.060   4.835
  100   2H5*    C  10          2H5*        C  10  -5.958  24.507   5.802
  101    H4*    C  10           H4*        C  10  -5.997  22.481   7.193
  102    H3*    C  10           H3*        C  10  -3.603  24.283   7.685
  103    H2*    C  10           H2*        C  10  -3.166  22.889   9.591
  104   2HO*    C  10          2HO*        C  10  -5.511  22.562  10.094
  105    H1*    C  10           H1*        C  10  -3.544  20.537   8.193
  106   1H4     C  10          1H4         C  10   2.649  21.399   7.488
  107   2H4     C  10          2H4         C  10   2.363  22.133   5.928
  108    H5     C  10           H5         C  10   0.179  22.750   5.144
  109    H6     C  10           H6         C  10  -2.208  22.729   5.696
  110   1H5*    U  11          1H5*        U  11  -4.960  24.648  11.577
  111   2H5*    U  11          2H5*        U  11  -4.617  26.291  12.136
  112    H4*    U  11           H4*        U  11  -3.296  24.431  13.230
  113    H3*    U  11           H3*        U  11  -1.792  26.612  11.793
  114    H2*    U  11           H2*        U  11   0.167  25.747  12.885
  115   2HO*    U  11          2HO*        U  11  -1.137  25.247  14.924
  116    H1*    U  11           H1*        U  11  -0.511  23.126  12.404
  117    H3     U  11           H3         U  11   3.044  24.063   9.667
  118    H5     U  11           H5         U  11  -0.235  25.718   7.658
  119    H6     U  11           H6         U  11  -1.620  25.233   9.628
  120   1H5*    C  12          1H5*        C  12  -0.163  27.548  15.985
  121   2H5*    C  12          2H5*        C  12   0.783  28.958  15.507
  122    H4*    C  12           H4*        C  12   1.431  26.018  15.372
  123    H3*    C  12           H3*        C  12   2.384  28.079  16.896
  124    H2*    C  12           H2*        C  12   3.061  29.395  15.014
  125   2HO*    C  12          2HO*        C  12   5.002  28.462  16.537
  126    H1*    C  12           H1*        C  12   4.369  26.902  13.876
  127   1H4     C  12          1H4         C  12   5.404  31.157   9.249
  128   2H4     C  12          2H4         C  12   3.718  31.609   9.207
  129    H5     C  12           H5         C  12   2.075  30.678  10.688
  130    H6     C  12           H6         C  12   1.716  29.106  12.536
  131   1H5*    U  13          1H5*        U  13   3.652  23.587  17.719
  132   2H5*    U  13          2H5*        U  13   4.392  23.562  19.322
  133    H4*    U  13           H4*        U  13   5.597  21.856  18.388
  134    H3*    U  13           H3*        U  13   7.215  24.144  18.442
  135    H2*    U  13           H2*        U  13   6.652  24.710  16.175
  136   2HO*    U  13          2HO*        U  13   9.065  23.204  16.248
  137    H1*    U  13           H1*        U  13   7.072  21.756  15.535
  138    H3     U  13           H3         U  13   6.837  22.722  11.108
  139    H5     U  13           H5         U  13   3.676  24.948  12.699
  140    H6     U  13           H6         U  13   4.348  24.208  14.942
  141   1H5*    U  14          1H5*        U  14  10.286  19.546  18.991
  142   2H5*    U  14          2H5*        U  14  11.699  20.480  18.501
  143    H4*    U  14           H4*        U  14   9.116  20.090  16.954
  144    H3*    U  14           H3*        U  14  11.655  18.713  16.945
  145    H2*    U  14           H2*        U  14  12.704  20.439  15.782
  146   2HO*    U  14          2HO*        U  14  11.469  18.708  13.897
  147    H1*    U  14           H1*        U  14  10.058  20.923  14.334
  148    H3     U  14           H3         U  14  12.296  23.735  11.517
  149    H5     U  14           H5         U  14  13.513  25.023  15.308
  150    H6     U  14           H6         U  14  12.258  23.152  16.290
  151   1H5*    G  15          1H5*        G  15   6.992  15.971  15.329
  152   2H5*    G  15          2H5*        G  15   7.433  17.485  14.529
  153    H4*    G  15           H4*        G  15   5.526  17.521  16.881
  154    H3*    G  15           H3*        G  15   4.928  16.747  14.015
  155    H2*    G  15           H2*        G  15   2.723  17.699  14.374
  156   2HO*    G  15          2HO*        G  15   2.694  17.060  16.742
  157    H1*    G  15           H1*        G  15   3.735  19.999  15.348
  158    H8     G  15           H8         G  15   6.541  19.182  13.047
  159    H1     G  15           H1         G  15   1.211  20.895   9.889
  160   1H2     G  15          1H2         G  15  -0.513  20.675  11.171
  161   2H2     G  15          2H2         G  15  -0.359  20.361  12.889
  162   1H5*    G  16          1H5*        G  16   1.388  15.548  15.858
  163   2H5*    G  16          2H5*        G  16   0.973  13.891  15.399
  164    H4*    G  16           H4*        G  16  -0.887  15.402  14.965
  165    H3*    G  16           H3*        G  16   0.421  14.345  12.444
  166    H2*    G  16           H2*        G  16  -1.453  15.350  11.280
  167   2HO*    G  16          2HO*        G  16  -2.996  14.854  13.118
  168    H1*    G  16           H1*        G  16  -1.244  17.715  12.577
  169    H8     G  16           H8         G  16   2.363  16.720  12.444
  170    H1     G  16           H1         G  16   0.042  18.011   6.617
  171   1H2     G  16          1H2         G  16  -2.103  18.355   6.698
  172   2H2     G  16          2H2         G  16  -3.013  18.068   8.168
  173   1H5*    G  17          1H5*        G  17  -3.437  13.373  11.484
  174   2H5*    G  17          2H5*        G  17  -3.527  11.752  10.781
  175    H4*    G  17           H4*        G  17  -4.328  13.498   9.241
  176    H3*    G  17           H3*        G  17  -1.811  12.079   8.337
  177    H2*    G  17           H2*        G  17  -2.126  13.312   6.238
  178   2HO*    G  17          2HO*        G  17  -4.549  13.221   6.460
  179    H1*    G  17           H1*        G  17  -2.365  15.671   7.409
  180    H8     G  17           H8         G  17  -0.187  14.085   9.979
  181    H1     G  17           H1         G  17   2.929  15.793   4.626
  182   1H2     G  17          1H2         G  17   1.512  16.219   3.037
  183   2H2     G  17          2H2         G  17  -0.207  15.919   3.228
  184   1H5*    C  18          1H5*        C  18  -3.752  11.588   4.943
  185   2H5*    C  18          2H5*        C  18  -3.643   9.948   4.287
  186    H4*    C  18           H4*        C  18  -2.642  11.530   2.763
  187    H3*    C  18           H3*        C  18  -0.528   9.859   4.120
  188    H2*    C  18           H2*        C  18   1.077  10.905   2.528
  189   2HO*    C  18          2HO*        C  18   0.027  11.352   0.621
  190    H1*    C  18           H1*        C  18   0.264  13.311   3.114
  191   1H4     C  18          1H4         C  18   4.419  11.959   7.722
  192   2H4     C  18          2H4         C  18   3.089  11.628   8.803
  193    H5     C  18           H5         C  18   0.791  11.632   8.102
  194    H6     C  18           H6         C  18  -0.681  11.819   6.174
  195   1H5*    C  19          1H5*        C  19   0.544   9.506   0.322
  196   2H5*    C  19          2H5*        C  19   0.940   7.859  -0.160
  197    H4*    C  19           H4*        C  19   2.770   9.371  -0.688
  198    H3*    C  19           H3*        C  19   3.404   7.473   1.600
  199    H2*    C  19           H2*        C  19   5.707   8.158   1.218
  200   2HO*    C  19          2HO*        C  19   5.189   8.433  -1.209
  201    H1*    C  19           H1*        C  19   5.084  10.798   1.194
  202   1H4     C  19          1H4         C  19   6.119   9.224   7.300
  203   2H4     C  19          2H4         C  19   4.430   8.817   7.503
  204    H5     C  19           H5         C  19   2.855   8.792   5.697
  205    H6     C  19           H6         C  19   2.561   9.246   3.311
  206   1H5*    U  20          1H5*        U  20   6.370   6.783  -1.070
  207   2H5*    U  20          2H5*        U  20   6.628   5.060  -1.359
  208    H4*    U  20           H4*        U  20   8.703   6.163  -0.733
  209    H3*    U  20           H3*        U  20   7.662   4.323   1.446
  210    H2*    U  20           H2*        U  20   9.904   4.544   2.351
  211   2HO*    U  20          2HO*        U  20  10.923   4.741   0.123
  212    H1*    U  20           H1*        U  20   9.850   7.250   2.111
  213    H3     U  20           H3         U  20   9.107   6.108   6.522
  214    H5     U  20           H5         U  20   5.305   6.171   4.781
  215    H6     U  20           H6         U  20   6.374   6.370   2.577
  216   1H5*    G  21          1H5*        G  21  11.387   2.869   0.362
  217   2H5*    G  21          2H5*        G  21  11.440   1.107   0.353
  218    H4*    G  21           H4*        G  21  13.204   2.033   1.738
  219    H3*    G  21           H3*        G  21  11.070   0.659   3.416
  220    H2*    G  21           H2*        G  21  12.735   0.788   5.168
  221   2HO*    G  21          2HO*        G  21  14.610   0.562   3.582
  222    H1*    G  21           H1*        G  21  13.170   3.428   4.694
  223    H8     G  21           H8         G  21   9.512   2.896   3.803
  224    H1     G  21           H1         G  21  10.640   2.953  10.138
  225   1H2     G  21          1H2         G  21  12.750   2.665  10.512
  226   2H2     G  21          2H2         G  21  13.932   2.680   9.219
  227   1H5*    G  22          1H5*        G  22  14.534  -1.290   4.301
  228   2H5*    G  22          2H5*        G  22  14.324  -3.042   4.303
  229    H4*    G  22           H4*        G  22  15.345  -2.338   6.361
  230    H3*    G  22           H3*        G  22  12.454  -3.149   6.797
  231    H2*    G  22           H2*        G  22  13.071  -3.283   9.104
  232   2HO*    G  22          2HO*        G  22  15.270  -4.085   8.819
  233    H1*    G  22           H1*        G  22  14.256  -0.827   9.007
  234    H8     G  22           H8         G  22  11.400  -0.523   6.540
  235    H1     G  22           H1         G  22   9.466  -0.572  12.684
  236   1H2     G  22          1H2         G  22  11.084  -1.193  13.968
  237   2H2     G  22          2H2         G  22  12.692  -1.523  13.351
  238   1H5*    U  23          1H5*        U  23  12.110  -7.819   8.779
  239   2H5*    U  23          2H5*        U  23  11.141  -6.331   8.759
  240    H4*    U  23           H4*        U  23  13.295  -6.971  10.808
  241    H3*    U  23           H3*        U  23  10.274  -7.157  10.804
  242    H2*    U  23           H2*        U  23  10.235  -6.550  13.091
  243   2HO*    U  23          2HO*        U  23  12.356  -7.705  13.541
  244    H1*    U  23           H1*        U  23  11.861  -4.419  12.780
  245    H3     U  23           H3         U  23   7.295  -3.327  12.780
  246    H5     U  23           H5         U  23   8.578  -3.168   8.806
  247    H6     U  23           H6         U  23  10.721  -4.154   9.507
  248   1H5*    U  24          1H5*        U  24  10.540  -9.122  13.815
  249   2H5*    U  24          2H5*        U  24   9.956 -10.787  13.891
  250    H4*    U  24           H4*        U  24   8.765  -9.495  15.519
  251    H3*    U  24           H3*        U  24   7.042  -9.996  13.091
  252    H2*    U  24           H2*        U  24   5.213  -9.127  14.313
  253   2HO*    U  24          2HO*        U  24   5.823 -10.091  16.413
  254    H1*    U  24           H1*        U  24   6.672  -7.005  15.311
  255    H3     U  24           H3         U  24   3.720  -5.465  12.094
  256    H5     U  24           H5         U  24   7.085  -6.731   9.940
  257    H6     U  24           H6         U  24   8.013  -7.658  12.015
  258   1H5*    A  25          1H5*        A  25   5.341 -13.983  12.034
  259   2H5*    A  25          2H5*        A  25   7.000 -14.428  11.638
  260    H4*    A  25           H4*        A  25   5.898 -13.922   9.595
  261    H3*    A  25           H3*        A  25   8.199 -12.403  10.278
  262    H2*    A  25           H2*        A  25   6.937 -10.460  10.835
  263   2HO*    A  25          2HO*        A  25   8.346  -9.742   9.192
  264    H1*    A  25           H1*        A  25   5.265 -11.188   8.410
  265    H8     A  25           H8         A  25   4.141 -10.204  12.027
  266   1H6     A  25          1H6         A  25   0.992  -5.701   9.074
  267   2H6     A  25          2H6         A  25   1.096  -6.629  10.558
  268    H2     A  25           H2         A  25   3.756  -7.627   6.161
  269   1H5*    G  26          1H5*        G  26   7.712 -15.604   5.305
  270   2H5*    G  26          2H5*        G  26   7.973 -13.899   5.035
  271    H4*    G  26           H4*        G  26   5.884 -14.208   7.048
  272    H3*    G  26           H3*        G  26   5.865 -16.425   5.282
  273    H2*    G  26           H2*        G  26   5.759 -14.814   3.514
  274   2HO*    G  26          2HO*        G  26   3.252 -16.104   3.961
  275    H1*    G  26           H1*        G  26   3.492 -13.724   5.210
  276    H8     G  26           H8         G  26   5.475 -13.225   1.938
  277    H1     G  26           H1         G  26   0.744  -9.040   2.897
  278   1H2     G  26          1H2         G  26   0.475  -8.778   5.026
  279   2H2     G  26          2H2         G  26   1.123  -9.911   6.199
  280   1H5*    U  27          1H5*        U  27   4.737 -16.880   8.550
  281   2H5*    U  27          2H5*        U  27   3.923 -18.444   8.786
  282    H4*    U  27           H4*        U  27   3.834 -17.568  10.922
  283    H3*    U  27           H3*        U  27   1.273 -16.585   9.591
  284    H2*    U  27           H2*        U  27   0.774 -15.335  11.544
  285   2HO*    U  27          2HO*        U  27   1.833 -17.161  12.919
  286    H1*    U  27           H1*        U  27   3.235 -14.273  11.926
  287    H3     U  27           H3         U  27   0.587 -11.053   9.939
  288    H5     U  27           H5         U  27   3.099 -12.589   6.989
  289    H6     U  27           H6         U  27   3.520 -14.531   8.429
  290   1H5*    A  28          1H5*        A  28  -0.364 -16.862  13.134
  291   2H5*    A  28          2H5*        A  28  -1.674 -18.042  13.091
  292    H4*    A  28           H4*        A  28  -2.550 -15.937  13.869
  293    H3*    A  28           H3*        A  28  -3.420 -16.502  11.005
  294    H2*    A  28           H2*        A  28  -4.861 -14.576  11.276
  295   2HO*    A  28          2HO*        A  28  -5.257 -15.097  13.643
  296    H1*    A  28           H1*        A  28  -2.900 -13.049  12.398
  297    H8     A  28           H8         A  28  -0.773 -14.793   9.942
  298   1H6     A  28          1H6         A  28  -3.154 -10.959   5.648
  299   2H6     A  28          2H6         A  28  -1.906 -12.154   5.958
  300    H2     A  28           H2         A  28  -5.986 -11.143   9.051
  301   1H5*    C  29          1H5*        C  29  -6.954 -15.773  12.179
  302   2H5*    C  29          2H5*        C  29  -8.169 -16.970  11.714
  303    H4*    C  29           H4*        C  29  -8.671 -14.841  10.677
  304    H3*    C  29           H3*        C  29  -7.662 -16.881   8.680
  305    H2*    C  29           H2*        C  29  -8.237 -15.224   6.979
  306   2HO*    C  29          2HO*        C  29 -10.182 -14.452   8.251
  307    H1*    C  29           H1*        C  29  -7.049 -13.186   8.227
  308   1H4     C  29          1H4         C  29  -2.493 -15.961   4.711
  309   2H4     C  29          2H4         C  29  -1.932 -16.811   6.132
  310    H5     C  29           H5         C  29  -3.108 -16.811   8.216
  311    H6     C  29           H6         C  29  -5.065 -15.935   9.388
  312   1H5*    C  30          1H5*        C  30 -11.297 -15.784   6.990
  313   2H5*    C  30          2H5*        C  30 -12.201 -17.170   6.368
  314    H4*    C  30           H4*        C  30 -11.726 -15.528   4.605
  315    H3*    C  30           H3*        C  30 -10.150 -18.097   4.263
  316    H2*    C  30           H2*        C  30  -9.606 -17.203   2.063
  317   2HO*    C  30          2HO*        C  30 -11.822 -16.066   1.944
  318    H1*    C  30           H1*        C  30  -8.975 -14.745   3.081
  319   1H4     C  30          1H4         C  30  -3.773 -18.461   2.940
  320   2H4     C  30          2H4         C  30  -4.090 -19.005   4.573
  321    H5     C  30           H5         C  30  -6.057 -18.385   5.807
  322    H6     C  30           H6         C  30  -8.150 -17.116   5.698
  323   1H5*    U  31          1H5*        U  31 -12.350 -17.406   0.630
  324   2H5*    U  31          2H5*        U  31 -13.318 -18.812   0.190
  325    H4*    U  31           H4*        U  31 -12.270 -17.871  -1.773
  326    H3*    U  31           H3*        U  31 -11.049 -20.531  -1.011
  327    H2*    U  31           H2*        U  31  -9.895 -20.428  -3.111
  328   2HO*    U  31          2HO*        U  31 -11.795 -19.383  -4.227
  329    H1*    U  31           H1*        U  31  -9.154 -17.807  -2.823
  330    H3     U  31           H3         U  31  -5.366 -20.348  -2.081
  331    H5     U  31           H5         U  31  -7.228 -20.008   1.660
  332    H6     U  31           H6         U  31  -9.210 -19.097   0.540
  333   1H5*    C  32          1H5*        C  32 -12.323 -21.536  -4.626
  334   2H5*    C  32          2H5*        C  32 -13.095 -23.122  -4.726
  335    H4*    C  32           H4*        C  32 -11.083 -23.088  -6.084
  336    H3*    C  32           H3*        C  32 -10.680 -24.741  -3.570
  337    H2*    C  32           H2*        C  32  -8.529 -25.317  -4.498
  338   2HO*    C  32          2HO*        C  32  -9.538 -25.297  -6.792
  339    H1*    C  32           H1*        C  32  -7.954 -22.758  -5.351
  340   1H4     C  32          1H4         C  32  -5.367 -23.750   0.399
  341   2H4     C  32          2H4         C  32  -6.888 -23.405   1.189
  342    H5     C  32           H5         C  32  -8.904 -22.890  -0.006
  343    H6     C  32           H6         C  32  -9.887 -22.677  -2.239
  344   1H5*    U  33          1H5*        U  33  -8.938 -27.210  -5.900
  345   2H5*    U  33          2H5*        U  33  -9.677 -28.813  -5.938
  346    H4*    U  33           H4*        U  33  -7.342 -29.092  -5.379
  347    H3*    U  33           H3*        U  33  -9.126 -29.365  -2.938
  348    H2*    U  33           H2*        U  33  -7.298 -29.906  -1.695
  349   2HO*    U  33          2HO*        U  33  -5.406 -30.294  -3.820
  350    H1*    U  33           H1*        U  33  -5.492 -28.249  -3.110
  351    H3     U  33           H3         U  33  -5.300 -26.979   1.277
  352    H5     U  33           H5         U  33  -9.237 -26.063   0.197
  353    H6     U  33           H6         U  33  -8.783 -26.968  -2.041
  354   1H5*    U  34          1H5*        U  34  -9.391 -35.019  -2.744
  355   2H5*    U  34          2H5*        U  34  -8.600 -34.203  -1.390
  356    H4*    U  34           H4*        U  34  -7.517 -36.327  -1.913
  357    H3*    U  34           H3*        U  34  -6.054 -34.064  -1.399
  358    H2*    U  34           H2*        U  34  -5.813 -33.468  -3.710
  359   2HO*    U  34          2HO*        U  34  -3.570 -35.057  -2.924
  360    H1*    U  34           H1*        U  34  -5.185 -36.399  -4.243
  361    H3     U  34           H3         U  34  -4.306 -35.529  -8.587
  362    H5     U  34           H5         U  34  -7.589 -33.046  -7.836
  363    H6     U  34           H6         U  34  -7.584 -33.832  -5.509
  364   1H5*    C  35          1H5*        C  35  -2.580 -34.413  -0.809
  365   2H5*    C  35          2H5*        C  35  -2.205 -35.441   0.575
  366    H4*    C  35           H4*        C  35  -1.127 -33.270   0.744
  367    H3*    C  35           H3*        C  35  -2.298 -34.475   2.897
  368    H2*    C  35           H2*        C  35  -4.414 -33.402   2.574
  369   2HO*    C  35          2HO*        C  35  -2.849 -31.892   4.412
  370    H1*    C  35           H1*        C  35  -3.003 -30.749   2.145
  371   1H4     C  35          1H4         C  35  -9.196 -29.585   1.116
  372   2H4     C  35          2H4         C  35  -9.246 -30.780  -0.169
  373    H5     C  35           H5         C  35  -7.404 -32.208  -0.669
  374    H6     C  35           H6         C  35  -5.038 -32.625  -0.247
  375   1H5*    G  36          1H5*        G  36   2.282 -31.351   3.029
  376   2H5*    G  36          2H5*        G  36   0.704 -31.285   2.224
  377    H4*    G  36           H4*        G  36   3.180 -32.660   1.112
  378    H3*    G  36           H3*        G  36   1.737 -30.085   0.373
  379    H2*    G  36           H2*        G  36   2.467 -30.460  -1.853
  380   2HO*    G  36          2HO*        G  36   4.706 -31.132  -0.891
  381    H1*    G  36           H1*        G  36   2.427 -33.292  -1.608
  382    H8     G  36           H8         G  36   1.045 -33.504  -3.833
  383    H1     G  36           H1         G  36  -3.406 -29.309  -1.811
  384   1H2     G  36          1H2         G  36  -2.882 -28.510   0.099
  385   2H2     G  36          2H2         G  36  -1.400 -28.939   0.924
  386   1H5*    G  37          1H5*        G  37   4.271 -28.966  -1.611
  387   2H5*    G  37          2H5*        G  37   4.785 -27.281  -1.523
  388    H4*    G  37           H4*        G  37   3.389 -27.994  -3.549
  389    H3*    G  37           H3*        G  37   2.399 -25.672  -1.852
  390    H2*    G  37           H2*        G  37   0.816 -25.376  -3.717
  391   2HO*    G  37          2HO*        G  37   2.506 -26.273  -5.340
  392    H1*    G  37           H1*        G  37   0.091 -27.965  -3.724
  393    H8     G  37           H8         G  37   0.991 -27.032  -0.112
  394    H1     G  37           H1         G  37  -4.571 -24.534  -2.140
  395   1H2     G  37          1H2         G  37  -4.803 -24.881  -4.257
  396   2H2     G  37          2H2         G  37  -3.703 -25.900  -5.161
  397   1H5*    U  38          1H5*        U  38   1.821 -24.337  -5.575
  398   2H5*    U  38          2H5*        U  38   2.555 -22.791  -5.967
  399    H4*    U  38           H4*        U  38   0.211 -22.834  -6.591
  400    H3*    U  38           H3*        U  38   0.743 -20.989  -4.282
  401    H2*    U  38           H2*        U  38  -1.462 -20.105  -4.674
  402   2HO*    U  38          2HO*        U  38  -1.496 -20.265  -7.012
  403    H1*    U  38           H1*        U  38  -2.583 -22.587  -4.761
  404    H3     U  38           H3         U  38  -3.539 -21.114  -0.516
  405    H5     U  38           H5         U  38   0.311 -22.716  -0.221
  406    H6     U  38           H6         U  38   0.353 -22.930  -2.660
  407   1H5*    G  39          1H5*        G  39  -0.259 -18.390  -7.333
  408   2H5*    G  39          2H5*        G  39   0.667 -16.892  -7.230
  409    H4*    G  39           H4*        G  39  -1.682 -16.432  -7.226
  410    H3*    G  39           H3*        G  39  -0.565 -15.938  -4.458
  411    H2*    G  39           H2*        G  39  -2.773 -14.979  -4.020
  412   2HO*    G  39          2HO*        G  39  -2.993 -14.200  -6.361
  413    H1*    G  39           H1*        G  39  -4.054 -17.131  -5.029
  414    H8     G  39           H8         G  39  -0.714 -18.331  -3.552
  415    H1     G  39           H1         G  39  -5.265 -17.154   0.830
  416   1H2     G  39          1H2         G  39  -6.887 -16.054  -0.079
  417   2H2     G  39          2H2         G  39  -6.974 -15.781  -1.805
  418   1H5*    G  40          1H5*        G  40  -2.530 -12.488  -5.500
  419   2H5*    G  40          2H5*        G  40  -1.740 -11.019  -4.897
  420    H4*    G  40           H4*        G  40  -4.078 -11.087  -4.272
  421    H3*    G  40           H3*        G  40  -2.064 -11.208  -2.005
  422    H2*    G  40           H2*        G  40  -3.989 -10.961  -0.541
  423   2HO*    G  40          2HO*        G  40  -5.105  -9.496  -2.222
  424    H1*    G  40           H1*        G  40  -5.493 -12.808  -1.803
  425    H8     G  40           H8         G  40  -2.036 -14.255  -2.136
  426    H1     G  40           H1         G  40  -4.249 -14.469   3.892
  427   1H2     G  40          1H2         G  40  -6.016 -13.249   4.086
  428   2H2     G  40          2H2         G  40  -6.684 -12.360   2.733
  429   1H5*    G  41          1H5*        G  41  -4.235  -8.766  -0.239
  430   2H5*    G  41          2H5*        G  41  -3.406  -7.316   0.318
  431    H4*    G  41           H4*        G  41  -4.256  -8.453   2.252
  432    H3*    G  41           H3*        G  41  -1.269  -8.868   1.957
  433    H2*    G  41           H2*        G  41  -1.367  -9.837   4.200
  434   2HO*    G  41          2HO*        G  41  -3.085  -8.556   5.122
  435    H1*    G  41           H1*        G  41  -3.365 -11.493   3.519
  436    H8     G  41           H8         G  41  -1.572 -11.019   0.212
  437    H1     G  41           H1         G  41   1.371 -15.146   4.159
  438   1H2     G  41          1H2         G  41   0.649 -14.949   6.160
  439   2H2     G  41          2H2         G  41  -0.595 -13.794   6.614
  440   1H5*    A  42          1H5*        A  42  -0.344  -5.288   5.911
  441   2H5*    A  42          2H5*        A  42  -0.066  -6.696   6.935
  442    H4*    A  42           H4*        A  42  -2.756  -5.808   5.815
  443    H3*    A  42           H3*        A  42  -1.550  -6.074   8.595
  444    H2*    A  42           H2*        A  42  -3.800  -6.460   9.421
  445   2HO*    A  42          2HO*        A  42  -4.799  -4.997   7.703
  446    H1*    A  42           H1*        A  42  -4.286  -8.393   7.622
  447    H8     A  42           H8         A  42  -0.752  -9.152   7.703
  448   1H6     A  42          1H6         A  42  -1.385 -11.326  13.490
  449   2H6     A  42          2H6         A  42  -0.400 -11.385  12.044
  450    H2     A  42           H2         A  42  -4.999  -8.944  12.526
  451   1H5*    A  43          1H5*        A  43  -4.287  -3.652   9.261
  452   2H5*    A  43          2H5*        A  43  -4.291  -2.103  10.074
  453    H4*    A  43           H4*        A  43  -5.547  -3.671  11.410
  454    H3*    A  43           H3*        A  43  -2.805  -3.174  12.637
  455    H2*    A  43           H2*        A  43  -3.442  -4.690  14.412
  456   2HO*    A  43          2HO*        A  43  -5.775  -3.846  14.291
  457    H1*    A  43           H1*        A  43  -4.563  -6.571  12.720
  458    H8     A  43           H8         A  43  -1.673  -5.611  10.670
  459   1H6     A  43          1H6         A  43   1.832  -9.242  14.267
  460   2H6     A  43          2H6         A  43   1.714  -8.466  12.698
  461    H2     A  43           H2         A  43  -1.945  -8.402  16.448
  462   1H5*    U  44          1H5*        U  44  -4.572  -2.791  16.003
  463   2H5*    U  44          2H5*        U  44  -4.119  -1.313  16.869
  464    H4*    U  44           H4*        U  44  -3.284  -3.228  18.095
  465    H3*    U  44           H3*        U  44  -1.080  -1.743  16.625
  466    H2*    U  44           H2*        U  44   0.453  -3.158  17.824
  467   2HO*    U  44          2HO*        U  44  -1.011  -3.146  19.812
  468    H1*    U  44           H1*        U  44  -0.956  -5.460  17.361
  469    H3     U  44           H3         U  44   2.712  -5.569  14.552
  470    H5     U  44           H5         U  44  -0.143  -3.318  12.477
  471    H6     U  44           H6         U  44  -1.526  -3.306  14.498
  472   1H5*    A  45          1H5*        A  45   0.297  -1.696  20.524
  473   2H5*    A  45          2H5*        A  45   1.037  -0.144  20.940
  474    H4*    A  45           H4*        A  45   2.637  -1.969  21.159
  475    H3*    A  45           H3*        A  45   3.274  -0.151  18.804
  476    H2*    A  45           H2*        A  45   5.382  -1.315  18.750
  477   2HO*    A  45          2HO*        A  45   5.406  -1.622  21.197
  478    H1*    A  45           H1*        A  45   4.201  -3.760  18.851
  479    H8     A  45           H8         A  45   1.761  -1.461  17.026
  480   1H6     A  45          1H6         A  45   5.128  -2.564  11.912
  481   2H6     A  45          2H6         A  45   3.608  -1.941  12.521
  482    H2     A  45           H2         A  45   7.323  -4.229  15.384
  483   1H5*    C  46          1H5*        C  46   6.603  -0.053  21.143
  484   2H5*    C  46          2H5*        C  46   7.259   1.576  21.317
  485    H4*    C  46           H4*        C  46   8.945   0.043  20.498
  486    H3*    C  46           H3*        C  46   8.075   2.014  18.345
  487    H2*    C  46           H2*        C  46  10.059   1.254  17.210
  488   2HO*    C  46          2HO*        C  46  11.302   0.959  19.305
  489    H1*    C  46           H1*        C  46   9.499  -1.387  17.725
  490   1H4     C  46          1H4         C  46   6.939   0.215  12.089
  491   2H4     C  46          2H4         C  46   5.453   0.698  12.877
  492    H5     C  46           H5         C  46   5.175   0.734  15.262
  493    H6     C  46           H6         C  46   6.295   0.311  17.404
  494   1H5*    C  47          1H5*        C  47  12.081   2.715  18.984
  495   2H5*    C  47          2H5*        C  47  12.488   4.433  18.982
  496    H4*    C  47           H4*        C  47  13.837   3.203  17.371
  497    H3*    C  47           H3*        C  47  11.807   5.009  16.017
  498    H2*    C  47           H2*        C  47  13.139   4.586  14.029
  499   2HO*    C  47          2HO*        C  47  15.233   4.471  15.285
  500    H1*    C  47           H1*        C  47  13.231   1.890  14.530
  501   1H4     C  47          1H4         C  47   8.136   3.042  10.852
  502   2H4     C  47          2H4         C  47   7.149   3.339  12.265
  503    H5     C  47           H5         C  47   8.019   3.346  14.505
  504    H6     C  47           H6         C  47  10.053   3.086  15.853
  505   1H5*    A  48          1H5*        A  48  15.643   6.309  14.882
  506   2H5*    A  48          2H5*        A  48  15.784   8.065  14.804
  507    H4*    A  48           H4*        A  48  16.550   7.020  12.746
  508    H3*    A  48           H3*        A  48  13.963   8.553  12.366
  509    H2*    A  48           H2*        A  48  14.405   8.240   9.983
  510   2HO*    A  48          2HO*        A  48  16.863   8.287  10.356
  511    H1*    A  48           H1*        A  48  14.820   5.588  10.296
  512    H8     A  48           H8         A  48  12.331   6.350  13.030
  513   1H6     A  48          1H6         A  48   7.938   6.262   8.624
  514   2H6     A  48          2H6         A  48   8.243   6.301  10.348
  515    H2     A  48           H2         A  48  11.896   6.258   6.610
  516   1H5*    G  49          1H5*        G  49  16.641  10.074   9.645
  517   2H5*    G  49          2H5*        G  49  16.622  11.827   9.499
  518    H4*    G  49           H4*        G  49  16.420  10.740   7.328
  519    H3*    G  49           H3*        G  49  13.869  12.170   8.148
  520    H2*    G  49           H2*        G  49  13.174  11.724   5.838
  521   2HO*    G  49          2HO*        G  49  15.568  11.859   5.081
  522    H1*    G  49           H1*        G  49  13.850   9.118   5.982
  523    H8     G  49           H8         G  49  12.823   9.819   9.539
  524    H1     G  49           H1         G  49   7.844   9.602   5.474
  525   1H2     G  49          1H2         G  49   8.536   9.850   3.446
  526   2H2     G  49          2H2         G  49  10.240   9.838   3.039
  527   1H5*    G  50          1H5*        G  50  14.613  13.430   4.368
  528   2H5*    G  50          2H5*        G  50  14.568  15.176   4.162
  529    H4*    G  50           H4*        G  50  13.178  14.025   2.500
  530    H3*    G  50           H3*        G  50  11.605  15.686   4.503
  531    H2*    G  50           H2*        G  50   9.670  15.198   3.081
  532   2HO*    G  50          2HO*        G  50  11.200  15.167   1.083
  533    H1*    G  50           H1*        G  50  10.244  12.544   2.874
  534    H8     G  50           H8         G  50  11.355  13.114   6.393
  535    H1     G  50           H1         G  50   4.950  12.996   5.727
  536   1H2     G  50          1H2         G  50   4.431  13.102   3.650
  537   2H2     G  50          2H2         G  50   5.621  13.419   2.404
  538   1H5*    U  51          1H5*        U  51  10.248  16.820   0.838
  539   2H5*    U  51          2H5*        U  51  10.488  18.517   0.421
  540    H4*    U  51           H4*        U  51   8.201  17.831  -0.071
  541    H3*    U  51           H3*        U  51   8.891  20.078   1.477
  542    H2*    U  51           H2*        U  51   8.191  19.292   3.472
  543   2HO*    U  51          2HO*        U  51   5.495  19.725   2.658
  544    H1*    U  51           H1*        U  51   5.948  17.661   2.290
  545    H3     U  51           H3         U  51   4.913  16.294   6.419
  546    H5     U  51           H5         U  51   9.076  16.708   6.650
  547    H6     U  51           H6         U  51   9.106  17.216   4.249
  548   1H5*    G  52          1H5*        G  52   7.847  22.272  -2.580
  549   2H5*    G  52          2H5*        G  52   6.223  22.486  -3.203
  550    H4*    G  52           H4*        G  52   7.660  19.835  -2.834
  551    H3*    G  52           H3*        G  52   6.601  21.425  -5.217
  552    H2*    G  52           H2*        G  52   6.590  19.325  -6.394
  553   2HO*    G  52          2HO*        G  52   8.591  18.524  -5.222
  554    H1*    G  52           H1*        G  52   5.353  18.042  -4.328
  555    H8     G  52           H8         G  52   3.999  21.607  -4.368
  556    H1     G  52           H1         G  52   1.336  17.708  -8.727
  557   1H2     G  52          1H2         G  52   2.623  16.014  -9.087
  558   2H2     G  52          2H2         G  52   4.046  15.704  -8.113
  559   1H5*    C  53          1H5*        C  53   9.289  19.040  -7.240
  560   2H5*    C  53          2H5*        C  53  10.201  19.983  -8.423
  561    H4*    C  53           H4*        C  53   9.100  18.093  -9.469
  562    H3*    C  53           H3*        C  53   7.785  20.702 -10.320
  563    H2*    C  53           H2*        C  53   6.721  19.314 -11.995
  564   2HO*    C  53          2HO*        C  53   8.714  17.851 -12.157
  565    H1*    C  53           H1*        C  53   6.032  17.397 -10.181
  566   1H4     C  53          1H4         C  53   1.228  21.584 -10.338
  567   2H4     C  53          2H4         C  53   1.982  22.525  -9.071
  568    H5     C  53           H5         C  53   4.202  22.108  -8.264
  569    H6     C  53           H6         C  53   6.102  20.565  -8.386
  570   1H5*    C  54          1H5*        C  54   8.855  18.895 -13.859
  571   2H5*    C  54          2H5*        C  54   9.542  20.024 -15.027
  572    H4*    C  54           H4*        C  54   7.678  18.787 -15.981
  573    H3*    C  54           H3*        C  54   6.981  21.719 -15.557
  574    H2*    C  54           H2*        C  54   5.055  21.209 -16.935
  575   2HO*    C  54          2HO*        C  54   6.348  19.563 -18.256
  576    H1*    C  54           H1*        C  54   4.470  18.934 -15.543
  577   1H4     C  54          1H4         C  54   1.345  23.662 -12.631
  578   2H4     C  54          2H4         C  54   2.711  23.939 -11.575
  579    H5     C  54           H5         C  54   4.828  22.840 -11.840
  580    H6     C  54           H6         C  54   6.046  21.159 -13.142
  581   1H5*    C  55          1H5*        C  55   6.275  21.042 -19.630
  582   2H5*    C  55          2H5*        C  55   6.913  22.363 -20.612
  583    H4*    C  55           H4*        C  55   4.548  21.981 -21.090
  584    H3*    C  55           H3*        C  55   5.112  24.592 -19.641
  585    H2*    C  55           H2*        C  55   2.834  25.159 -20.049
  586   2HO*    C  55          2HO*        C  55   2.491  24.460 -22.184
  587    H1*    C  55           H1*        C  55   1.865  22.625 -19.490
  588   1H4     C  55          1H4         C  55   1.278  26.333 -14.316
  589   2H4     C  55          2H4         C  55   2.931  25.999 -13.853
  590    H5     C  55           H5         C  55   4.433  24.680 -15.179
  591    H6     C  55           H6         C  55   4.655  23.412 -17.265
  592   1H    MET 104          1H        MET 104  10.364 -16.722   3.253
  593    HA   MET 104           HA       MET 104  11.047 -13.859   2.905
  594   1HB   MET 104          1HB       MET 104  12.968 -15.013   4.099
  595   2HB   MET 104          2HB       MET 104  13.160 -16.052   2.696
  596   1HG   MET 104          1HG       MET 104  14.455 -14.534   1.739
  597   2HG   MET 104          2HG       MET 104  13.159 -13.349   1.721
  598   1HE   MET 104          1HE       MET 104  13.779 -11.211   4.929
  599   2HE   MET 104          2HE       MET 104  13.288 -11.054   3.246
  600   3HE   MET 104          3HE       MET 104  12.497 -12.258   4.287
  601    H    TYR 105           H        TYR 105  10.819 -13.227   0.829
  602    HA   TYR 105           HA       TYR 105  10.287 -15.357  -1.217
  603   1HB   TYR 105          1HB       TYR 105   9.160 -12.580  -0.760
  604   2HB   TYR 105          2HB       TYR 105   9.053 -13.346  -2.334
  605    HD1  TYR 105           HD1      TYR 105   8.247 -14.191   1.355
  606    HD2  TYR 105           HD2      TYR 105   7.337 -14.817  -2.849
  607    HE1  TYR 105           HE1      TYR 105   6.462 -15.769   1.961
  608    HE2  TYR 105           HE2      TYR 105   5.413 -16.244  -2.185
  609    HH   TYR 105           HH       TYR 105   4.626 -16.913   1.243
  610    H    VAL 106           H        VAL 106  11.669 -15.587  -2.848
  611    HA   VAL 106           HA       VAL 106  13.810 -13.508  -3.125
  612    HB   VAL 106           HB       VAL 106  13.841 -16.487  -3.738
  613   1HG1  VAL 106          1HG1      VAL 106  16.164 -14.513  -3.652
  614   2HG1  VAL 106          2HG1      VAL 106  16.310 -16.272  -3.815
  615   3HG1  VAL 106          3HG1      VAL 106  15.542 -15.347  -5.095
  616   1HG2  VAL 106          1HG2      VAL 106  15.271 -16.703  -1.781
  617   2HG2  VAL 106          2HG2      VAL 106  15.051 -14.961  -1.415
  618   3HG2  VAL 106          3HG2      VAL 106  13.671 -16.095  -1.330
  619    H    CYS 107           H        CYS 107  14.395 -12.672  -5.064
  620    HA   CYS 107           HA       CYS 107  12.742 -13.168  -7.429
  621   1HB   CYS 107          1HB       CYS 107  13.608 -10.894  -6.855
  622   2HB   CYS 107          2HB       CYS 107  15.257 -11.496  -7.027
  623    H    HIS 108           H        HIS 108  13.172 -14.591  -8.996
  624    HA   HIS 108           HA       HIS 108  15.798 -16.011  -8.911
  625   1HB   HIS 108          1HB       HIS 108  13.087 -16.938  -9.969
  626   2HB   HIS 108          2HB       HIS 108  14.576 -17.892  -9.994
  627    HD2  HIS 108           HD2      HIS 108  11.605 -17.994  -8.101
  628    HE1  HIS 108           HE1      HIS 108  14.469 -18.269  -4.941
  629    HE2  HIS 108           HE2      HIS 108  12.017 -18.600  -5.572
  630    H    PHE 109           H        PHE 109  15.068 -13.410 -10.349
  631    HA   PHE 109           HA       PHE 109  15.172 -13.919 -13.192
  632   1HB   PHE 109          1HB       PHE 109  14.729 -11.677 -11.837
  633   2HB   PHE 109          2HB       PHE 109  16.474 -11.500 -11.880
  634    HD1  PHE 109           HD1      PHE 109  13.347 -11.383 -13.703
  635    HD2  PHE 109           HD2      PHE 109  17.631 -11.098 -14.008
  636    HE1  PHE 109           HE1      PHE 109  13.088 -10.509 -16.024
  637    HE2  PHE 109           HE2      PHE 109  17.385 -10.190 -16.346
  638    HZ   PHE 109           HZ       PHE 109  15.103  -9.895 -17.338
  639    H    GLU 110           H        GLU 110  17.043 -13.759 -14.590
  640    HA   GLU 110           HA       GLU 110  19.044 -15.561 -13.889
  641   1HB   GLU 110          1HB       GLU 110  18.419 -14.886 -16.202
  642   2HB   GLU 110          2HB       GLU 110  19.252 -13.344 -15.985
  643   1HG   GLU 110          1HG       GLU 110  21.403 -14.553 -15.657
  644   2HG   GLU 110          2HG       GLU 110  20.558 -16.098 -15.781
  645    H    ASN 111           H        ASN 111  20.512 -15.417 -12.292
  646    HA   ASN 111           HA       ASN 111  22.459 -14.767 -11.227
  647   1HB   ASN 111          1HB       ASN 111  23.110 -13.999 -13.633
  648   2HB   ASN 111          2HB       ASN 111  22.718 -12.366 -13.091
  649   1HD2  ASN 111          1HD2      ASN 111  24.800 -11.508 -13.143
  650   2HD2  ASN 111          2HD2      ASN 111  26.086 -12.115 -12.109
  651    H    CYS 112           H        CYS 112  19.613 -13.438 -10.835
  652    HA   CYS 112           HA       CYS 112  20.311 -10.872  -9.577
  653   1HB   CYS 112          1HB       CYS 112  18.220 -11.130 -10.810
  654   2HB   CYS 112          2HB       CYS 112  17.652 -12.377  -9.673
  655    H    GLY 113           H        GLY 113  18.247 -13.512  -8.233
  656   1HA   GLY 113          1HA       GLY 113  18.327 -14.670  -6.235
  657   2HA   GLY 113          2HA       GLY 113  20.038 -14.218  -6.119
  658    H    LYS 114           H        LYS 114  17.872 -11.483  -6.351
  659    HA   LYS 114           HA       LYS 114  18.541 -10.573  -3.670
  660   1HB   LYS 114          1HB       LYS 114  17.932  -9.254  -5.839
  661   2HB   LYS 114          2HB       LYS 114  16.256  -9.455  -5.311
  662   1HG   LYS 114          1HG       LYS 114  16.705  -8.192  -3.280
  663   2HG   LYS 114          2HG       LYS 114  18.465  -8.288  -3.535
  664   1HD   LYS 114          1HD       LYS 114  18.284  -6.928  -5.576
  665   2HD   LYS 114          2HD       LYS 114  16.533  -6.921  -5.405
  666   1HE   LYS 114          1HE       LYS 114  17.343  -4.810  -4.784
  667   2HE   LYS 114          2HE       LYS 114  16.663  -5.613  -3.358
  668   1HZ   LYS 114          1HZ       LYS 114  18.798  -4.530  -2.860
  669   2HZ   LYS 114          2HZ       LYS 114  18.945  -6.139  -2.655
  670   3HZ   LYS 114          3HZ       LYS 114  19.571  -5.422  -3.987
  671    H    ALA 115           H        ALA 115  17.285 -10.469  -1.802
  672    HA   ALA 115           HA       ALA 115  14.831 -12.194  -1.819
  673   1HB   ALA 115          1HB       ALA 115  15.524 -12.981   0.388
  674   2HB   ALA 115          2HB       ALA 115  16.767 -13.309  -0.826
  675   3HB   ALA 115          3HB       ALA 115  16.987 -11.962   0.327
  676    H    PHE 116           H        PHE 116  13.040 -11.522  -0.768
  677    HA   PHE 116           HA       PHE 116  13.166  -8.873   0.627
  678   1HB   PHE 116          1HB       PHE 116  10.871  -9.912  -1.076
  679   2HB   PHE 116          2HB       PHE 116  11.079  -8.325  -0.388
  680    HD1  PHE 116           HD1      PHE 116  12.508  -6.640  -1.496
  681    HD2  PHE 116           HD2      PHE 116  12.287 -10.679  -2.986
  682    HE1  PHE 116           HE1      PHE 116  13.941  -6.026  -3.446
  683    HE2  PHE 116           HE2      PHE 116  13.719 -10.077  -4.887
  684    HZ   PHE 116           HZ       PHE 116  14.573  -7.797  -5.109
  685    H    LYS 117           H        LYS 117  11.692  -8.495   2.306
  686    HA   LYS 117           HA       LYS 117  11.031 -10.720   3.965
  687   1HB   LYS 117          1HB       LYS 117  11.435  -8.432   4.792
  688   2HB   LYS 117          2HB       LYS 117   9.998  -7.874   3.950
  689   1HG   LYS 117          1HG       LYS 117   8.631  -9.351   5.422
  690   2HG   LYS 117          2HG       LYS 117  10.099  -9.847   6.281
  691   1HD   LYS 117          1HD       LYS 117   8.809  -8.194   7.542
  692   2HD   LYS 117          2HD       LYS 117  10.356  -7.499   7.000
  693   1HE   LYS 117          1HE       LYS 117   8.886  -6.765   4.929
  694   2HE   LYS 117          2HE       LYS 117   7.527  -7.070   6.035
  695   1HZ   LYS 117          1HZ       LYS 117   8.539  -5.417   7.543
  696   2HZ   LYS 117          2HZ       LYS 117   9.838  -5.245   6.538
  697   3HZ   LYS 117          3HZ       LYS 117   8.351  -4.717   6.071
  698    H    LYS 118           H        LYS 118   9.120  -8.851   1.568
  699    HA   LYS 118           HA       LYS 118   6.908 -10.866   1.878
  700   1HB   LYS 118          1HB       LYS 118   6.592  -7.845   1.571
  701   2HB   LYS 118          2HB       LYS 118   5.289  -9.024   1.698
  702   1HG   LYS 118          1HG       LYS 118   7.344  -8.571   3.901
  703   2HG   LYS 118          2HG       LYS 118   5.811  -7.718   3.814
  704   1HD   LYS 118          1HD       LYS 118   4.516  -9.584   4.022
  705   2HD   LYS 118          2HD       LYS 118   5.809 -10.733   3.626
  706   1HE   LYS 118          1HE       LYS 118   5.773  -9.184   6.182
  707   2HE   LYS 118          2HE       LYS 118   4.872 -10.716   5.920
  708   1HZ   LYS 118          1HZ       LYS 118   6.724 -11.918   5.845
  709   2HZ   LYS 118          2HZ       LYS 118   7.725 -10.758   5.373
  710   3HZ   LYS 118          3HZ       LYS 118   7.213 -10.820   6.944
  711    H    HIS 119           H        HIS 119   5.593 -11.260   0.052
  712    HA   HIS 119           HA       HIS 119   7.071 -11.329  -2.391
  713   1HB   HIS 119          1HB       HIS 119   5.050 -12.242  -3.404
  714   2HB   HIS 119          2HB       HIS 119   5.459 -13.000  -1.896
  715    HD1  HIS 119           HD1      HIS 119   2.811 -10.182  -2.748
  716    HD2  HIS 119           HD2      HIS 119   3.522 -13.814  -0.713
  717    HE1  HIS 119           HE1      HIS 119   0.586 -10.852  -1.603
  718    HE2  HIS 119           HE2      HIS 119   1.018 -13.072  -0.467
  719    H    ASN 120           H        ASN 120   4.747  -8.937  -1.165
  720    HA   ASN 120           HA       ASN 120   4.121  -7.714  -3.691
  721   1HB   ASN 120          1HB       ASN 120   4.314  -5.839  -1.405
  722   2HB   ASN 120          2HB       ASN 120   2.964  -6.196  -2.447
  723   1HD2  ASN 120          1HD2      ASN 120   1.236  -7.496  -1.515
  724   2HD2  ASN 120          2HD2      ASN 120   1.461  -8.220   0.074
  725    H    GLN 121           H        GLN 121   6.897  -7.394  -1.477
  726    HA   GLN 121           HA       GLN 121   8.069  -5.109  -2.893
  727   1HB   GLN 121          1HB       GLN 121   9.643  -7.014  -1.206
  728   2HB   GLN 121          2HB       GLN 121   9.838  -5.267  -1.459
  729   1HG   GLN 121          1HG       GLN 121   7.970  -4.807   0.032
  730   2HG   GLN 121          2HG       GLN 121   7.676  -6.551   0.230
  731   1HE2  GLN 121          1HE2      GLN 121   9.504  -3.886   1.523
  732   2HE2  GLN 121          2HE2      GLN 121  10.513  -4.880   2.546
  733    H    LEU 122           H        LEU 122   8.432  -8.701  -2.890
  734    HA   LEU 122           HA       LEU 122  10.546  -8.874  -4.768
  735   1HB   LEU 122          1HB       LEU 122   9.803 -10.803  -3.497
  736   2HB   LEU 122          2HB       LEU 122   8.189 -10.710  -4.169
  737    HG   LEU 122           HG       LEU 122   8.948 -11.412  -6.357
  738   1HD1  LEU 122          1HD1      LEU 122  11.188 -12.123  -6.721
  739   2HD1  LEU 122          2HD1      LEU 122  11.257 -10.436  -6.238
  740   3HD1  LEU 122          3HD1      LEU 122  11.663 -11.706  -5.050
  741   1HD2  LEU 122          1HD2      LEU 122  10.079 -13.270  -4.194
  742   2HD2  LEU 122          2HD2      LEU 122   8.370 -13.181  -4.681
  743   3HD2  LEU 122          3HD2      LEU 122   9.608 -13.705  -5.838
  744    H    LYS 123           H        LYS 123   6.973  -8.956  -5.344
  745    HA   LYS 123           HA       LYS 123   7.017  -8.897  -8.158
  746   1HB   LYS 123          1HB       LYS 123   5.053  -7.647  -6.190
  747   2HB   LYS 123          2HB       LYS 123   4.743  -7.760  -7.925
  748   1HG   LYS 123          1HG       LYS 123   4.643 -10.143  -7.898
  749   2HG   LYS 123          2HG       LYS 123   5.442 -10.255  -6.340
  750   1HD   LYS 123          1HD       LYS 123   3.221 -10.738  -5.808
  751   2HD   LYS 123          2HD       LYS 123   3.428  -9.069  -5.316
  752   1HE   LYS 123          1HE       LYS 123   1.423  -8.867  -6.387
  753   2HE   LYS 123          2HE       LYS 123   2.493  -8.533  -7.753
  754   1HZ   LYS 123          1HZ       LYS 123   2.255 -10.931  -8.346
  755   2HZ   LYS 123          2HZ       LYS 123   1.236 -11.153  -7.075
  756   3HZ   LYS 123          3HZ       LYS 123   0.798 -10.188  -8.320
  757    H    VAL 124           H        VAL 124   7.196  -6.159  -5.833
  758    HA   VAL 124           HA       VAL 124   7.229  -4.025  -7.738
  759    HB   VAL 124           HB       VAL 124   8.285  -4.392  -4.941
  760   1HG1  VAL 124          1HG1      VAL 124   8.798  -1.969  -4.797
  761   2HG1  VAL 124          2HG1      VAL 124   9.961  -2.852  -5.781
  762   3HG1  VAL 124          3HG1      VAL 124   8.708  -1.866  -6.569
  763   1HG2  VAL 124          1HG2      VAL 124   5.831  -3.953  -5.679
  764   2HG2  VAL 124          2HG2      VAL 124   6.511  -3.038  -4.352
  765   3HG2  VAL 124          3HG2      VAL 124   6.436  -2.306  -5.990
  766    H    HIS 125           H        HIS 125   9.889  -6.058  -6.405
  767    HA   HIS 125           HA       HIS 125  11.992  -4.595  -7.647
  768   1HB   HIS 125          1HB       HIS 125  12.416  -6.033  -5.774
  769   2HB   HIS 125          2HB       HIS 125  11.787  -7.449  -6.610
  770    HD1  HIS 125           HD1      HIS 125  14.838  -5.090  -6.797
  771    HD2  HIS 125           HD2      HIS 125  13.370  -8.806  -8.142
  772    HE1  HIS 125           HE1      HIS 125  16.807  -6.284  -7.873
  773    H    GLN 126           H        GLN 126  10.233  -7.585  -8.670
  774    HA   GLN 126           HA       GLN 126  11.823  -8.062 -10.991
  775   1HB   GLN 126          1HB       GLN 126   8.992  -8.922 -10.250
  776   2HB   GLN 126          2HB       GLN 126   9.828  -9.425 -11.753
  777   1HG   GLN 126          1HG       GLN 126  11.806 -10.113 -10.329
  778   2HG   GLN 126          2HG       GLN 126  10.859  -9.828  -8.878
  779   1HE2  GLN 126          1HE2      GLN 126  12.164 -12.183  -9.489
  780   2HE2  GLN 126          2HE2      GLN 126  10.939 -13.454  -9.745
  781    H    PHE 127           H        PHE 127   8.990  -5.986 -10.476
  782    HA   PHE 127           HA       PHE 127   8.299  -5.434 -13.159
  783   1HB   PHE 127          1HB       PHE 127   6.876  -4.149 -12.188
  784   2HB   PHE 127          2HB       PHE 127   7.569  -4.519 -10.663
  785    HD1  PHE 127           HD1      PHE 127   7.512  -2.773  -9.301
  786    HD2  PHE 127           HD2      PHE 127   8.404  -1.929 -13.417
  787    HE1  PHE 127           HE1      PHE 127   8.019  -0.533  -8.644
  788    HE2  PHE 127           HE2      PHE 127   8.832   0.408 -12.849
  789    HZ   PHE 127           HZ       PHE 127   8.778   1.152 -10.438
  790    H    SER 128           H        SER 128  11.118  -4.408 -11.280
  791    HA   SER 128           HA       SER 128  11.958  -2.258 -13.045
  792   1HB   SER 128          1HB       SER 128  12.713  -2.645 -10.662
  793   2HB   SER 128          2HB       SER 128  13.717  -3.989 -11.256
  794    HG   SER 128           HG       SER 128  14.866  -1.983 -11.145
  795    H    HIS 129           H        HIS 129  12.845  -5.775 -12.789
  796    HA   HIS 129           HA       HIS 129  14.730  -5.761 -14.970
  797   1HB   HIS 129          1HB       HIS 129  12.999  -8.016 -13.869
  798   2HB   HIS 129          2HB       HIS 129  14.287  -8.188 -15.035
  799    HD1  HIS 129           HD1      HIS 129  16.867  -7.708 -14.067
  800    HD2  HIS 129           HD2      HIS 129  13.679  -8.753 -11.566
  801    HE1  HIS 129           HE1      HIS 129  17.880  -8.801 -11.976
  802    H    THR 130           H        THR 130  11.200  -6.282 -14.801
  803    HA   THR 130           HA       THR 130  10.971  -6.988 -17.640
  804    HB   THR 130           HB       THR 130   8.530  -6.876 -17.203
  805    HG1  THR 130           HG1      THR 130   9.373  -5.833 -14.753
  806   1HG2  THR 130          1HG2      THR 130   8.299  -8.681 -15.660
  807   2HG2  THR 130          2HG2      THR 130   9.903  -8.942 -16.391
  808   3HG2  THR 130          3HG2      THR 130   9.753  -8.267 -14.754
  809    H    GLN 131           H        GLN 131  11.077  -4.062 -15.796
  810    HA   GLN 131           HA       GLN 131  10.736  -1.855 -16.255
  811   1HB   GLN 131          1HB       GLN 131  12.227  -2.712 -18.334
  812   2HB   GLN 131          2HB       GLN 131  10.777  -2.278 -19.240
  813   1HG   GLN 131          1HG       GLN 131  11.702  -0.180 -19.190
  814   2HG   GLN 131          2HG       GLN 131  10.985  -0.074 -17.580
  815   1HE2  GLN 131          1HE2      GLN 131  12.805  -1.529 -15.905
  816   2HE2  GLN 131          2HE2      GLN 131  14.357  -0.749 -16.067
  817    H    GLN 132           H        GLN 132   8.375  -3.649 -16.053
  818    HA   GLN 132           HA       GLN 132   6.454  -1.664 -17.217
  819   1HB   GLN 132          1HB       GLN 132   4.787  -3.387 -17.576
  820   2HB   GLN 132          2HB       GLN 132   6.210  -3.621 -18.576
  821   1HG   GLN 132          1HG       GLN 132   5.449  -5.770 -17.948
  822   2HG   GLN 132          2HG       GLN 132   6.933  -5.452 -17.072
  823   1HE2  GLN 132          1HE2      GLN 132   6.874  -5.837 -14.905
  824   2HE2  GLN 132          2HE2      GLN 132   5.401  -5.947 -13.929
  825    H    LEU 133           H        LEU 133   4.477  -1.434 -15.930
  826    HA   LEU 133           HA       LEU 133   5.252  -1.549 -13.094
  827   1HB   LEU 133          1HB       LEU 133   3.265   0.082 -14.678
  828   2HB   LEU 133          2HB       LEU 133   3.229   0.115 -12.907
  829    HG   LEU 133           HG       LEU 133   5.848   0.599 -14.471
  830   1HD1  LEU 133          1HD1      LEU 133   3.850   2.683 -13.487
  831   2HD1  LEU 133          2HD1      LEU 133   5.452   2.998 -14.195
  832   3HD1  LEU 133          3HD1      LEU 133   4.174   2.283 -15.190
  833   1HD2  LEU 133          1HD2      LEU 133   6.609   1.640 -12.481
  834   2HD2  LEU 133          2HD2      LEU 133   5.028   1.463 -11.711
  835   3HD2  LEU 133          3HD2      LEU 133   6.019   0.028 -12.060
  836    HA   PRO 134           HA       PRO 134   2.491  -4.881 -12.376
  837   1HB   PRO 134          1HB       PRO 134   2.652  -4.766  -9.550
  838   2HB   PRO 134          2HB       PRO 134   3.756  -5.647 -10.647
  839   1HG   PRO 134          1HG       PRO 134   4.250  -3.218  -9.075
  840   2HG   PRO 134          2HG       PRO 134   5.399  -4.246  -9.947
  841   1HD   PRO 134          1HD       PRO 134   4.366  -1.668 -10.707
  842   2HD   PRO 134          2HD       PRO 134   5.466  -2.732 -11.582
  843    H    TYR 135           H        TYR 135   1.953  -1.889 -10.484
  844    HA   TYR 135           HA       TYR 135  -0.741  -2.826  -9.702
  845   1HB   TYR 135          1HB       TYR 135   0.838  -0.359  -8.824
  846   2HB   TYR 135          2HB       TYR 135  -0.662  -0.914  -8.127
  847    HD1  TYR 135           HD1      TYR 135   2.957  -1.375  -8.157
  848    HD2  TYR 135           HD2      TYR 135  -0.806  -3.108  -6.960
  849    HE1  TYR 135           HE1      TYR 135   4.187  -2.945  -6.657
  850    HE2  TYR 135           HE2      TYR 135   0.442  -4.792  -5.560
  851    HH   TYR 135           HH       TYR 135   4.000  -4.872  -5.353
  852    H    GLU 136           H        GLU 136  -2.033  -2.570 -11.511
  853    HA   GLU 136           HA       GLU 136  -2.031   0.087 -12.878
  854   1HB   GLU 136          1HB       GLU 136  -1.843  -1.810 -14.374
  855   2HB   GLU 136          2HB       GLU 136  -3.187  -2.644 -13.596
  856   1HG   GLU 136          1HG       GLU 136  -4.782  -1.019 -14.465
  857   2HG   GLU 136          2HG       GLU 136  -3.479  -0.037 -15.145
  858    H    CYS 137           H        CYS 137  -3.827   1.417 -12.872
  859    HA   CYS 137           HA       CYS 137  -5.897   0.989 -10.860
  860   1HB   CYS 137          1HB       CYS 137  -5.117   3.226 -11.304
  861   2HB   CYS 137          2HB       CYS 137  -5.467   3.083 -13.014
  862    HA   PRO 138           HA       PRO 138  -8.294  -1.382 -13.796
  863   1HB   PRO 138          1HB       PRO 138 -10.025  -2.580 -12.078
  864   2HB   PRO 138          2HB       PRO 138  -8.265  -2.865 -11.961
  865   1HG   PRO 138          1HG       PRO 138  -9.929  -0.875 -10.365
  866   2HG   PRO 138          2HG       PRO 138  -8.782  -2.102  -9.738
  867   1HD   PRO 138          1HD       PRO 138  -8.081   0.534 -10.189
  868   2HD   PRO 138          2HD       PRO 138  -6.929  -0.829 -10.362
  869    H    HIS 139           H        HIS 139  -9.256   1.552 -12.585
  870    HA   HIS 139           HA       HIS 139 -12.113   1.497 -12.669
  871   1HB   HIS 139          1HB       HIS 139 -10.712   3.321 -11.685
  872   2HB   HIS 139          2HB       HIS 139 -10.253   3.822 -13.314
  873    HD2  HIS 139           HD2      HIS 139 -13.296   3.688 -10.929
  874    HE1  HIS 139           HE1      HIS 139 -14.384   6.290 -14.130
  875    HE2  HIS 139           HE2      HIS 139 -15.103   5.364 -11.869
  876    H    GLU 140           H        GLU 140 -13.621   1.955 -14.272
  877    HA   GLU 140           HA       GLU 140 -12.950   1.135 -16.953
  878   1HB   GLU 140          1HB       GLU 140 -15.460   2.436 -15.789
  879   2HB   GLU 140          2HB       GLU 140 -15.321   1.824 -17.445
  880   1HG   GLU 140          1HG       GLU 140 -14.799  -0.442 -16.559
  881   2HG   GLU 140          2HG       GLU 140 -15.006   0.155 -14.911
  882    H    GLY 141           H        GLY 141 -11.592   2.399 -18.141
  883   1HA   GLY 141          1HA       GLY 141 -11.631   4.212 -19.794
  884   2HA   GLY 141          2HA       GLY 141 -12.445   5.239 -18.601
  885    H    CYS 142           H        CYS 142 -10.158   3.559 -16.865
  886    HA   CYS 142           HA       CYS 142  -8.165   5.777 -17.118
  887   1HB   CYS 142          1HB       CYS 142  -9.364   5.229 -14.895
  888   2HB   CYS 142          2HB       CYS 142  -8.390   3.762 -14.850
  889    H    ASP 143           H        ASP 143  -5.871   5.208 -16.970
  890    HA   ASP 143           HA       ASP 143  -5.156   2.406 -17.676
  891   1HB   ASP 143          1HB       ASP 143  -4.077   2.968 -19.690
  892   2HB   ASP 143          2HB       ASP 143  -5.646   3.744 -19.800
  893    H    LYS 144           H        LYS 144  -4.660   4.776 -15.557
  894    HA   LYS 144           HA       LYS 144  -1.797   5.222 -15.590
  895   1HB   LYS 144          1HB       LYS 144  -4.008   5.533 -13.529
  896   2HB   LYS 144          2HB       LYS 144  -2.328   5.623 -13.047
  897   1HG   LYS 144          1HG       LYS 144  -3.211   7.828 -13.328
  898   2HG   LYS 144          2HG       LYS 144  -1.880   7.526 -14.445
  899   1HD   LYS 144          1HD       LYS 144  -3.404   7.286 -16.310
  900   2HD   LYS 144          2HD       LYS 144  -4.815   7.349 -15.254
  901   1HE   LYS 144          1HE       LYS 144  -2.823   9.644 -15.514
  902   2HE   LYS 144          2HE       LYS 144  -4.232   9.460 -16.559
  903   1HZ   LYS 144          1HZ       LYS 144  -4.293   9.972 -13.631
  904   2HZ   LYS 144          2HZ       LYS 144  -4.883  10.888 -14.854
  905   3HZ   LYS 144          3HZ       LYS 144  -5.606   9.470 -14.491
  906    H    ARG 145           H        ARG 145  -0.136   4.188 -14.490
  907    HA   ARG 145           HA       ARG 145  -0.800   1.756 -12.877
  908   1HB   ARG 145          1HB       ARG 145   1.501   1.800 -14.868
  909   2HB   ARG 145          2HB       ARG 145   0.867   0.453 -13.879
  910   1HG   ARG 145          1HG       ARG 145  -1.197   0.427 -15.182
  911   2HG   ARG 145          2HG       ARG 145  -0.574   1.709 -16.238
  912   1HD   ARG 145          1HD       ARG 145   1.238   0.320 -17.004
  913   2HD   ARG 145          2HD       ARG 145   0.865  -0.938 -15.805
  914    HE   ARG 145           HE       ARG 145  -1.483  -0.862 -17.119
  915   1HH1  ARG 145          1HH1      ARG 145   1.720  -1.090 -18.569
  916   2HH1  ARG 145          2HH1      ARG 145   1.091  -2.013 -19.910
  917   1HH2  ARG 145          1HH2      ARG 145  -2.145  -1.976 -18.671
  918   2HH2  ARG 145          2HH2      ARG 145  -1.108  -2.517 -19.996
  919    H    PHE 146           H        PHE 146   0.756   1.199 -11.328
  920    HA   PHE 146           HA       PHE 146   2.609   3.444 -10.619
  921   1HB   PHE 146          1HB       PHE 146   0.746   1.959  -8.695
  922   2HB   PHE 146          2HB       PHE 146   1.794   3.288  -8.324
  923    HD1  PHE 146           HD1      PHE 146  -1.357   2.369 -10.051
  924    HD2  PHE 146           HD2      PHE 146   1.356   5.584  -9.067
  925    HE1  PHE 146           HE1      PHE 146  -3.006   3.980 -10.845
  926    HE2  PHE 146           HE2      PHE 146  -0.301   7.224  -9.935
  927    HZ   PHE 146           HZ       PHE 146  -2.433   6.430 -10.889
  928    H    SER 147           H        SER 147   4.235   2.929  -9.049
  929    HA   SER 147           HA       SER 147   5.432   0.332  -9.644
  930   1HB   SER 147          1HB       SER 147   7.283   1.332  -8.130
  931   2HB   SER 147          2HB       SER 147   6.902   2.214  -9.630
  932    HG   SER 147           HG       SER 147   7.060   3.607  -7.818
  933    H    LEU 148           H        LEU 148   3.649   1.814  -6.983
  934    HA   LEU 148           HA       LEU 148   4.023  -0.688  -5.398
  935   1HB   LEU 148          1HB       LEU 148   4.483   2.172  -4.537
  936   2HB   LEU 148          2HB       LEU 148   3.760   1.084  -3.391
  937    HG   LEU 148           HG       LEU 148   6.089   1.320  -2.952
  938   1HD1  LEU 148          1HD1      LEU 148   6.770  -1.129  -2.970
  939   2HD1  LEU 148          2HD1      LEU 148   5.186  -0.781  -2.273
  940   3HD1  LEU 148          3HD1      LEU 148   5.293  -1.436  -3.925
  941   1HD2  LEU 148          1HD2      LEU 148   7.873   0.623  -4.315
  942   2HD2  LEU 148          2HD2      LEU 148   6.805  -0.108  -5.509
  943   3HD2  LEU 148          3HD2      LEU 148   6.864   1.666  -5.340
  944    HA   PRO 149           HA       PRO 149  -0.370  -0.673  -5.103
  945   1HB   PRO 149          1HB       PRO 149  -0.771  -1.803  -2.585
  946   2HB   PRO 149          2HB       PRO 149  -0.292  -2.699  -4.042
  947   1HG   PRO 149          1HG       PRO 149   1.457  -1.747  -1.778
  948   2HG   PRO 149          2HG       PRO 149   1.501  -3.307  -2.683
  949   1HD   PRO 149          1HD       PRO 149   3.256  -1.290  -3.246
  950   2HD   PRO 149          2HD       PRO 149   2.620  -2.357  -4.452
  951    H    SER 150           H        SER 150   1.463   0.790  -2.433
  952    HA   SER 150           HA       SER 150  -0.714   2.188  -1.182
  953   1HB   SER 150          1HB       SER 150   1.277   3.720  -0.423
  954   2HB   SER 150          2HB       SER 150   1.215   2.036   0.118
  955    HG   SER 150           HG       SER 150   3.119   3.249  -1.322
  956    H    ARG 151           H        ARG 151   1.462   3.001  -3.908
  957    HA   ARG 151           HA       ARG 151   0.540   5.765  -4.135
  958   1HB   ARG 151          1HB       ARG 151   2.636   4.195  -5.261
  959   2HB   ARG 151          2HB       ARG 151   1.625   4.670  -6.626
  960   1HG   ARG 151          1HG       ARG 151   2.721   6.576  -4.512
  961   2HG   ARG 151          2HG       ARG 151   3.465   6.291  -6.082
  962   1HD   ARG 151          1HD       ARG 151   2.102   7.728  -7.128
  963   2HD   ARG 151          2HD       ARG 151   0.664   6.984  -6.465
  964    HE   ARG 151           HE       ARG 151   2.255   8.925  -4.821
  965   1HH1  ARG 151          1HH1      ARG 151  -0.866   8.200  -6.331
  966   2HH1  ARG 151          2HH1      ARG 151  -1.564   9.654  -5.593
  967   1HH2  ARG 151          1HH2      ARG 151   1.135  10.747  -3.968
  968   2HH2  ARG 151          2HH2      ARG 151  -0.578  10.869  -4.383
  969    H    LEU 152           H        LEU 152  -0.343   2.622  -5.614
  970    HA   LEU 152           HA       LEU 152  -2.315   3.656  -7.469
  971   1HB   LEU 152          1HB       LEU 152  -1.437   1.395  -7.678
  972   2HB   LEU 152          2HB       LEU 152  -1.953   1.001  -6.036
  973    HG   LEU 152           HG       LEU 152  -4.283   1.015  -6.657
  974   1HD1  LEU 152          1HD1      LEU 152  -3.408   1.665  -9.502
  975   2HD1  LEU 152          2HD1      LEU 152  -5.057   1.328  -8.931
  976   3HD1  LEU 152          3HD1      LEU 152  -4.240   2.804  -8.428
  977   1HD2  LEU 152          1HD2      LEU 152  -2.735  -0.519  -8.780
  978   2HD2  LEU 152          2HD2      LEU 152  -2.834  -1.042  -7.088
  979   3HD2  LEU 152          3HD2      LEU 152  -4.308  -0.933  -8.080
  980    H    LYS 153           H        LYS 153  -2.462   2.430  -4.061
  981    HA   LYS 153           HA       LYS 153  -5.229   2.709  -3.629
  982   1HB   LYS 153          1HB       LYS 153  -3.568   1.667  -2.073
  983   2HB   LYS 153          2HB       LYS 153  -3.027   3.277  -1.586
  984   1HG   LYS 153          1HG       LYS 153  -5.316   3.800  -0.777
  985   2HG   LYS 153          2HG       LYS 153  -5.860   2.192  -1.268
  986   1HD   LYS 153          1HD       LYS 153  -3.703   2.770   0.813
  987   2HD   LYS 153          2HD       LYS 153  -5.396   2.400   1.169
  988   1HE   LYS 153          1HE       LYS 153  -5.141   0.190   0.036
  989   2HE   LYS 153          2HE       LYS 153  -3.432   0.540  -0.241
  990   1HZ   LYS 153          1HZ       LYS 153  -3.133   0.660   2.179
  991   2HZ   LYS 153          2HZ       LYS 153  -4.714   0.337   2.433
  992   3HZ   LYS 153          3HZ       LYS 153  -3.746  -0.793   1.764
  993    H    ARG 154           H        ARG 154  -2.644   5.206  -3.269
  994    HA   ARG 154           HA       ARG 154  -4.433   7.345  -2.478
  995   1HB   ARG 154          1HB       ARG 154  -1.623   7.181  -3.588
  996   2HB   ARG 154          2HB       ARG 154  -2.455   8.723  -3.624
  997   1HG   ARG 154          1HG       ARG 154  -2.771   7.529  -0.980
  998   2HG   ARG 154          2HG       ARG 154  -1.077   7.560  -1.447
  999   1HD   ARG 154          1HD       ARG 154  -1.653   9.574  -0.205
 1000   2HD   ARG 154          2HD       ARG 154  -1.173   9.981  -1.850
 1001    HE   ARG 154           HE       ARG 154  -3.736  10.048  -2.304
 1002   1HH1  ARG 154          1HH1      ARG 154  -2.165  11.437   0.547
 1003   2HH1  ARG 154          2HH1      ARG 154  -3.457  12.602   0.686
 1004   1HH2  ARG 154          1HH2      ARG 154  -5.085  11.656  -2.054
 1005   2HH2  ARG 154          2HH2      ARG 154  -5.034  12.709  -0.669
 1006    H    HIS 155           H        HIS 155  -3.320   6.130  -5.668
 1007    HA   HIS 155           HA       HIS 155  -4.478   8.218  -7.242
 1008   1HB   HIS 155          1HB       HIS 155  -2.873   6.685  -8.197
 1009   2HB   HIS 155          2HB       HIS 155  -3.933   5.294  -7.935
 1010    HD1  HIS 155           HD1      HIS 155  -3.915   8.535 -10.033
 1011    HD2  HIS 155           HD2      HIS 155  -5.856   4.824  -9.680
 1012    HE1  HIS 155           HE1      HIS 155  -5.711   8.520 -11.819
 1013    H    GLU 156           H        GLU 156  -5.866   5.105  -6.039
 1014    HA   GLU 156           HA       GLU 156  -8.311   5.182  -7.407
 1015   1HB   GLU 156          1HB       GLU 156  -7.599   4.130  -4.629
 1016   2HB   GLU 156          2HB       GLU 156  -9.208   3.969  -5.320
 1017   1HG   GLU 156          1HG       GLU 156  -8.276   2.794  -7.290
 1018   2HG   GLU 156          2HG       GLU 156  -6.669   2.869  -6.578
 1019    H    LYS 157           H        LYS 157  -7.275   7.110  -4.600
 1020    HA   LYS 157           HA       LYS 157  -9.855   8.035  -3.731
 1021   1HB   LYS 157          1HB       LYS 157  -7.183   9.518  -3.626
 1022   2HB   LYS 157          2HB       LYS 157  -8.635   9.880  -2.710
 1023   1HG   LYS 157          1HG       LYS 157  -8.523   7.588  -1.656
 1024   2HG   LYS 157          2HG       LYS 157  -6.996   7.321  -2.494
 1025   1HD   LYS 157          1HD       LYS 157  -6.494   7.943  -0.251
 1026   2HD   LYS 157          2HD       LYS 157  -6.014   9.283  -1.305
 1027   1HE   LYS 157          1HE       LYS 157  -8.059  10.522  -0.716
 1028   2HE   LYS 157          2HE       LYS 157  -8.670   9.138   0.200
 1029   1HZ   LYS 157          1HZ       LYS 157  -6.803   9.407   1.736
 1030   2HZ   LYS 157          2HZ       LYS 157  -6.229  10.684   0.889
 1031   3HZ   LYS 157          3HZ       LYS 157  -7.666  10.788   1.665
 1032    H    VAL 158           H        VAL 158  -7.832   8.880  -6.518
 1033    HA   VAL 158           HA       VAL 158  -8.987  11.413  -7.159
 1034    HB   VAL 158           HB       VAL 158  -7.951   9.297  -9.118
 1035   1HG1  VAL 158          1HG1      VAL 158  -7.450  11.229 -10.555
 1036   2HG1  VAL 158          2HG1      VAL 158  -9.186  11.184 -10.206
 1037   3HG1  VAL 158          3HG1      VAL 158  -8.120  12.322  -9.330
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.601  11.697  -7.884
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.167  10.032  -7.442
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.842  10.645  -9.093
 1041    H    HIS 159           H        HIS 159  -9.973   8.065  -7.956
 1042    HA   HIS 159           HA       HIS 159 -12.257   8.919  -9.563
 1043   1HB   HIS 159          1HB       HIS 159 -11.374   6.227  -8.426
 1044   2HB   HIS 159          2HB       HIS 159 -12.824   6.445  -9.429
 1045    HD1  HIS 159           HD1      HIS 159 -12.044   8.017 -11.850
 1046    HD2  HIS 159           HD2      HIS 159  -9.285   5.568  -9.825
 1047    HE1  HIS 159           HE1      HIS 159 -10.088   7.651 -13.447
 1048    H    ALA 160           H        ALA 160 -11.667   8.030  -6.167
 1049    HA   ALA 160           HA       ALA 160 -14.457   7.776  -5.422
 1050   1HB   ALA 160          1HB       ALA 160 -12.054   8.481  -3.672
 1051   2HB   ALA 160          2HB       ALA 160 -13.613   7.837  -3.130
 1052   3HB   ALA 160          3HB       ALA 160 -12.538   6.822  -4.109
 1053    H    GLY 161           H        GLY 161 -12.190  10.498  -5.748
 1054   1HA   GLY 161          1HA       GLY 161 -12.897  12.751  -6.081
 1055   2HA   GLY 161          2HA       GLY 161 -14.440  12.383  -5.313
 1056    H    TYR 162           H        TYR 162 -13.254  14.675  -4.574
 1057    HA   TYR 162           HA       TYR 162 -12.110  14.068  -1.866
 1058   1HB   TYR 162          1HB       TYR 162 -11.444  16.420  -3.685
 1059   2HB   TYR 162          2HB       TYR 162 -10.788  16.150  -2.058
 1060    HD1  TYR 162           HD1      TYR 162 -10.970  14.885  -5.539
 1061    HD2  TYR 162           HD2      TYR 162  -8.912  14.539  -1.764
 1062    HE1  TYR 162           HE1      TYR 162  -9.497  13.200  -6.507
 1063    HE2  TYR 162           HE2      TYR 162  -7.229  13.035  -2.844
 1064    HH   TYR 162           HH       TYR 162  -6.498  12.089  -4.914
 1065    HA   PRO 163           HA       PRO 163 -16.028  16.241  -1.364
 1066   1HB   PRO 163          1HB       PRO 163 -16.874  15.048   0.951
 1067   2HB   PRO 163          2HB       PRO 163 -16.857  14.182  -0.612
 1068   1HG   PRO 163          1HG       PRO 163 -14.768  14.070   1.581
 1069   2HG   PRO 163          2HG       PRO 163 -15.545  12.708   0.712
 1070   1HD   PRO 163          1HD       PRO 163 -13.105  13.728  -0.002
 1071   2HD   PRO 163          2HD       PRO 163 -14.258  13.076  -1.213
 1072    H    CYS 164           H        CYS 164 -16.685  18.030  -0.225
 1073    HA   CYS 164           HA       CYS 164 -14.711  19.374   1.433
 1074   1HB   CYS 164          1HB       CYS 164 -16.492  20.359  -0.233
 1075   2HB   CYS 164          2HB       CYS 164 -17.596  20.249   1.155
 1076    H    LYS 165           H        LYS 165 -14.721  19.788   3.583
 1077    HA   LYS 165           HA       LYS 165 -17.046  19.033   5.225
 1078   1HB   LYS 165          1HB       LYS 165 -15.443  17.031   5.106
 1079   2HB   LYS 165          2HB       LYS 165 -14.270  18.004   5.974
 1080   1HG   LYS 165          1HG       LYS 165 -15.517  16.367   7.361
 1081   2HG   LYS 165          2HG       LYS 165 -15.671  18.003   7.967
 1082   1HD   LYS 165          1HD       LYS 165 -17.955  18.179   7.072
 1083   2HD   LYS 165          2HD       LYS 165 -17.785  16.597   6.272
 1084   1HE   LYS 165          1HE       LYS 165 -17.444  15.540   8.503
 1085   2HE   LYS 165          2HE       LYS 165 -17.661  17.109   9.283
 1086   1HZ   LYS 165          1HZ       LYS 165 -19.694  15.714   9.240
 1087   2HZ   LYS 165          2HZ       LYS 165 -19.964  17.145   8.538
 1088   3HZ   LYS 165          3HZ       LYS 165 -19.750  15.803   7.618
 1089    H    LYS 166           H        LYS 166 -15.159  21.385   4.243
 1090    HA   LYS 166           HA       LYS 166 -14.051  22.593   6.649
 1091   1HB   LYS 166          1HB       LYS 166 -15.096  23.836   4.092
 1092   2HB   LYS 166          2HB       LYS 166 -14.194  24.704   5.325
 1093   1HG   LYS 166          1HG       LYS 166 -13.147  22.521   3.484
 1094   2HG   LYS 166          2HG       LYS 166 -12.791  24.243   3.469
 1095   1HD   LYS 166          1HD       LYS 166 -10.895  23.514   4.482
 1096   2HD   LYS 166          2HD       LYS 166 -11.877  23.794   5.928
 1097   1HE   LYS 166          1HE       LYS 166 -12.502  21.356   5.915
 1098   2HE   LYS 166          2HE       LYS 166 -11.544  21.147   4.441
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.293  20.486   6.420
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.564  21.765   5.716
 1101   3HZ   LYS 166          3HZ       LYS 166 -10.443  21.974   7.079
 1102    H    ASP 167           H        ASP 167 -17.278  22.333   5.298
 1103    HA   ASP 167           HA       ASP 167 -18.341  23.450   7.812
 1104   1HB   ASP 167          1HB       ASP 167 -18.332  25.319   6.050
 1105   2HB   ASP 167          2HB       ASP 167 -19.501  24.358   5.141
 1106    H    ASP 168           H        ASP 168 -20.243  22.433   8.460
 1107    HA   ASP 168           HA       ASP 168 -20.636  19.811   7.374
 1108   1HB   ASP 168          1HB       ASP 168 -20.984  20.681   9.793
 1109   2HB   ASP 168          2HB       ASP 168 -22.572  21.225   9.241
 1110    H    SER 169           H        SER 169 -22.119  22.902   6.613
 1111    HA   SER 169           HA       SER 169 -24.442  21.608   5.261
 1112   1HB   SER 169          1HB       SER 169 -25.307  23.850   4.998
 1113   2HB   SER 169          2HB       SER 169 -24.780  23.645   6.665
 1114    HG   SER 169           HG       SER 169 -22.822  24.771   6.096
 1115    H    CYS 170           H        CYS 170 -21.459  21.536   4.366
 1116    HA   CYS 170           HA       CYS 170 -21.892  22.557   1.588
 1117   1HB   CYS 170          1HB       CYS 170 -19.988  23.575   2.959
 1118   2HB   CYS 170          2HB       CYS 170 -19.251  21.982   2.957
 1119    H    SER 171           H        SER 171 -21.840  21.055  -0.040
 1120    HA   SER 171           HA       SER 171 -21.121  18.232   0.697
 1121   1HB   SER 171          1HB       SER 171 -23.496  19.183  -0.961
 1122   2HB   SER 171          2HB       SER 171 -23.093  17.496  -0.589
 1123    HG   SER 171           HG       SER 171 -24.701  18.332   0.820
 1124    H    PHE 172           H        PHE 172 -19.849  20.562  -1.023
 1125    HA   PHE 172           HA       PHE 172 -19.778  19.675  -3.747
 1126   1HB   PHE 172          1HB       PHE 172 -18.969  21.865  -3.254
 1127   2HB   PHE 172          2HB       PHE 172 -17.905  21.281  -1.986
 1128    HD1  PHE 172           HD1      PHE 172 -15.781  20.146  -2.461
 1129    HD2  PHE 172           HD2      PHE 172 -18.260  21.621  -5.656
 1130    HE1  PHE 172           HE1      PHE 172 -13.935  19.769  -4.062
 1131    HE2  PHE 172           HE2      PHE 172 -16.332  21.440  -7.226
 1132    HZ   PHE 172           HZ       PHE 172 -14.152  20.555  -6.419
 1133    H    VAL 173           H        VAL 173 -18.543  18.174  -4.815
 1134    HA   VAL 173           HA       VAL 173 -16.346  16.833  -3.302
 1135    HB   VAL 173           HB       VAL 173 -18.291  15.447  -5.188
 1136   1HG1  VAL 173          1HG1      VAL 173 -15.971  14.343  -3.502
 1137   2HG1  VAL 173          2HG1      VAL 173 -17.100  13.370  -4.465
 1138   3HG1  VAL 173          3HG1      VAL 173 -15.981  14.458  -5.275
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.016  15.441  -2.157
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.453  15.778  -3.128
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.838  14.126  -3.044
 1142    H    GLY 174           H        GLY 174 -14.449  17.114  -4.278
 1143   1HA   GLY 174          1HA       GLY 174 -14.414  18.190  -7.031
 1144   2HA   GLY 174          2HA       GLY 174 -13.030  18.024  -5.934
 1145    H    LYS 175           H        LYS 175 -13.790  17.179  -8.881
 1146    HA   LYS 175           HA       LYS 175 -13.481  14.362  -9.057
 1147   1HB   LYS 175          1HB       LYS 175 -14.143  15.720 -10.939
 1148   2HB   LYS 175          2HB       LYS 175 -12.646  16.609 -10.954
 1149   1HG   LYS 175          1HG       LYS 175 -12.619  13.630 -11.442
 1150   2HG   LYS 175          2HG       LYS 175 -13.151  14.721 -12.712
 1151   1HD   LYS 175          1HD       LYS 175 -10.431  14.936 -11.383
 1152   2HD   LYS 175          2HD       LYS 175 -10.739  14.042 -12.860
 1153   1HE   LYS 175          1HE       LYS 175 -11.271  16.038 -14.071
 1154   2HE   LYS 175          2HE       LYS 175 -11.367  17.008 -12.593
 1155   1HZ   LYS 175          1HZ       LYS 175  -9.032  16.784 -12.267
 1156   2HZ   LYS 175          2HZ       LYS 175  -8.859  15.709 -13.496
 1157   3HZ   LYS 175          3HZ       LYS 175  -9.227  17.254 -13.845
 1158    H    THR 176           H        THR 176 -11.143  16.851  -8.236
 1159    HA   THR 176           HA       THR 176  -9.089  14.766  -7.815
 1160    HB   THR 176           HB       THR 176  -7.459  16.694  -8.857
 1161    HG1  THR 176           HG1      THR 176  -8.757  17.929  -9.951
 1162   1HG2  THR 176          1HG2      THR 176  -7.290  15.172 -10.847
 1163   2HG2  THR 176          2HG2      THR 176  -7.200  14.329  -9.280
 1164   3HG2  THR 176          3HG2      THR 176  -8.680  14.292 -10.242
 1165    H    TRP 177           H        TRP 177  -7.239  15.568  -6.540
 1166    HA   TRP 177           HA       TRP 177  -8.166  16.841  -4.220
 1167   1HB   TRP 177          1HB       TRP 177  -6.268  15.388  -4.160
 1168   2HB   TRP 177          2HB       TRP 177  -5.391  16.350  -5.314
 1169    HD1  TRP 177           HD1      TRP 177  -3.442  17.289  -4.289
 1170    HE1  TRP 177           HE1      TRP 177  -2.764  18.543  -2.153
 1171    HE3  TRP 177           HE3      TRP 177  -7.744  16.623  -1.652
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.685  18.460   0.563
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.724  17.043   0.802
 1174    HH2  TRP 177           HH2      TRP 177  -5.702  17.902   1.917
 1175    H    THR 178           H        THR 178  -6.329  18.265  -6.980
 1176    HA   THR 178           HA       THR 178  -5.894  20.852  -5.911
 1177    HB   THR 178           HB       THR 178  -6.148  21.610  -8.344
 1178    HG1  THR 178           HG1      THR 178  -5.940  19.006  -9.206
 1179   1HG2  THR 178          1HG2      THR 178  -4.082  20.711  -9.140
 1180   2HG2  THR 178          2HG2      THR 178  -3.945  21.125  -7.422
 1181   3HG2  THR 178          3HG2      THR 178  -4.103  19.429  -7.920
 1182    H    LEU 179           H        LEU 179  -8.721  19.641  -7.801
 1183    HA   LEU 179           HA       LEU 179 -10.106  22.097  -7.887
 1184   1HB   LEU 179          1HB       LEU 179 -11.251  19.267  -7.843
 1185   2HB   LEU 179          2HB       LEU 179 -12.123  20.722  -8.330
 1186    HG   LEU 179           HG       LEU 179  -9.720  19.490  -9.715
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.302  19.073 -11.526
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.876  18.363 -10.006
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.602  19.868 -10.608
 1190   1HD2  LEU 179          1HD2      LEU 179  -9.523  21.908 -10.024
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.117  21.185 -11.515
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.251  22.029 -10.438
 1193    H    TYR 180           H        TYR 180 -10.019  19.624  -5.329
 1194    HA   TYR 180           HA       TYR 180 -12.183  20.775  -3.756
 1195   1HB   TYR 180          1HB       TYR 180 -11.758  18.571  -3.220
 1196   2HB   TYR 180          2HB       TYR 180 -10.010  18.736  -3.311
 1197    HD1  TYR 180           HD1      TYR 180 -12.941  19.938  -1.261
 1198    HD2  TYR 180           HD2      TYR 180  -8.743  18.963  -1.361
 1199    HE1  TYR 180           HE1      TYR 180 -12.765  20.371   1.193
 1200    HE2  TYR 180           HE2      TYR 180  -8.595  19.320   1.097
 1201    HH   TYR 180           HH       TYR 180  -9.708  19.852   2.995
 1202    H    LEU 181           H        LEU 181  -8.585  20.888  -3.551
 1203    HA   LEU 181           HA       LEU 181  -8.420  22.710  -1.407
 1204   1HB   LEU 181          1HB       LEU 181  -6.614  22.221  -3.812
 1205   2HB   LEU 181          2HB       LEU 181  -6.204  23.351  -2.556
 1206    HG   LEU 181           HG       LEU 181  -6.669  20.336  -2.205
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.192  22.064  -2.431
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.161  20.523  -1.578
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.594  20.545  -3.289
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.687  20.729   0.117
 1211   2HD2  LEU 181          2HD2      LEU 181  -6.019  22.468  -0.161
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.334  21.286  -0.145
 1213    H    LYS 182           H        LYS 182  -8.685  23.391  -4.927
 1214    HA   LYS 182           HA       LYS 182  -8.525  26.264  -4.728
 1215   1HB   LYS 182          1HB       LYS 182  -9.720  24.384  -6.820
 1216   2HB   LYS 182          2HB       LYS 182  -9.777  26.147  -6.968
 1217   1HG   LYS 182          1HG       LYS 182  -7.273  26.219  -6.693
 1218   2HG   LYS 182          2HG       LYS 182  -7.249  24.456  -6.774
 1219   1HD   LYS 182          1HD       LYS 182  -8.361  24.615  -9.048
 1220   2HD   LYS 182          2HD       LYS 182  -8.228  26.384  -8.917
 1221   1HE   LYS 182          1HE       LYS 182  -5.692  25.935  -8.466
 1222   2HE   LYS 182          2HE       LYS 182  -6.008  24.318  -9.114
 1223   1HZ   LYS 182          1HZ       LYS 182  -6.402  26.913 -10.490
 1224   2HZ   LYS 182          2HZ       LYS 182  -5.301  25.767 -10.889
 1225   3HZ   LYS 182          3HZ       LYS 182  -6.902  25.482 -11.141
 1226    H    HIS 183           H        HIS 183 -11.298  23.968  -4.654
 1227    HA   HIS 183           HA       HIS 183 -13.373  25.932  -4.485
 1228   1HB   HIS 183          1HB       HIS 183 -13.996  23.678  -4.946
 1229   2HB   HIS 183          2HB       HIS 183 -13.144  23.031  -3.561
 1230    HD1  HIS 183           HD1      HIS 183 -16.439  24.876  -4.317
 1231    HD2  HIS 183           HD2      HIS 183 -14.291  23.123  -1.149
 1232    HE1  HIS 183           HE1      HIS 183 -18.018  24.820  -2.310
 1233    H    VAL 184           H        VAL 184 -11.358  24.335  -1.974
 1234    HA   VAL 184           HA       VAL 184 -12.684  25.474   0.292
 1235    HB   VAL 184           HB       VAL 184  -9.945  24.279  -0.181
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.483  25.996   1.498
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.881  25.443   2.462
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.472  24.381   2.213
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.511  23.554   1.269
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.677  22.708  -0.057
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.969  22.675   1.554
 1242    H    ALA 185           H        ALA 185  -9.846  26.551  -1.610
 1243    HA   ALA 185           HA       ALA 185  -9.215  28.742   0.066
 1244   1HB   ALA 185          1HB       ALA 185  -7.669  27.796  -1.620
 1245   2HB   ALA 185          2HB       ALA 185  -8.721  28.387  -2.926
 1246   3HB   ALA 185          3HB       ALA 185  -7.889  29.539  -1.860
 1247    H    GLU 186           H        GLU 186 -11.534  28.407  -2.607
 1248    HA   GLU 186           HA       GLU 186 -11.998  31.319  -2.773
 1249   1HB   GLU 186          1HB       GLU 186 -13.139  28.914  -4.246
 1250   2HB   GLU 186          2HB       GLU 186 -13.706  30.555  -4.528
 1251   1HG   GLU 186          1HG       GLU 186 -10.803  29.697  -4.883
 1252   2HG   GLU 186          2HG       GLU 186 -11.998  29.745  -6.175
 1253    H    CYS 187           H        CYS 187 -13.491  28.518  -1.206
 1254    HA   CYS 187           HA       CYS 187 -16.015  30.080  -0.775
 1255   1HB   CYS 187          1HB       CYS 187 -15.959  27.847  -2.080
 1256   2HB   CYS 187          2HB       CYS 187 -15.707  27.067  -0.511
 1257    HG   CYS 187           HG       CYS 187 -17.812  28.218   0.640
 1258    H    HIS 188           H        HIS 188 -13.319  28.647   0.965
 1259    HA   HIS 188           HA       HIS 188 -14.757  29.156   3.553
 1260   1HB   HIS 188          1HB       HIS 188 -12.965  26.769   2.954
 1261   2HB   HIS 188          2HB       HIS 188 -13.728  27.129   4.504
 1262    HD1  HIS 188           HD1      HIS 188 -16.563  27.018   4.445
 1263    HD2  HIS 188           HD2      HIS 188 -14.325  25.347   1.304
 1264    HE1  HIS 188           HE1      HIS 188 -18.109  25.345   3.276
 1265    H    GLN 189           H        GLN 189 -12.401  30.339   1.706
 1266    HA   GLN 189           HA       GLN 189 -10.822  31.214   4.065
 1267   1HB   GLN 189          1HB       GLN 189  -9.504  30.235   1.500
 1268   2HB   GLN 189          2HB       GLN 189  -8.682  30.934   2.881
 1269   1HG   GLN 189          1HG       GLN 189  -9.423  29.019   4.293
 1270   2HG   GLN 189          2HG       GLN 189 -10.113  28.247   2.860
 1271   1HE2  GLN 189          1HE2      GLN 189  -8.049  27.071   4.500
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.613  26.918   3.490
 1273    H    ASP 190           H        ASP 190  -9.230  33.045   3.291
 1274    HA   ASP 190           HA       ASP 190 -10.257  34.627   1.015
 1275   1HB   ASP 190          1HB       ASP 190 -11.750  35.228   2.940
 1276   2HB   ASP 190          2HB       ASP 190 -10.332  35.703   3.875
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  -6.711  30.365 -15.470
    2   2H5*    G   1          2H5*        G   1  -7.659  28.922 -15.076
    3    H4*    G   1           H4*        G   1  -6.756  28.746 -17.317
    4    H3*    G   1           H3*        G   1  -5.409  26.873 -15.359
    5    H2*    G   1           H2*        G   1  -4.389  25.856 -17.320
    6   2HO*    G   1          2HO*        G   1  -6.387  26.373 -18.703
    7    H1*    G   1           H1*        G   1  -3.574  28.231 -18.317
    8    H8     G   1           H8         G   1  -3.436  28.956 -14.631
    9    H1     G   1           H1         G   1   1.490  25.429 -16.778
   10   1H2     G   1          1H2         G   1   0.970  24.471 -18.658
   11   2H2     G   1          2H2         G   1  -0.486  24.903 -19.529
   12   1H5*    G   2          1H5*        G   2  -6.607  24.362 -18.432
   13   2H5*    G   2          2H5*        G   2  -7.389  22.903 -17.813
   14    H4*    G   2           H4*        G   2  -5.575  22.346 -19.340
   15    H3*    G   2           H3*        G   2  -4.977  21.634 -16.457
   16    H2*    G   2           H2*        G   2  -3.083  20.412 -17.366
   17   2HO*    G   2          2HO*        G   2  -4.367  19.881 -19.436
   18    H1*    G   2           H1*        G   2  -2.290  22.486 -18.932
   19    H8     G   2           H8         G   2  -3.751  24.215 -15.902
   20    H1     G   2           H1         G   2   2.057  21.650 -14.853
   21   1H2     G   2          1H2         G   2   2.508  20.183 -16.370
   22   2H2     G   2          2H2         G   2   1.476  19.947 -17.769
   23   1H5*    G   3          1H5*        G   3  -4.361  18.096 -18.536
   24   2H5*    G   3          2H5*        G   3  -5.152  16.724 -17.755
   25    H4*    G   3           H4*        G   3  -2.780  16.267 -18.159
   26    H3*    G   3           H3*        G   3  -3.515  16.602 -15.231
   27    H2*    G   3           H2*        G   3  -1.282  15.812 -14.771
   28   2HO*    G   3          2HO*        G   3  -1.412  14.282 -16.728
   29    H1*    G   3           H1*        G   3  -0.101  17.342 -16.716
   30    H8     G   3           H8         G   3  -2.828  19.505 -15.183
   31    H1     G   3           H1         G   3   2.547  19.140 -11.655
   32   1H2     G   3          1H2         G   3   3.726  17.453 -12.276
   33   2H2     G   3          2H2         G   3   3.316  16.500 -13.690
   34   1H5*    C   4          1H5*        C   4  -1.678  12.912 -15.186
   35   2H5*    C   4          2H5*        C   4  -2.538  11.766 -14.149
   36    H4*    C   4           H4*        C   4  -0.224  12.061 -13.408
   37    H3*    C   4           H3*        C   4  -2.290  13.240 -11.523
   38    H2*    C   4           H2*        C   4  -0.477  13.573 -10.003
   39   2HO*    C   4          2HO*        C   4   0.486  11.390 -10.672
   40    H1*    C   4           H1*        C   4   1.354  14.315 -11.975
   41   1H4     C   4          1H4         C   4  -0.902  19.403  -8.845
   42   2H4     C   4          2H4         C   4  -2.380  19.372  -9.775
   43    H5     C   4           H5         C   4  -2.842  17.720 -11.453
   44    H6     C   4           H6         C   4  -2.000  15.688 -12.529
   45   1H5*    C   5          1H5*        C   5  -1.211  12.029  -8.561
   46   2H5*    C   5          2H5*        C   5  -2.283  10.887  -7.771
   47    H4*    C   5           H4*        C   5  -1.719  12.920  -6.476
   48    H3*    C   5           H3*        C   5  -4.145  11.567  -6.375
   49    H2*    C   5           H2*        C   5  -5.214  13.051  -7.976
   50   2HO*    C   5          2HO*        C   5  -5.584  13.945  -5.316
   51    H1*    C   5           H1*        C   5  -3.999  15.393  -6.566
   52   1H4     C   5          1H4         C   5  -5.904  18.567 -11.677
   53   2H4     C   5          2H4         C   5  -5.594  17.214 -12.733
   54    H5     C   5           H5         C   5  -4.840  15.084 -11.936
   55    H6     C   5           H6         C   5  -4.281  13.789  -9.938
   56   1H5*    A   6          1H5*        A   6  -2.249  14.992  -4.202
   57   2H5*    A   6          2H5*        A   6  -0.847  13.917  -4.171
   58    H4*    A   6           H4*        A   6  -0.285  15.865  -3.097
   59    H3*    A   6           H3*        A   6  -0.585  13.550  -1.241
   60    H2*    A   6           H2*        A   6  -0.319  14.969   0.691
   61   2HO*    A   6          2HO*        A   6   1.371  16.321   0.250
   62    H1*    A   6           H1*        A   6  -1.653  17.183  -0.194
   63    H8     A   6           H8         A   6  -4.156  15.064  -1.562
   64   1H6     A   6          1H6         A   6  -6.153  13.812   4.170
   65   2H6     A   6          2H6         A   6  -6.463  13.574   2.468
   66    H2     A   6           H2         A   6  -2.270  15.924   4.517
   67   1H5*    U   7          1H5*        U   7   3.112  12.964   1.065
   68   2H5*    U   7          2H5*        U   7   2.099  14.296   0.522
   69    H4*    U   7           H4*        U   7   3.858  15.117   1.933
   70    H3*    U   7           H3*        U   7   3.204  16.300  -0.492
   71    H2*    U   7           H2*        U   7   5.000  15.204  -1.645
   72   2HO*    U   7          2HO*        U   7   5.720  17.783  -0.750
   73    H1*    U   7           H1*        U   7   6.770  15.869   0.740
   74    H3     U   7           H3         U   7  10.459  14.231  -1.199
   75    H5     U   7           H5         U   7   7.738  11.065  -1.401
   76    H6     U   7           H6         U   7   5.955  12.615  -0.760
   77   1H5*    A   8          1H5*        A   8   4.022  19.998  -0.523
   78   2H5*    A   8          2H5*        A   8   3.275  20.832   0.845
   79    H4*    A   8           H4*        A   8   2.547  21.937  -1.083
   80    H3*    A   8           H3*        A   8   0.690  20.964   0.665
   81    H2*    A   8           H2*        A   8   0.319  18.986  -0.677
   82   2HO*    A   8          2HO*        A   8  -1.756  19.926  -0.184
   83    H1*    A   8           H1*        A   8   0.110  20.913  -2.986
   84    H8     A   8           H8         A   8   2.315  17.772  -2.825
   85   1H6     A   8          1H6         A   8  -1.330  15.671  -7.380
   86   2H6     A   8          2H6         A   8   0.221  15.493  -6.595
   87    H2     A   8           H2         A   8  -3.246  19.285  -5.650
   88   1H5*    C   9          1H5*        C   9  -2.565  22.378  -0.157
   89   2H5*    C   9          2H5*        C   9  -2.839  23.890   0.723
   90    H4*    C   9           H4*        C   9  -4.406  22.293   1.509
   91    H3*    C   9           H3*        C   9  -2.241  22.774   3.541
   92    H2*    C   9           H2*        C   9  -3.505  21.312   5.001
   93   2HO*    C   9          2HO*        C   9  -5.619  22.168   3.904
   94    H1*    C   9           H1*        C   9  -3.956  19.385   3.126
   95   1H4     C   9          1H4         C   9   1.693  18.082   5.911
   96   2H4     C   9          2H4         C   9   2.487  18.660   4.459
   97    H5     C   9           H5         C   9   1.335  19.892   2.769
   98    H6     C   9           H6         C   9  -0.844  20.659   2.000
   99   1H5*    C  10          1H5*        C  10  -5.604  23.038   5.712
  100   2H5*    C  10          2H5*        C  10  -5.695  24.430   6.791
  101    H4*    C  10           H4*        C  10  -5.898  22.316   8.028
  102    H3*    C  10           H3*        C  10  -3.311  23.816   8.574
  103    H2*    C  10           H2*        C  10  -2.979  22.216  10.343
  104   2HO*    C  10          2HO*        C  10  -5.334  22.092  10.889
  105    H1*    C  10           H1*        C  10  -3.627  20.058   8.758
  106   1H4     C  10          1H4         C  10   2.629  20.525   7.984
  107   2H4     C  10          2H4         C  10   2.378  21.454   6.523
  108    H5     C  10           H5         C  10   0.229  22.293   5.848
  109    H6     C  10           H6         C  10  -2.150  22.352   6.430
  110   1H5*    U  11          1H5*        U  11  -4.207  24.071  12.479
  111   2H5*    U  11          2H5*        U  11  -3.691  25.657  13.075
  112    H4*    U  11           H4*        U  11  -2.347  23.655  13.855
  113    H3*    U  11           H3*        U  11  -0.901  25.842  12.358
  114    H2*    U  11           H2*        U  11   1.102  24.764  13.113
  115   2HO*    U  11          2HO*        U  11   0.125  24.190  15.278
  116    H1*    U  11           H1*        U  11   0.193  22.256  12.533
  117    H3     U  11           H3         U  11   3.392  23.192   9.398
  118    H5     U  11           H5         U  11   0.062  25.368   8.088
  119    H6     U  11           H6         U  11  -1.105  24.722  10.148
  120   1H5*    C  12          1H5*        C  12   1.562  26.380  16.014
  121   2H5*    C  12          2H5*        C  12   2.400  27.856  15.555
  122    H4*    C  12           H4*        C  12   3.150  25.057  15.222
  123    H3*    C  12           H3*        C  12   4.491  27.331  15.894
  124    H2*    C  12           H2*        C  12   4.122  28.300  13.674
  125   2HO*    C  12          2HO*        C  12   6.711  27.414  14.224
  126    H1*    C  12           H1*        C  12   5.198  25.650  12.638
  127   1H4     C  12          1H4         C  12   4.111  28.529   7.070
  128   2H4     C  12          2H4         C  12   2.474  28.923   7.530
  129    H5     C  12           H5         C  12   1.564  28.427   9.696
  130    H6     C  12           H6         C  12   2.059  27.452  11.890
  131   1H5*    U  13          1H5*        U  13   5.760  22.971  16.622
  132   2H5*    U  13          2H5*        U  13   6.863  23.189  17.981
  133    H4*    U  13           H4*        U  13   7.589  21.143  17.317
  134    H3*    U  13           H3*        U  13   9.444  23.035  16.477
  135    H2*    U  13           H2*        U  13   8.519  23.266  14.307
  136   2HO*    U  13          2HO*        U  13  10.589  21.322  14.285
  137    H1*    U  13           H1*        U  13   8.245  20.243  14.140
  138    H3     U  13           H3         U  13   6.959  20.903   9.824
  139    H5     U  13           H5         U  13   4.658  23.692  11.916
  140    H6     U  13           H6         U  13   5.796  23.014  13.982
  141   1H5*    U  14          1H5*        U  14  11.480  18.215  18.524
  142   2H5*    U  14          2H5*        U  14  12.723  18.040  17.289
  143    H4*    U  14           H4*        U  14   9.705  18.099  16.877
  144    H3*    U  14           H3*        U  14  11.409  15.975  17.481
  145    H2*    U  14           H2*        U  14  12.814  16.330  15.622
  146   2HO*    U  14          2HO*        U  14  10.814  14.411  14.996
  147    H1*    U  14           H1*        U  14  10.330  16.727  13.917
  148    H3     U  14           H3         U  14  13.310  16.484  10.440
  149    H5     U  14           H5         U  14  14.997  19.382  12.957
  150    H6     U  14           H6         U  14  13.190  18.967  14.568
  151   1H5*    G  15          1H5*        G  15   6.228  14.162  16.663
  152   2H5*    G  15          2H5*        G  15   7.061  15.218  15.507
  153    H4*    G  15           H4*        G  15   4.820  16.182  17.299
  154    H3*    G  15           H3*        G  15   4.633  15.181  14.437
  155    H2*    G  15           H2*        G  15   2.526  16.370  14.470
  156   2HO*    G  15          2HO*        G  15   2.027  15.860  16.777
  157    H1*    G  15           H1*        G  15   3.751  18.546  15.655
  158    H8     G  15           H8         G  15   6.411  17.473  13.287
  159    H1     G  15           H1         G  15   1.323  19.968  10.262
  160   1H2     G  15          1H2         G  15  -0.409  19.865  11.550
  161   2H2     G  15          2H2         G  15  -0.272  19.509  13.260
  162   1H5*    G  16          1H5*        G  16   0.790  14.223  15.956
  163   2H5*    G  16          2H5*        G  16   0.337  12.592  15.452
  164    H4*    G  16           H4*        G  16  -1.432  14.120  14.906
  165    H3*    G  16           H3*        G  16   0.059  13.242  12.414
  166    H2*    G  16           H2*        G  16  -1.794  14.271  11.230
  167   2HO*    G  16          2HO*        G  16  -3.422  13.606  12.918
  168    H1*    G  16           H1*        G  16  -1.720  16.536  12.737
  169    H8     G  16           H8         G  16   1.920  15.619  12.558
  170    H1     G  16           H1         G  16  -0.363  17.490   6.873
  171   1H2     G  16          1H2         G  16  -2.519  17.778   6.962
  172   2H2     G  16          2H2         G  16  -3.440  17.299   8.374
  173   1H5*    G  17          1H5*        G  17  -3.712  12.142  11.182
  174   2H5*    G  17          2H5*        G  17  -3.656  10.596  10.326
  175    H4*    G  17           H4*        G  17  -4.505  12.436   8.932
  176    H3*    G  17           H3*        G  17  -1.872  11.277   7.981
  177    H2*    G  17           H2*        G  17  -2.237  12.700   6.002
  178   2HO*    G  17          2HO*        G  17  -4.640  12.417   6.165
  179    H1*    G  17           H1*        G  17  -2.625  14.912   7.425
  180    H8     G  17           H8         G  17  -0.439  13.162   9.875
  181    H1     G  17           H1         G  17   2.742  15.543   4.825
  182   1H2     G  17          1H2         G  17   1.345  16.108   3.258
  183   2H2     G  17          2H2         G  17  -0.364  15.710   3.362
  184   1H5*    C  18          1H5*        C  18  -3.633  10.984   4.433
  185   2H5*    C  18          2H5*        C  18  -3.406   9.409   3.653
  186    H4*    C  18           H4*        C  18  -2.416  11.141   2.286
  187    H3*    C  18           H3*        C  18  -0.241   9.575   3.695
  188    H2*    C  18           H2*        C  18   1.309  10.817   2.193
  189   2HO*    C  18          2HO*        C  18   0.211  11.326   0.297
  190    H1*    C  18           H1*        C  18   0.309  13.113   2.963
  191   1H4     C  18          1H4         C  18   4.319  11.601   7.660
  192   2H4     C  18          2H4         C  18   2.965  11.074   8.627
  193    H5     C  18           H5         C  18   0.713  10.993   7.805
  194    H6     C  18           H6         C  18  -0.680  11.309   5.833
  195   1H5*    C  19          1H5*        C  19   1.183   9.508  -0.004
  196   2H5*    C  19          2H5*        C  19   1.690   7.891  -0.517
  197    H4*    C  19           H4*        C  19   3.464   9.509  -0.881
  198    H3*    C  19           H3*        C  19   4.079   7.508   1.332
  199    H2*    C  19           H2*        C  19   6.330   8.372   1.190
  200   2HO*    C  19          2HO*        C  19   5.974   8.730  -1.259
  201    H1*    C  19           H1*        C  19   5.562  10.983   1.206
  202   1H4     C  19          1H4         C  19   6.300   9.119   7.283
  203   2H4     C  19          2H4         C  19   4.629   8.609   7.352
  204    H5     C  19           H5         C  19   3.172   8.612   5.452
  205    H6     C  19           H6         C  19   2.991   9.221   3.088
  206   1H5*    U  20          1H5*        U  20   7.314   7.147  -1.005
  207   2H5*    U  20          2H5*        U  20   7.685   5.468  -1.395
  208    H4*    U  20           H4*        U  20   9.618   6.501  -0.442
  209    H3*    U  20           H3*        U  20   8.307   4.591   1.529
  210    H2*    U  20           H2*        U  20  10.434   4.733   2.667
  211   2HO*    U  20          2HO*        U  20  11.774   4.893   0.686
  212    H1*    U  20           H1*        U  20  10.462   7.462   2.448
  213    H3     U  20           H3         U  20   9.415   6.375   6.787
  214    H5     U  20           H5         U  20   5.760   6.142   4.771
  215    H6     U  20           H6         U  20   6.965   6.461   2.651
  216   1H5*    G  21          1H5*        G  21  12.061   2.901   0.623
  217   2H5*    G  21          2H5*        G  21  11.984   1.138   0.591
  218    H4*    G  21           H4*        G  21  13.711   1.925   2.099
  219    H3*    G  21           H3*        G  21  11.397   0.700   3.642
  220    H2*    G  21           H2*        G  21  12.969   0.757   5.503
  221   2HO*    G  21          2HO*        G  21  14.910   0.429   3.981
  222    H1*    G  21           H1*        G  21  13.591   3.356   5.029
  223    H8     G  21           H8         G  21   9.955   3.005   3.945
  224    H1     G  21           H1         G  21  10.751   3.098  10.332
  225   1H2     G  21          1H2         G  21  12.836   2.828  10.823
  226   2H2     G  21          2H2         G  21  14.082   2.776   9.591
  227   1H5*    G  22          1H5*        G  22  14.743  -1.343   4.718
  228   2H5*    G  22          2H5*        G  22  14.539  -3.090   4.756
  229    H4*    G  22           H4*        G  22  15.547  -2.275   6.811
  230    H3*    G  22           H3*        G  22  12.734  -3.353   7.208
  231    H2*    G  22           H2*        G  22  13.119  -3.085   9.549
  232   2HO*    G  22          2HO*        G  22  15.386  -3.800   9.492
  233    H1*    G  22           H1*        G  22  14.279  -0.614   9.335
  234    H8     G  22           H8         G  22  11.548  -0.560   6.723
  235    H1     G  22           H1         G  22   9.312  -0.132  12.747
  236   1H2     G  22          1H2         G  22  10.856  -0.659  14.153
  237   2H2     G  22          2H2         G  22  12.499  -1.009  13.648
  238   1H5*    U  23          1H5*        U  23  12.483  -7.523   9.674
  239   2H5*    U  23          2H5*        U  23  11.521  -6.111   9.177
  240    H4*    U  23           H4*        U  23  13.144  -6.283  11.737
  241    H3*    U  23           H3*        U  23  10.182  -6.492  11.078
  242    H2*    U  23           H2*        U  23   9.780  -5.833  13.336
  243   2HO*    U  23          2HO*        U  23  11.755  -6.926  14.224
  244    H1*    U  23           H1*        U  23  11.475  -3.711  13.100
  245    H3     U  23           H3         U  23   6.922  -2.656  12.641
  246    H5     U  23           H5         U  23   8.405  -3.064   8.753
  247    H6     U  23           H6         U  23  10.533  -3.860   9.698
  248   1H5*    U  24          1H5*        U  24   9.985  -8.435  14.100
  249   2H5*    U  24          2H5*        U  24   9.336 -10.072  14.094
  250    H4*    U  24           H4*        U  24   8.055  -8.712  15.602
  251    H3*    U  24           H3*        U  24   6.562  -9.211  13.028
  252    H2*    U  24           H2*        U  24   4.623  -8.402  14.106
  253   2HO*    U  24          2HO*        U  24   5.073  -9.344  16.256
  254    H1*    U  24           H1*        U  24   5.979  -6.254  15.186
  255    H3     U  24           H3         U  24   3.241  -4.867  11.707
  256    H5     U  24           H5         U  24   6.812  -6.048   9.860
  257    H6     U  24           H6         U  24   7.624  -6.840  12.039
  258   1H5*    A  25          1H5*        A  25   5.143 -13.279  11.816
  259   2H5*    A  25          2H5*        A  25   6.854 -13.553  11.502
  260    H4*    A  25           H4*        A  25   5.798 -13.126   9.406
  261    H3*    A  25           H3*        A  25   7.940 -11.455  10.102
  262    H2*    A  25           H2*        A  25   6.429  -9.660  10.772
  263   2HO*    A  25          2HO*        A  25   7.925  -8.789   9.264
  264    H1*    A  25           H1*        A  25   5.003 -10.545   8.221
  265    H8     A  25           H8         A  25   3.660  -9.434  11.734
  266   1H6     A  25          1H6         A  25   0.598  -5.097   8.461
  267   2H6     A  25          2H6         A  25   0.647  -5.944   9.995
  268    H2     A  25           H2         A  25   3.378  -7.240   5.717
  269   1H5*    G  26          1H5*        G  26   7.784 -14.510   5.065
  270   2H5*    G  26          2H5*        G  26   7.740 -12.779   4.805
  271    H4*    G  26           H4*        G  26   5.829 -13.445   6.880
  272    H3*    G  26           H3*        G  26   6.007 -15.697   5.228
  273    H2*    G  26           H2*        G  26   5.783 -14.243   3.358
  274   2HO*    G  26          2HO*        G  26   3.325 -15.611   3.875
  275    H1*    G  26           H1*        G  26   3.352 -13.207   4.879
  276    H8     G  26           H8         G  26   5.326 -13.019   1.636
  277    H1     G  26           H1         G  26   0.860  -8.464   2.298
  278   1H2     G  26          1H2         G  26   0.294  -8.308   4.374
  279   2H2     G  26          2H2         G  26   0.771  -9.502   5.571
  280   1H5*    U  27          1H5*        U  27   4.780 -16.144   8.494
  281   2H5*    U  27          2H5*        U  27   4.040 -17.720   8.829
  282    H4*    U  27           H4*        U  27   3.853 -16.703  10.891
  283    H3*    U  27           H3*        U  27   1.267 -15.945   9.467
  284    H2*    U  27           H2*        U  27   0.675 -14.624  11.364
  285   2HO*    U  27          2HO*        U  27   1.851 -16.295  12.836
  286    H1*    U  27           H1*        U  27   3.051 -13.377  11.649
  287    H3     U  27           H3         U  27   0.214 -10.501   9.414
  288    H5     U  27           H5         U  27   2.775 -12.152   6.573
  289    H6     U  27           H6         U  27   3.387 -13.882   8.192
  290   1H5*    A  28          1H5*        A  28  -0.318 -16.141  13.105
  291   2H5*    A  28          2H5*        A  28  -1.561 -17.391  13.134
  292    H4*    A  28           H4*        A  28  -2.531 -15.314  13.875
  293    H3*    A  28           H3*        A  28  -3.447 -16.059  11.068
  294    H2*    A  28           H2*        A  28  -4.956 -14.178  11.255
  295   2HO*    A  28          2HO*        A  28  -5.294 -14.593  13.656
  296    H1*    A  28           H1*        A  28  -3.066 -12.495  12.258
  297    H8     A  28           H8         A  28  -0.896 -14.308   9.876
  298   1H6     A  28          1H6         A  28  -3.377 -10.687   5.457
  299   2H6     A  28          2H6         A  28  -2.087 -11.822   5.814
  300    H2     A  28           H2         A  28  -6.227 -10.873   8.846
  301   1H5*    C  29          1H5*        C  29  -7.019 -15.448  12.282
  302   2H5*    C  29          2H5*        C  29  -8.172 -16.724  11.865
  303    H4*    C  29           H4*        C  29  -8.759 -14.669  10.722
  304    H3*    C  29           H3*        C  29  -7.629 -16.746   8.830
  305    H2*    C  29           H2*        C  29  -8.268 -15.196   7.048
  306   2HO*    C  29          2HO*        C  29 -10.262 -14.465   8.269
  307    H1*    C  29           H1*        C  29  -7.186 -13.054   8.219
  308   1H4     C  29          1H4         C  29  -2.471 -15.749   4.863
  309   2H4     C  29          2H4         C  29  -1.908 -16.552   6.310
  310    H5     C  29           H5         C  29  -3.114 -16.536   8.377
  311    H6     C  29           H6         C  29  -5.113 -15.691   9.499
  312   1H5*    C  30          1H5*        C  30 -11.284 -15.928   7.044
  313   2H5*    C  30          2H5*        C  30 -12.102 -17.392   6.483
  314    H4*    C  30           H4*        C  30 -11.698 -15.820   4.645
  315    H3*    C  30           H3*        C  30  -9.974 -18.308   4.444
  316    H2*    C  30           H2*        C  30  -9.465 -17.500   2.207
  317   2HO*    C  30          2HO*        C  30 -11.740 -16.503   2.014
  318    H1*    C  30           H1*        C  30  -8.988 -14.959   3.100
  319   1H4     C  30          1H4         C  30  -3.579 -18.370   3.154
  320   2H4     C  30          2H4         C  30  -3.875 -18.856   4.809
  321    H5     C  30           H5         C  30  -5.879 -18.289   6.009
  322    H6     C  30           H6         C  30  -8.042 -17.150   5.833
  323   1H5*    U  31          1H5*        U  31 -12.178 -17.940   0.769
  324   2H5*    U  31          2H5*        U  31 -13.059 -19.422   0.399
  325    H4*    U  31           H4*        U  31 -12.054 -18.523  -1.604
  326    H3*    U  31           H3*        U  31 -10.679 -21.060  -0.699
  327    H2*    U  31           H2*        U  31  -9.525 -21.000  -2.800
  328   2HO*    U  31          2HO*        U  31 -11.478 -20.135  -3.977
  329    H1*    U  31           H1*        U  31  -8.948 -18.329  -2.651
  330    H3     U  31           H3         U  31  -5.020 -20.610  -1.780
  331    H5     U  31           H5         U  31  -6.900 -20.160   1.941
  332    H6     U  31           H6         U  31  -8.932 -19.437   0.776
  333   1H5*    C  32          1H5*        C  32 -11.879 -22.331  -4.257
  334   2H5*    C  32          2H5*        C  32 -12.551 -23.965  -4.272
  335    H4*    C  32           H4*        C  32 -10.543 -23.877  -5.632
  336    H3*    C  32           H3*        C  32 -10.040 -25.369  -3.036
  337    H2*    C  32           H2*        C  32  -7.854 -25.855  -3.940
  338   2HO*    C  32          2HO*        C  32  -8.866 -26.013  -6.230
  339    H1*    C  32           H1*        C  32  -7.441 -23.313  -4.922
  340   1H4     C  32          1H4         C  32  -4.811 -23.853   0.870
  341   2H4     C  32          2H4         C  32  -6.353 -23.565   1.643
  342    H5     C  32           H5         C  32  -8.393 -23.238   0.425
  343    H6     C  32           H6         C  32  -9.382 -23.198  -1.816
  344   1H5*    U  33          1H5*        U  33  -8.145 -27.837  -5.247
  345   2H5*    U  33          2H5*        U  33  -8.777 -29.484  -5.204
  346    H4*    U  33           H4*        U  33  -6.427 -29.584  -4.639
  347    H3*    U  33           H3*        U  33  -8.193 -29.852  -2.185
  348    H2*    U  33           H2*        U  33  -6.338 -30.208  -0.918
  349   2HO*    U  33          2HO*        U  33  -4.419 -30.581  -3.020
  350    H1*    U  33           H1*        U  33  -4.640 -28.511  -2.415
  351    H3     U  33           H3         U  33  -4.544 -27.014   1.902
  352    H5     U  33           H5         U  33  -8.529 -26.415   0.783
  353    H6     U  33           H6         U  33  -8.010 -27.395  -1.409
  354   1H5*    U  34          1H5*        U  34  -8.098 -35.492  -1.720
  355   2H5*    U  34          2H5*        U  34  -7.369 -34.565  -0.404
  356    H4*    U  34           H4*        U  34  -6.146 -36.634  -0.825
  357    H3*    U  34           H3*        U  34  -4.836 -34.259  -0.414
  358    H2*    U  34           H2*        U  34  -4.621 -33.758  -2.750
  359   2HO*    U  34          2HO*        U  34  -2.286 -35.160  -1.883
  360    H1*    U  34           H1*        U  34  -3.800 -36.662  -3.146
  361    H3     U  34           H3         U  34  -2.958 -35.933  -7.522
  362    H5     U  34           H5         U  34  -6.397 -33.636  -6.890
  363    H6     U  34           H6         U  34  -6.356 -34.318  -4.532
  364   1H5*    C  35          1H5*        C  35  -1.348 -34.352   0.194
  365   2H5*    C  35          2H5*        C  35  -0.914 -35.287   1.626
  366    H4*    C  35           H4*        C  35   0.022 -33.048   1.692
  367    H3*    C  35           H3*        C  35  -1.079 -34.217   3.902
  368    H2*    C  35           H2*        C  35  -3.259 -33.299   3.522
  369   2HO*    C  35          2HO*        C  35  -1.803 -31.602   5.286
  370    H1*    C  35           H1*        C  35  -2.016 -30.585   2.964
  371   1H4     C  35          1H4         C  35  -8.266 -29.872   1.866
  372   2H4     C  35          2H4         C  35  -8.233 -31.130   0.642
  373    H5     C  35           H5         C  35  -6.302 -32.460   0.218
  374    H6     C  35           H6         C  35  -3.916 -32.704   0.665
  375   1H5*    G  36          1H5*        G  36   3.289 -30.802   3.878
  376   2H5*    G  36          2H5*        G  36   1.715 -30.879   3.070
  377    H4*    G  36           H4*        G  36   4.279 -32.147   2.030
  378    H3*    G  36           H3*        G  36   2.679 -29.707   1.163
  379    H2*    G  36           H2*        G  36   3.437 -30.145  -1.040
  380   2HO*    G  36          2HO*        G  36   5.712 -30.627  -0.048
  381    H1*    G  36           H1*        G  36   3.579 -32.959  -0.654
  382    H8     G  36           H8         G  36   2.222 -33.370  -2.868
  383    H1     G  36           H1         G  36  -2.496 -29.371  -1.063
  384   1H2     G  36          1H2         G  36  -2.033 -28.448   0.806
  385   2H2     G  36          2H2         G  36  -0.530 -28.738   1.653
  386   1H5*    G  37          1H5*        G  37   5.145 -28.531  -0.875
  387   2H5*    G  37          2H5*        G  37   5.556 -26.818  -0.868
  388    H4*    G  37           H4*        G  37   4.213 -27.710  -2.858
  389    H3*    G  37           H3*        G  37   3.072 -25.378  -1.274
  390    H2*    G  37           H2*        G  37   1.480 -25.270  -3.155
  391   2HO*    G  37          2HO*        G  37   3.230 -26.135  -4.729
  392    H1*    G  37           H1*        G  37   0.921 -27.898  -3.037
  393    H8     G  37           H8         G  37   1.745 -26.735   0.526
  394    H1     G  37           H1         G  37  -3.956 -24.699  -1.624
  395   1H2     G  37          1H2         G  37  -4.161 -25.166  -3.722
  396   2H2     G  37          2H2         G  37  -2.993 -26.155  -4.574
  397   1H5*    U  38          1H5*        U  38   2.437 -24.261  -5.061
  398   2H5*    U  38          2H5*        U  38   3.072 -22.692  -5.526
  399    H4*    U  38           H4*        U  38   0.742 -22.916  -6.155
  400    H3*    U  38           H3*        U  38   1.133 -20.932  -3.936
  401    H2*    U  38           H2*        U  38  -1.118 -20.213  -4.379
  402   2HO*    U  38          2HO*        U  38  -1.126 -20.487  -6.705
  403    H1*    U  38           H1*        U  38  -2.077 -22.765  -4.348
  404    H3     U  38           H3         U  38  -3.149 -21.157  -0.180
  405    H5     U  38           H5         U  38   0.792 -22.500   0.199
  406    H6     U  38           H6         U  38   0.862 -22.823  -2.226
  407   1H5*    G  39          1H5*        G  39  -0.016 -18.552  -7.113
  408   2H5*    G  39          2H5*        G  39   0.807 -16.996  -7.078
  409    H4*    G  39           H4*        G  39  -1.574 -16.702  -7.101
  410    H3*    G  39           H3*        G  39  -0.492 -15.980  -4.370
  411    H2*    G  39           H2*        G  39  -2.762 -15.169  -3.965
  412   2HO*    G  39          2HO*        G  39  -3.030 -14.541  -6.360
  413    H1*    G  39           H1*        G  39  -3.891 -17.450  -4.868
  414    H8     G  39           H8         G  39  -0.488 -18.347  -3.330
  415    H1     G  39           H1         G  39  -5.126 -17.249   0.982
  416   1H2     G  39          1H2         G  39  -6.810 -16.302   0.017
  417   2H2     G  39          2H2         G  39  -6.908 -16.127  -1.722
  418   1H5*    G  40          1H5*        G  40  -2.740 -12.779  -5.544
  419   2H5*    G  40          2H5*        G  40  -2.065 -11.222  -5.030
  420    H4*    G  40           H4*        G  40  -4.381 -11.448  -4.356
  421    H3*    G  40           H3*        G  40  -2.320 -11.303  -2.128
  422    H2*    G  40           H2*        G  40  -4.256 -11.103  -0.649
  423   2HO*    G  40          2HO*        G  40  -5.488  -9.820  -2.394
  424    H1*    G  40           H1*        G  40  -5.629 -13.124  -1.794
  425    H8     G  40           H8         G  40  -2.073 -14.326  -2.064
  426    H1     G  40           H1         G  40  -4.280 -14.386   3.971
  427   1H2     G  40          1H2         G  40  -6.114 -13.258   4.108
  428   2H2     G  40          2H2         G  40  -6.843 -12.497   2.707
  429   1H5*    G  41          1H5*        G  41  -4.653  -8.890  -0.467
  430   2H5*    G  41          2H5*        G  41  -3.892  -7.365  -0.013
  431    H4*    G  41           H4*        G  41  -4.623  -8.444   2.006
  432    H3*    G  41           H3*        G  41  -1.624  -8.735   1.642
  433    H2*    G  41           H2*        G  41  -1.638  -9.539   3.954
  434   2HO*    G  41          2HO*        G  41  -3.425  -8.272   4.777
  435    H1*    G  41           H1*        G  41  -3.543 -11.350   3.408
  436    H8     G  41           H8         G  41  -1.796 -10.916   0.060
  437    H1     G  41           H1         G  41   1.326 -14.780   4.142
  438   1H2     G  41          1H2         G  41   0.589 -14.543   6.133
  439   2H2     G  41          2H2         G  41  -0.727 -13.458   6.542
  440   1H5*    A  42          1H5*        A  42  -0.555  -4.848   5.245
  441   2H5*    A  42          2H5*        A  42  -0.347  -6.215   6.348
  442    H4*    A  42           H4*        A  42  -2.970  -5.273   5.122
  443    H3*    A  42           H3*        A  42  -1.857  -5.448   7.938
  444    H2*    A  42           H2*        A  42  -4.105  -5.829   8.737
  445   2HO*    A  42          2HO*        A  42  -5.066  -4.404   6.949
  446    H1*    A  42           H1*        A  42  -4.598  -7.806   7.001
  447    H8     A  42           H8         A  42  -1.068  -8.588   7.053
  448   1H6     A  42          1H6         A  42  -1.649 -10.558  12.932
  449   2H6     A  42          2H6         A  42  -0.658 -10.639  11.492
  450    H2     A  42           H2         A  42  -5.295  -8.260  11.902
  451   1H5*    A  43          1H5*        A  43  -4.615  -2.979   8.411
  452   2H5*    A  43          2H5*        A  43  -4.630  -1.401   9.163
  453    H4*    A  43           H4*        A  43  -5.954  -2.904  10.508
  454    H3*    A  43           H3*        A  43  -3.261  -2.384  11.831
  455    H2*    A  43           H2*        A  43  -3.976  -3.833  13.623
  456   2HO*    A  43          2HO*        A  43  -6.304  -2.967  13.361
  457    H1*    A  43           H1*        A  43  -5.056  -5.763  11.970
  458    H8     A  43           H8         A  43  -2.066  -4.875  10.011
  459   1H6     A  43          1H6         A  43   1.232  -8.459  13.842
  460   2H6     A  43          2H6         A  43   1.190  -7.723  12.251
  461    H2     A  43           H2         A  43  -2.623  -7.518  15.837
  462   1H5*    U  44          1H5*        U  44  -5.195  -1.887  15.074
  463   2H5*    U  44          2H5*        U  44  -4.785  -0.386  15.924
  464    H4*    U  44           H4*        U  44  -4.022  -2.269  17.240
  465    H3*    U  44           H3*        U  44  -1.729  -0.840  15.855
  466    H2*    U  44           H2*        U  44  -0.278  -2.214  17.187
  467   2HO*    U  44          2HO*        U  44  -1.887  -2.143  19.081
  468    H1*    U  44           H1*        U  44  -1.676  -4.510  16.717
  469    H3     U  44           H3         U  44   2.064  -4.912  14.082
  470    H5     U  44           H5         U  44  -0.489  -2.448  11.863
  471    H6     U  44           H6         U  44  -1.955  -2.297  13.818
  472   1H5*    A  45          1H5*        A  45  -0.575  -0.749  19.786
  473   2H5*    A  45          2H5*        A  45   0.208   0.770  20.232
  474    H4*    A  45           H4*        A  45   1.696  -1.125  20.587
  475    H3*    A  45           H3*        A  45   2.603   0.625  18.268
  476    H2*    A  45           H2*        A  45   4.646  -0.658  18.392
  477   2HO*    A  45          2HO*        A  45   4.424  -0.932  20.847
  478    H1*    A  45           H1*        A  45   3.331  -3.031  18.420
  479    H8     A  45           H8         A  45   1.142  -0.650  16.399
  480   1H6     A  45          1H6         A  45   4.782  -2.037  11.545
  481   2H6     A  45          2H6         A  45   3.254  -1.332  12.036
  482    H2     A  45           H2         A  45   6.687  -3.666  15.196
  483   1H5*    C  46          1H5*        C  46   5.732   0.500  20.900
  484   2H5*    C  46          2H5*        C  46   6.462   2.086  21.154
  485    H4*    C  46           H4*        C  46   8.133   0.457  20.492
  486    H3*    C  46           H3*        C  46   7.583   2.506  18.309
  487    H2*    C  46           H2*        C  46   9.615   1.653  17.333
  488   2HO*    C  46          2HO*        C  46  10.644   1.268  19.526
  489    H1*    C  46           H1*        C  46   8.878  -0.961  17.741
  490   1H4     C  46          1H4         C  46   6.801   0.623  11.925
  491   2H4     C  46          2H4         C  46   5.257   1.109  12.591
  492    H5     C  46           H5         C  46   4.820   1.226  14.951
  493    H6     C  46           H6         C  46   5.779   0.844  17.176
  494   1H5*    C  47          1H5*        C  47  11.599   2.993  19.268
  495   2H5*    C  47          2H5*        C  47  12.043   4.702  19.318
  496    H4*    C  47           H4*        C  47  13.466   3.475  17.773
  497    H3*    C  47           H3*        C  47  11.540   5.337  16.348
  498    H2*    C  47           H2*        C  47  12.971   4.943  14.428
  499   2HO*    C  47          2HO*        C  47  15.009   4.826  15.707
  500    H1*    C  47           H1*        C  47  13.043   2.234  14.885
  501   1H4     C  47          1H4         C  47   8.206   3.349  10.878
  502   2H4     C  47          2H4         C  47   7.130   3.668  12.219
  503    H5     C  47           H5         C  47   7.854   3.730  14.507
  504    H6     C  47           H6         C  47   9.792   3.481  15.990
  505   1H5*    A  48          1H5*        A  48  15.501   6.729  15.481
  506   2H5*    A  48          2H5*        A  48  15.555   8.492  15.431
  507    H4*    A  48           H4*        A  48  16.469   7.519  13.391
  508    H3*    A  48           H3*        A  48  13.814   8.908  12.919
  509    H2*    A  48           H2*        A  48  14.386   8.672  10.561
  510   2HO*    A  48          2HO*        A  48  16.807   8.880  11.023
  511    H1*    A  48           H1*        A  48  14.969   6.039  10.854
  512    H8     A  48           H8         A  48  12.264   6.727  13.431
  513   1H6     A  48          1H6         A  48   8.172   6.311   8.762
  514   2H6     A  48          2H6         A  48   8.363   6.422  10.500
  515    H2     A  48           H2         A  48  12.251   6.376   7.010
  516   1H5*    G  49          1H5*        G  49  16.549  10.703  10.383
  517   2H5*    G  49          2H5*        G  49  16.413  12.457  10.304
  518    H4*    G  49           H4*        G  49  16.409  11.454   8.083
  519    H3*    G  49           H3*        G  49  13.719  12.670   8.809
  520    H2*    G  49           H2*        G  49  13.178  12.258   6.458
  521   2HO*    G  49          2HO*        G  49  15.602  12.611   5.854
  522    H1*    G  49           H1*        G  49  14.079   9.711   6.519
  523    H8     G  49           H8         G  49  12.769  10.123  10.024
  524    H1     G  49           H1         G  49   8.100   9.715   5.620
  525   1H2     G  49          1H2         G  49   8.897  10.131   3.657
  526   2H2     G  49          2H2         G  49  10.620  10.272   3.369
  527   1H5*    G  50          1H5*        G  50  14.544  14.124   5.117
  528   2H5*    G  50          2H5*        G  50  14.385  15.867   4.967
  529    H4*    G  50           H4*        G  50  13.163  14.693   3.205
  530    H3*    G  50           H3*        G  50  11.370  16.145   5.182
  531    H2*    G  50           H2*        G  50   9.558  15.585   3.633
  532   2HO*    G  50          2HO*        G  50  11.190  15.767   1.723
  533    H1*    G  50           H1*        G  50  10.348  12.995   3.325
  534    H8     G  50           H8         G  50  11.187  13.438   6.933
  535    H1     G  50           H1         G  50   4.871  12.863   5.826
  536   1H2     G  50          1H2         G  50   4.469  13.092   3.732
  537   2H2     G  50          2H2         G  50   5.703  13.589   2.593
  538   1H5*    U  51          1H5*        U  51  10.134  17.358   1.517
  539   2H5*    U  51          2H5*        U  51  10.255  19.084   1.187
  540    H4*    U  51           H4*        U  51   8.059  18.243   0.552
  541    H3*    U  51           H3*        U  51   8.480  20.468   2.219
  542    H2*    U  51           H2*        U  51   7.771  19.523   4.144
  543   2HO*    U  51          2HO*        U  51   5.081  19.823   3.255
  544    H1*    U  51           H1*        U  51   5.705  17.802   2.779
  545    H3     U  51           H3         U  51   4.585  16.088   6.757
  546    H5     U  51           H5         U  51   8.687  16.792   7.229
  547    H6     U  51           H6         U  51   8.785  17.488   4.877
  548   1H5*    G  52          1H5*        G  52   7.527  22.444  -1.977
  549   2H5*    G  52          2H5*        G  52   5.920  22.623  -2.651
  550    H4*    G  52           H4*        G  52   7.289  19.963  -2.083
  551    H3*    G  52           H3*        G  52   6.583  21.507  -4.615
  552    H2*    G  52           H2*        G  52   6.555  19.392  -5.742
  553   2HO*    G  52          2HO*        G  52   8.395  18.553  -4.309
  554    H1*    G  52           H1*        G  52   5.080  18.201  -3.768
  555    H8     G  52           H8         G  52   3.780  21.760  -3.970
  556    H1     G  52           H1         G  52   1.431  17.815  -8.470
  557   1H2     G  52          1H2         G  52   2.735  16.110  -8.713
  558   2H2     G  52          2H2         G  52   4.100  15.821  -7.655
  559   1H5*    C  53          1H5*        C  53   9.462  18.886  -6.066
  560   2H5*    C  53          2H5*        C  53  10.550  19.686  -7.202
  561    H4*    C  53           H4*        C  53   9.512  17.728  -8.199
  562    H3*    C  53           H3*        C  53   8.457  20.297  -9.439
  563    H2*    C  53           H2*        C  53   7.512  18.810 -11.110
  564   2HO*    C  53          2HO*        C  53   9.423  17.254 -10.904
  565    H1*    C  53           H1*        C  53   6.509  17.094  -9.244
  566   1H4     C  53          1H4         C  53   1.870  21.338 -10.147
  567   2H4     C  53          2H4         C  53   2.540  22.369  -8.902
  568    H5     C  53           H5         C  53   4.687  21.994  -7.897
  569    H6     C  53           H6         C  53   6.560  20.423  -7.751
  570   1H5*    C  54          1H5*        C  54   9.931  18.076 -12.649
  571   2H5*    C  54          2H5*        C  54  10.810  19.082 -13.803
  572    H4*    C  54           H4*        C  54   9.038  17.827 -14.907
  573    H3*    C  54           H3*        C  54   8.441  20.802 -14.774
  574    H2*    C  54           H2*        C  54   6.672  20.287 -16.348
  575   2HO*    C  54          2HO*        C  54   8.033  18.510 -17.399
  576    H1*    C  54           H1*        C  54   5.816  18.119 -14.917
  577   1H4     C  54          1H4         C  54   2.466  23.041 -12.675
  578   2H4     C  54          2H4         C  54   3.699  23.359 -11.478
  579    H5     C  54           H5         C  54   5.822  22.243 -11.443
  580    H6     C  54           H6         C  54   7.165  20.492 -12.508
  581   1H5*    C  55          1H5*        C  55   8.236  19.901 -18.863
  582   2H5*    C  55          2H5*        C  55   9.062  21.133 -19.820
  583    H4*    C  55           H4*        C  55   6.765  20.843 -20.584
  584    H3*    C  55           H3*        C  55   7.264  23.495 -19.199
  585    H2*    C  55           H2*        C  55   5.089  24.129 -19.950
  586   2HO*    C  55          2HO*        C  55   5.363  23.039 -22.101
  587    H1*    C  55           H1*        C  55   3.928  21.683 -19.382
  588   1H4     C  55          1H4         C  55   2.858  25.647 -14.487
  589   2H4     C  55          2H4         C  55   4.419  25.260 -13.796
  590    H5     C  55           H5         C  55   6.013  23.819 -14.861
  591    H6     C  55           H6         C  55   6.447  22.463 -16.856
  592   1H    MET 104          1H        MET 104  10.207 -16.566   2.732
  593    HA   MET 104           HA       MET 104  11.011 -13.746   2.381
  594   1HB   MET 104          1HB       MET 104  12.945 -14.946   3.495
  595   2HB   MET 104          2HB       MET 104  13.045 -16.004   2.094
  596   1HG   MET 104          1HG       MET 104  14.323 -14.526   1.051
  597   2HG   MET 104          2HG       MET 104  13.067 -13.302   1.105
  598   1HE   MET 104          1HE       MET 104  13.204 -11.102   2.707
  599   2HE   MET 104          2HE       MET 104  12.612 -12.320   3.867
  600   3HE   MET 104          3HE       MET 104  13.938 -11.229   4.310
  601    H    TYR 105           H        TYR 105  10.685 -13.100   0.324
  602    HA   TYR 105           HA       TYR 105  10.054 -15.218  -1.709
  603   1HB   TYR 105          1HB       TYR 105   8.980 -12.413  -1.236
  604   2HB   TYR 105          2HB       TYR 105   8.756 -13.247  -2.773
  605    HD1  TYR 105           HD1      TYR 105   8.114 -13.791   0.998
  606    HD2  TYR 105           HD2      TYR 105   7.113 -14.865  -3.092
  607    HE1  TYR 105           HE1      TYR 105   6.445 -15.422   1.823
  608    HE2  TYR 105           HE2      TYR 105   5.319 -16.346  -2.234
  609    HH   TYR 105           HH       TYR 105   4.356 -17.298  -0.405
  610    H    VAL 106           H        VAL 106  11.417 -15.465  -3.348
  611    HA   VAL 106           HA       VAL 106  13.538 -13.380  -3.699
  612    HB   VAL 106           HB       VAL 106  13.557 -16.357  -4.316
  613   1HG1  VAL 106          1HG1      VAL 106  16.020 -16.138  -4.449
  614   2HG1  VAL 106          2HG1      VAL 106  15.224 -15.207  -5.707
  615   3HG1  VAL 106          3HG1      VAL 106  15.877 -14.378  -4.275
  616   1HG2  VAL 106          1HG2      VAL 106  13.436 -15.976  -1.908
  617   2HG2  VAL 106          2HG2      VAL 106  15.032 -16.572  -2.390
  618   3HG2  VAL 106          3HG2      VAL 106  14.804 -14.830  -2.017
  619    H    CYS 107           H        CYS 107  14.070 -12.544  -5.649
  620    HA   CYS 107           HA       CYS 107  12.356 -13.036  -7.970
  621   1HB   CYS 107          1HB       CYS 107  13.252 -10.763  -7.408
  622   2HB   CYS 107          2HB       CYS 107  14.889 -11.376  -7.650
  623    H    HIS 108           H        HIS 108  12.745 -14.440  -9.566
  624    HA   HIS 108           HA       HIS 108  15.368 -15.867  -9.553
  625   1HB   HIS 108          1HB       HIS 108  12.630 -16.793 -10.541
  626   2HB   HIS 108          2HB       HIS 108  14.121 -17.746 -10.605
  627    HD2  HIS 108           HD2      HIS 108  11.199 -17.853  -8.640
  628    HE1  HIS 108           HE1      HIS 108  14.137 -18.115  -5.547
  629    HE2  HIS 108           HE2      HIS 108  11.672 -18.450  -6.118
  630    H    PHE 109           H        PHE 109  14.589 -13.260 -10.959
  631    HA   PHE 109           HA       PHE 109  14.629 -13.754 -13.808
  632   1HB   PHE 109          1HB       PHE 109  14.215 -11.520 -12.429
  633   2HB   PHE 109          2HB       PHE 109  15.959 -11.342 -12.516
  634    HD1  PHE 109           HD1      PHE 109  17.062 -10.941 -14.673
  635    HD2  PHE 109           HD2      PHE 109  12.785 -11.197 -14.253
  636    HE1  PHE 109           HE1      PHE 109  16.757 -10.011 -16.997
  637    HE2  PHE 109           HE2      PHE 109  12.467 -10.296 -16.555
  638    HZ   PHE 109           HZ       PHE 109  14.450  -9.690 -17.920
  639    H    GLU 110           H        GLU 110  16.474 -13.580 -15.243
  640    HA   GLU 110           HA       GLU 110  18.482 -15.396 -14.584
  641   1HB   GLU 110          1HB       GLU 110  17.790 -14.708 -16.883
  642   2HB   GLU 110          2HB       GLU 110  18.663 -13.185 -16.692
  643   1HG   GLU 110          1HG       GLU 110  20.787 -14.434 -16.438
  644   2HG   GLU 110          2HG       GLU 110  19.916 -15.965 -16.513
  645    H    ASN 111           H        ASN 111  19.988 -15.249 -13.023
  646    HA   ASN 111           HA       ASN 111  21.958 -14.603 -11.993
  647   1HB   ASN 111          1HB       ASN 111  22.141 -12.290 -14.008
  648   2HB   ASN 111          2HB       ASN 111  23.399 -12.882 -12.968
  649   1HD2  ASN 111          1HD2      ASN 111  23.458 -12.691 -15.871
  650   2HD2  ASN 111          2HD2      ASN 111  23.774 -14.330 -16.421
  651    H    CYS 112           H        CYS 112  19.123 -13.272 -11.550
  652    HA   CYS 112           HA       CYS 112  19.841 -10.709 -10.303
  653   1HB   CYS 112          1HB       CYS 112  17.718 -10.973 -11.473
  654   2HB   CYS 112          2HB       CYS 112  17.191 -12.231 -10.329
  655    H    GLY 113           H        GLY 113  17.828 -13.356  -8.898
  656   1HA   GLY 113          1HA       GLY 113  17.979 -14.517  -6.907
  657   2HA   GLY 113          2HA       GLY 113  19.686 -14.041  -6.833
  658    H    LYS 114           H        LYS 114  17.504 -11.321  -7.011
  659    HA   LYS 114           HA       LYS 114  18.222 -10.416  -4.343
  660   1HB   LYS 114          1HB       LYS 114  17.527  -9.105  -6.509
  661   2HB   LYS 114          2HB       LYS 114  15.876  -9.300  -5.892
  662   1HG   LYS 114          1HG       LYS 114  16.425  -8.034  -3.896
  663   2HG   LYS 114          2HG       LYS 114  18.173  -8.141  -4.228
  664   1HD   LYS 114          1HD       LYS 114  17.928  -6.772  -6.246
  665   2HD   LYS 114          2HD       LYS 114  16.182  -6.771  -6.033
  666   1HE   LYS 114          1HE       LYS 114  16.991  -4.656  -5.425
  667   2HE   LYS 114          2HE       LYS 114  16.356  -5.467  -3.985
  668   1HZ   LYS 114          1HZ       LYS 114  19.247  -5.260  -4.686
  669   2HZ   LYS 114          2HZ       LYS 114  18.498  -4.372  -3.542
  670   3HZ   LYS 114          3HZ       LYS 114  18.658  -5.980  -3.340
  671    H    ALA 115           H        ALA 115  17.016 -10.331  -2.444
  672    HA   ALA 115           HA       ALA 115  14.564 -12.059  -2.412
  673   1HB   ALA 115          1HB       ALA 115  15.324 -12.877  -0.238
  674   2HB   ALA 115          2HB       ALA 115  16.542 -13.179  -1.482
  675   3HB   ALA 115          3HB       ALA 115  16.775 -11.846  -0.318
  676    H    PHE 116           H        PHE 116  12.794 -11.376  -1.328
  677    HA   PHE 116           HA       PHE 116  12.981  -8.791   0.184
  678   1HB   PHE 116          1HB       PHE 116  10.582  -9.645  -1.465
  679   2HB   PHE 116          2HB       PHE 116  10.953  -8.107  -0.767
  680    HD1  PHE 116           HD1      PHE 116  12.391  -6.480  -1.934
  681    HD2  PHE 116           HD2      PHE 116  11.922 -10.479  -3.474
  682    HE1  PHE 116           HE1      PHE 116  13.744  -5.892  -3.944
  683    HE2  PHE 116           HE2      PHE 116  13.278  -9.903  -5.436
  684    HZ   PHE 116           HZ       PHE 116  14.216  -7.657  -5.666
  685    H    LYS 117           H        LYS 117  11.418  -8.459   1.847
  686    HA   LYS 117           HA       LYS 117  10.813 -10.869   3.309
  687   1HB   LYS 117          1HB       LYS 117  10.620  -9.495   5.043
  688   2HB   LYS 117          2HB       LYS 117  11.294  -8.277   3.966
  689   1HG   LYS 117          1HG       LYS 117   9.080  -7.414   3.499
  690   2HG   LYS 117          2HG       LYS 117   8.399  -8.642   4.608
  691   1HD   LYS 117          1HD       LYS 117  10.259  -6.397   5.454
  692   2HD   LYS 117          2HD       LYS 117   8.497  -6.351   5.514
  693   1HE   LYS 117          1HE       LYS 117   8.881  -7.022   7.651
  694   2HE   LYS 117          2HE       LYS 117   8.696  -8.596   6.866
  695   1HZ   LYS 117          1HZ       LYS 117  11.333  -7.330   7.311
  696   2HZ   LYS 117          2HZ       LYS 117  10.604  -8.385   8.390
  697   3HZ   LYS 117          3HZ       LYS 117  11.025  -8.899   6.893
  698    H    LYS 118           H        LYS 118   8.877  -8.611   1.293
  699    HA   LYS 118           HA       LYS 118   6.559 -10.533   1.573
  700   1HB   LYS 118          1HB       LYS 118   6.385  -7.561   0.944
  701   2HB   LYS 118          2HB       LYS 118   5.043  -8.639   1.167
  702   1HG   LYS 118          1HG       LYS 118   7.020  -7.845   3.290
  703   2HG   LYS 118          2HG       LYS 118   5.477  -7.082   3.069
  704   1HD   LYS 118          1HD       LYS 118   4.262  -8.783   3.951
  705   2HD   LYS 118          2HD       LYS 118   5.371 -10.016   3.372
  706   1HE   LYS 118          1HE       LYS 118   4.998  -9.841   5.837
  707   2HE   LYS 118          2HE       LYS 118   6.649 -10.086   5.223
  708   1HZ   LYS 118          1HZ       LYS 118   6.678  -8.511   6.961
  709   2HZ   LYS 118          2HZ       LYS 118   6.846  -7.568   5.587
  710   3HZ   LYS 118          3HZ       LYS 118   5.423  -7.689   6.411
  711    H    HIS 119           H        HIS 119   5.405 -11.124  -0.271
  712    HA   HIS 119           HA       HIS 119   6.873 -11.251  -2.730
  713   1HB   HIS 119          1HB       HIS 119   4.815 -12.210  -3.683
  714   2HB   HIS 119          2HB       HIS 119   5.307 -12.948  -2.187
  715    HD1  HIS 119           HD1      HIS 119   2.566 -10.193  -2.964
  716    HD2  HIS 119           HD2      HIS 119   3.412 -13.805  -0.941
  717    HE1  HIS 119           HE1      HIS 119   0.374 -10.901  -1.748
  718    HE2  HIS 119           HE2      HIS 119   0.924 -13.071  -0.551
  719    H    ASN 120           H        ASN 120   4.505  -8.918  -1.502
  720    HA   ASN 120           HA       ASN 120   3.848  -7.708  -4.019
  721   1HB   ASN 120          1HB       ASN 120   3.663  -6.904  -1.107
  722   2HB   ASN 120          2HB       ASN 120   3.574  -5.623  -2.317
  723   1HD2  ASN 120          1HD2      ASN 120   1.532  -7.710  -0.601
  724   2HD2  ASN 120          2HD2      ASN 120   0.261  -7.774  -1.824
  725    H    GLN 121           H        GLN 121   6.662  -7.360  -1.841
  726    HA   GLN 121           HA       GLN 121   7.791  -5.052  -3.268
  727   1HB   GLN 121          1HB       GLN 121   9.309  -7.032  -1.587
  728   2HB   GLN 121          2HB       GLN 121   9.703  -5.347  -1.980
  729   1HG   GLN 121          1HG       GLN 121   7.954  -4.557  -0.473
  730   2HG   GLN 121          2HG       GLN 121   7.536  -6.238  -0.090
  731   1HE2  GLN 121          1HE2      GLN 121   9.600  -3.640   0.857
  732   2HE2  GLN 121          2HE2      GLN 121  10.618  -4.598   1.909
  733    H    LEU 122           H        LEU 122   8.181  -8.638  -3.307
  734    HA   LEU 122           HA       LEU 122  10.235  -8.786  -5.256
  735   1HB   LEU 122          1HB       LEU 122   9.565 -10.732  -3.983
  736   2HB   LEU 122          2HB       LEU 122   7.920 -10.638  -4.563
  737    HG   LEU 122           HG       LEU 122   8.561 -11.315  -6.801
  738   1HD1  LEU 122          1HD1      LEU 122  10.871 -10.344  -6.794
  739   2HD1  LEU 122          2HD1      LEU 122  11.331 -11.606  -5.617
  740   3HD1  LEU 122          3HD1      LEU 122  10.786 -12.034  -7.266
  741   1HD2  LEU 122          1HD2      LEU 122   9.770 -13.174  -4.684
  742   2HD2  LEU 122          2HD2      LEU 122   8.049 -13.092  -5.123
  743   3HD2  LEU 122          3HD2      LEU 122   9.259 -13.617  -6.313
  744    H    LYS 123           H        LYS 123   6.654  -8.877  -5.693
  745    HA   LYS 123           HA       LYS 123   6.568  -8.829  -8.499
  746   1HB   LYS 123          1HB       LYS 123   4.683  -9.103  -6.841
  747   2HB   LYS 123          2HB       LYS 123   4.645  -7.355  -6.635
  748   1HG   LYS 123          1HG       LYS 123   4.055  -7.065  -9.011
  749   2HG   LYS 123          2HG       LYS 123   4.189  -8.810  -9.281
  750   1HD   LYS 123          1HD       LYS 123   2.205  -7.468  -7.386
  751   2HD   LYS 123          2HD       LYS 123   1.830  -8.037  -9.019
  752   1HE   LYS 123          1HE       LYS 123   2.404 -10.362  -8.363
  753   2HE   LYS 123          2HE       LYS 123   2.803  -9.815  -6.733
  754   1HZ   LYS 123          1HZ       LYS 123   0.481  -9.106  -6.476
  755   2HZ   LYS 123          2HZ       LYS 123   0.112  -9.695  -7.960
  756   3HZ   LYS 123          3HZ       LYS 123   0.591 -10.713  -6.768
  757    H    VAL 124           H        VAL 124   6.825  -6.073  -6.202
  758    HA   VAL 124           HA       VAL 124   6.795  -3.956  -8.126
  759    HB   VAL 124           HB       VAL 124   7.960  -4.295  -5.361
  760   1HG1  VAL 124          1HG1      VAL 124   8.425  -1.869  -5.251
  761   2HG1  VAL 124          2HG1      VAL 124   9.560  -2.722  -6.293
  762   3HG1  VAL 124          3HG1      VAL 124   8.244  -1.768  -7.017
  763   1HG2  VAL 124          1HG2      VAL 124   5.463  -3.932  -6.023
  764   2HG2  VAL 124          2HG2      VAL 124   6.182  -3.020  -4.709
  765   3HG2  VAL 124          3HG2      VAL 124   6.019  -2.278  -6.337
  766    H    HIS 125           H        HIS 125   9.495  -5.973  -6.856
  767    HA   HIS 125           HA       HIS 125  11.565  -4.506  -8.131
  768   1HB   HIS 125          1HB       HIS 125  12.024  -5.970  -6.285
  769   2HB   HIS 125          2HB       HIS 125  11.392  -7.379  -7.137
  770    HD1  HIS 125           HD1      HIS 125  14.406  -4.972  -7.356
  771    HD2  HIS 125           HD2      HIS 125  12.959  -8.694  -8.704
  772    HE1  HIS 125           HE1      HIS 125  16.367  -6.126  -8.495
  773    H    GLN 126           H        GLN 126   9.763  -7.467  -9.166
  774    HA   GLN 126           HA       GLN 126  11.317  -7.920 -11.525
  775   1HB   GLN 126          1HB       GLN 126   8.488  -8.779 -10.759
  776   2HB   GLN 126          2HB       GLN 126   9.314  -9.262 -12.275
  777   1HG   GLN 126          1HG       GLN 126  11.307  -9.955 -10.843
  778   2HG   GLN 126          2HG       GLN 126  10.334  -9.719  -9.403
  779   1HE2  GLN 126          1HE2      GLN 126  11.695 -12.043 -10.095
  780   2HE2  GLN 126          2HE2      GLN 126  10.485 -13.321 -10.386
  781    H    PHE 127           H        PHE 127   8.510  -5.831 -10.916
  782    HA   PHE 127           HA       PHE 127   7.772  -5.220 -13.575
  783   1HB   PHE 127          1HB       PHE 127   6.382  -3.941 -12.565
  784   2HB   PHE 127          2HB       PHE 127   7.087  -4.358 -11.052
  785    HD1  PHE 127           HD1      PHE 127   7.049  -2.632  -9.647
  786    HD2  PHE 127           HD2      PHE 127   7.908  -1.710 -13.755
  787    HE1  PHE 127           HE1      PHE 127   7.589  -0.411  -8.950
  788    HE2  PHE 127           HE2      PHE 127   8.370   0.606 -13.144
  789    HZ   PHE 127           HZ       PHE 127   8.368   1.295 -10.716
  790    H    SER 128           H        SER 128  10.628  -4.252 -11.719
  791    HA   SER 128           HA       SER 128  11.459  -2.077 -13.462
  792   1HB   SER 128          1HB       SER 128  12.244  -2.511 -11.096
  793   2HB   SER 128          2HB       SER 128  13.234  -3.849 -11.730
  794    HG   SER 128           HG       SER 128  14.393  -1.849 -11.598
  795    H    HIS 129           H        HIS 129  12.331  -5.601 -13.274
  796    HA   HIS 129           HA       HIS 129  14.184  -5.567 -15.481
  797   1HB   HIS 129          1HB       HIS 129  12.449  -7.817 -14.382
  798   2HB   HIS 129          2HB       HIS 129  13.703  -7.992 -15.586
  799    HD1  HIS 129           HD1      HIS 129  16.312  -7.541 -14.683
  800    HD2  HIS 129           HD2      HIS 129  13.190  -8.589 -12.102
  801    HE1  HIS 129           HE1      HIS 129  17.379  -8.653 -12.630
  802    H    THR 130           H        THR 130  10.652  -6.059 -15.274
  803    HA   THR 130           HA       THR 130  10.375  -6.702 -18.124
  804    HB   THR 130           HB       THR 130   7.946  -6.560 -17.651
  805    HG1  THR 130           HG1      THR 130   8.831  -5.575 -15.200
  806   1HG2  THR 130          1HG2      THR 130   7.703  -8.399 -16.145
  807   2HG2  THR 130          2HG2      THR 130   9.296  -8.671 -16.900
  808   3HG2  THR 130          3HG2      THR 130   9.174  -8.030 -15.250
  809    H    GLN 131           H        GLN 131  10.556  -3.818 -16.225
  810    HA   GLN 131           HA       GLN 131  10.225  -1.599 -16.625
  811   1HB   GLN 131          1HB       GLN 131  11.698  -2.422 -18.729
  812   2HB   GLN 131          2HB       GLN 131  10.250  -1.957 -19.620
  813   1HG   GLN 131          1HG       GLN 131  11.182   0.136 -19.522
  814   2HG   GLN 131          2HG       GLN 131  10.487   0.204 -17.902
  815   1HE2  GLN 131          1HE2      GLN 131  12.335  -1.331 -16.305
  816   2HE2  GLN 131          2HE2      GLN 131  13.883  -0.542 -16.465
  817    H    GLN 132           H        GLN 132   7.849  -3.345 -16.423
  818    HA   GLN 132           HA       GLN 132   5.947  -1.323 -17.545
  819   1HB   GLN 132          1HB       GLN 132   4.256  -3.015 -17.936
  820   2HB   GLN 132          2HB       GLN 132   5.672  -3.247 -18.946
  821   1HG   GLN 132          1HG       GLN 132   4.881  -5.396 -18.359
  822   2HG   GLN 132          2HG       GLN 132   6.373  -5.121 -17.486
  823   1HE2  GLN 132          1HE2      GLN 132   6.322  -5.546 -15.326
  824   2HE2  GLN 132          2HE2      GLN 132   4.853  -5.658 -14.344
  825    H    LEU 133           H        LEU 133   3.984  -1.087 -16.246
  826    HA   LEU 133           HA       LEU 133   4.770  -1.278 -13.421
  827   1HB   LEU 133          1HB       LEU 133   2.788   0.410 -14.955
  828   2HB   LEU 133          2HB       LEU 133   2.746   0.393 -13.183
  829    HG   LEU 133           HG       LEU 133   5.372   0.908 -14.729
  830   1HD1  LEU 133          1HD1      LEU 133   3.387   2.960 -13.653
  831   2HD1  LEU 133          2HD1      LEU 133   4.989   3.298 -14.345
  832   3HD1  LEU 133          3HD1      LEU 133   3.707   2.632 -15.371
  833   1HD2  LEU 133          1HD2      LEU 133   6.142   1.872 -12.695
  834   2HD2  LEU 133          2HD2      LEU 133   4.565   1.655 -11.929
  835   3HD2  LEU 133          3HD2      LEU 133   5.562   0.242 -12.344
  836    HA   PRO 134           HA       PRO 134   2.027  -4.633 -12.782
  837   1HB   PRO 134          1HB       PRO 134   2.199  -4.585  -9.956
  838   2HB   PRO 134          2HB       PRO 134   3.302  -5.444 -11.078
  839   1HG   PRO 134          1HG       PRO 134   3.785  -3.045  -9.456
  840   2HG   PRO 134          2HG       PRO 134   4.941  -4.055 -10.333
  841   1HD   PRO 134          1HD       PRO 134   3.925  -1.465 -11.047
  842   2HD   PRO 134          2HD       PRO 134   5.004  -2.522 -11.956
  843    H    TYR 135           H        TYR 135   1.488  -1.677 -10.853
  844    HA   TYR 135           HA       TYR 135  -1.211  -2.634 -10.091
  845   1HB   TYR 135          1HB       TYR 135   0.380  -0.230  -9.080
  846   2HB   TYR 135          2HB       TYR 135  -1.101  -0.857  -8.396
  847    HD1  TYR 135           HD1      TYR 135  -1.175  -3.153  -7.405
  848    HD2  TYR 135           HD2      TYR 135   2.532  -1.211  -8.461
  849    HE1  TYR 135           HE1      TYR 135   0.130  -4.868  -6.097
  850    HE2  TYR 135           HE2      TYR 135   3.803  -2.803  -7.020
  851    HH   TYR 135           HH       TYR 135   3.685  -4.793  -5.841
  852    H    GLU 136           H        GLU 136  -2.500  -2.250 -11.884
  853    HA   GLU 136           HA       GLU 136  -2.444   0.479 -13.099
  854   1HB   GLU 136          1HB       GLU 136  -2.292  -1.322 -14.701
  855   2HB   GLU 136          2HB       GLU 136  -3.644  -2.186 -13.972
  856   1HG   GLU 136          1HG       GLU 136  -5.219  -0.488 -14.738
  857   2HG   GLU 136          2HG       GLU 136  -3.903   0.513 -15.361
  858    H    CYS 137           H        CYS 137  -4.208   1.837 -13.018
  859    HA   CYS 137           HA       CYS 137  -6.300   1.333 -11.040
  860   1HB   CYS 137          1HB       CYS 137  -5.443   3.581 -11.346
  861   2HB   CYS 137          2HB       CYS 137  -5.856   3.567 -13.049
  862    HA   PRO 138           HA       PRO 138  -8.699  -0.761 -14.176
  863   1HB   PRO 138          1HB       PRO 138 -10.401  -2.136 -12.576
  864   2HB   PRO 138          2HB       PRO 138  -8.638  -2.416 -12.490
  865   1HG   PRO 138          1HG       PRO 138 -10.319  -0.606 -10.706
  866   2HG   PRO 138          2HG       PRO 138  -9.154  -1.869 -10.202
  867   1HD   PRO 138          1HD       PRO 138  -8.496   0.811 -10.413
  868   2HD   PRO 138          2HD       PRO 138  -7.325  -0.516 -10.687
  869    H    HIS 139           H        HIS 139  -9.657   2.028 -12.647
  870    HA   HIS 139           HA       HIS 139 -12.525   1.926 -12.748
  871   1HB   HIS 139          1HB       HIS 139 -11.117   3.587 -11.467
  872   2HB   HIS 139          2HB       HIS 139 -10.735   4.380 -13.000
  873    HD2  HIS 139           HD2      HIS 139 -12.480   6.135 -13.865
  874    HE1  HIS 139           HE1      HIS 139 -15.764   5.209 -11.304
  875    HE2  HIS 139           HE2      HIS 139 -14.917   6.797 -13.107
  876    H    GLU 140           H        GLU 140 -14.006   2.760 -14.258
  877    HA   GLU 140           HA       GLU 140 -13.362   2.321 -17.022
  878   1HB   GLU 140          1HB       GLU 140 -15.623   2.040 -16.000
  879   2HB   GLU 140          2HB       GLU 140 -15.752   3.792 -15.805
  880   1HG   GLU 140          1HG       GLU 140 -15.599   4.071 -18.272
  881   2HG   GLU 140          2HG       GLU 140 -15.385   2.332 -18.462
  882    H    GLY 141           H        GLY 141 -12.301   3.618 -18.405
  883   1HA   GLY 141          1HA       GLY 141 -12.012   5.630 -19.630
  884   2HA   GLY 141          2HA       GLY 141 -12.788   6.542 -18.322
  885    H    CYS 142           H        CYS 142 -10.614   4.563 -16.769
  886    HA   CYS 142           HA       CYS 142  -8.488   6.668 -16.797
  887   1HB   CYS 142          1HB       CYS 142  -9.772   6.020 -14.639
  888   2HB   CYS 142          2HB       CYS 142  -8.879   4.503 -14.698
  889    H    ASP 143           H        ASP 143  -6.271   6.024 -16.844
  890    HA   ASP 143           HA       ASP 143  -5.677   3.205 -17.613
  891   1HB   ASP 143          1HB       ASP 143  -4.621   3.787 -19.638
  892   2HB   ASP 143          2HB       ASP 143  -6.168   4.610 -19.687
  893    H    LYS 144           H        LYS 144  -5.050   5.449 -15.419
  894    HA   LYS 144           HA       LYS 144  -2.171   5.819 -15.520
  895   1HB   LYS 144          1HB       LYS 144  -4.369   6.255 -13.489
  896   2HB   LYS 144          2HB       LYS 144  -2.737   6.052 -12.895
  897   1HG   LYS 144          1HG       LYS 144  -3.085   8.375 -13.062
  898   2HG   LYS 144          2HG       LYS 144  -1.913   7.891 -14.283
  899   1HD   LYS 144          1HD       LYS 144  -3.239   9.446 -15.417
  900   2HD   LYS 144          2HD       LYS 144  -3.901   7.907 -15.946
  901   1HE   LYS 144          1HE       LYS 144  -5.848   9.018 -15.457
  902   2HE   LYS 144          2HE       LYS 144  -5.557   8.225 -13.908
  903   1HZ   LYS 144          1HZ       LYS 144  -4.590  10.358 -13.104
  904   2HZ   LYS 144          2HZ       LYS 144  -4.894  11.064 -14.573
  905   3HZ   LYS 144          3HZ       LYS 144  -6.115  10.559 -13.630
  906    H    ARG 145           H        ARG 145  -0.521   4.696 -14.481
  907    HA   ARG 145           HA       ARG 145  -1.226   2.182 -13.007
  908   1HB   ARG 145          1HB       ARG 145   1.077   2.335 -14.998
  909   2HB   ARG 145          2HB       ARG 145   0.439   0.932 -14.089
  910   1HG   ARG 145          1HG       ARG 145  -1.634   1.001 -15.377
  911   2HG   ARG 145          2HG       ARG 145  -1.011   2.345 -16.356
  912   1HD   ARG 145          1HD       ARG 145   0.791   0.995 -17.216
  913   2HD   ARG 145          2HD       ARG 145   0.406  -0.335 -16.104
  914    HE   ARG 145           HE       ARG 145  -1.938  -0.183 -17.386
  915   1HH1  ARG 145          1HH1      ARG 145   1.231  -0.208 -18.922
  916   2HH1  ARG 145          2HH1      ARG 145   0.586  -1.001 -20.336
  917   1HH2  ARG 145          1HH2      ARG 145  -2.624  -1.137 -19.033
  918   2HH2  ARG 145          2HH2      ARG 145  -1.609  -1.525 -20.428
  919    H    PHE 146           H        PHE 146   0.331   1.496 -11.505
  920    HA   PHE 146           HA       PHE 146   2.192   3.674 -10.639
  921   1HB   PHE 146          1HB       PHE 146   0.334   2.055  -8.830
  922   2HB   PHE 146          2HB       PHE 146   1.371   3.366  -8.363
  923    HD1  PHE 146           HD1      PHE 146  -1.782   2.558 -10.127
  924    HD2  PHE 146           HD2      PHE 146   0.949   5.697  -8.961
  925    HE1  PHE 146           HE1      PHE 146  -3.435   4.225 -10.793
  926    HE2  PHE 146           HE2      PHE 146  -0.706   7.393  -9.715
  927    HZ   PHE 146           HZ       PHE 146  -2.852   6.665 -10.696
  928    H    SER 147           H        SER 147   3.827   3.059  -9.153
  929    HA   SER 147           HA       SER 147   4.998   0.504  -9.933
  930   1HB   SER 147          1HB       SER 147   6.855   1.476  -8.307
  931   2HB   SER 147          2HB       SER 147   6.550   2.244  -9.879
  932    HG   SER 147           HG       SER 147   6.094   3.988  -8.876
  933    H    LEU 148           H        LEU 148   3.261   1.791  -7.151
  934    HA   LEU 148           HA       LEU 148   3.771  -0.778  -5.695
  935   1HB   LEU 148          1HB       LEU 148   4.082   2.053  -4.716
  936   2HB   LEU 148          2HB       LEU 148   3.398   0.907  -3.608
  937    HG   LEU 148           HG       LEU 148   5.764   1.270  -3.219
  938   1HD1  LEU 148          1HD1      LEU 148   4.909  -0.832  -2.459
  939   2HD1  LEU 148          2HD1      LEU 148   4.961  -1.512  -4.102
  940   3HD1  LEU 148          3HD1      LEU 148   6.471  -1.188  -3.207
  941   1HD2  LEU 148          1HD2      LEU 148   6.437   1.522  -5.665
  942   2HD2  LEU 148          2HD2      LEU 148   7.513   0.555  -4.629
  943   3HD2  LEU 148          3HD2      LEU 148   6.404  -0.246  -5.744
  944    HA   PRO 149           HA       PRO 149  -0.626  -0.987  -5.332
  945   1HB   PRO 149          1HB       PRO 149  -0.928  -2.214  -2.838
  946   2HB   PRO 149          2HB       PRO 149  -0.488  -3.040  -4.345
  947   1HG   PRO 149          1HG       PRO 149   1.286  -2.227  -2.071
  948   2HG   PRO 149          2HG       PRO 149   1.386  -3.665  -3.152
  949   1HD   PRO 149          1HD       PRO 149   2.968  -1.413  -3.418
  950   2HD   PRO 149          2HD       PRO 149   2.586  -2.503  -4.715
  951    H    SER 150           H        SER 150   1.142   0.328  -2.519
  952    HA   SER 150           HA       SER 150  -1.047   1.678  -1.259
  953   1HB   SER 150          1HB       SER 150   0.790   3.137  -0.296
  954   2HB   SER 150          2HB       SER 150   1.014   1.393  -0.059
  955    HG   SER 150           HG       SER 150   2.912   2.565  -0.822
  956    H    ARG 151           H        ARG 151   1.082   2.554  -3.982
  957    HA   ARG 151           HA       ARG 151   0.245   5.345  -4.099
  958   1HB   ARG 151          1HB       ARG 151   1.663   3.546  -6.122
  959   2HB   ARG 151          2HB       ARG 151   1.407   5.290  -6.340
  960   1HG   ARG 151          1HG       ARG 151   2.663   5.765  -4.279
  961   2HG   ARG 151          2HG       ARG 151   2.838   4.043  -3.954
  962   1HD   ARG 151          1HD       ARG 151   4.146   3.872  -6.142
  963   2HD   ARG 151          2HD       ARG 151   4.192   5.653  -6.133
  964    HE   ARG 151           HE       ARG 151   4.911   4.889  -3.545
  965   1HH1  ARG 151          1HH1      ARG 151   6.451   4.067  -6.621
  966   2HH1  ARG 151          2HH1      ARG 151   7.989   3.879  -5.823
  967   1HH2  ARG 151          1HH2      ARG 151   6.646   4.432  -2.683
  968   2HH2  ARG 151          2HH2      ARG 151   8.107   3.985  -3.575
  969    H    LEU 152           H        LEU 152  -0.748   2.309  -5.710
  970    HA   LEU 152           HA       LEU 152  -2.689   3.513  -7.502
  971   1HB   LEU 152          1HB       LEU 152  -1.854   1.279  -7.897
  972   2HB   LEU 152          2HB       LEU 152  -2.359   0.747  -6.287
  973    HG   LEU 152           HG       LEU 152  -4.700   0.858  -6.888
  974   1HD1  LEU 152          1HD1      LEU 152  -4.636   2.789  -8.511
  975   2HD1  LEU 152          2HD1      LEU 152  -3.811   1.727  -9.668
  976   3HD1  LEU 152          3HD1      LEU 152  -5.466   1.369  -9.127
  977   1HD2  LEU 152          1HD2      LEU 152  -3.186  -0.538  -9.121
  978   2HD2  LEU 152          2HD2      LEU 152  -3.294  -1.182  -7.473
  979   3HD2  LEU 152          3HD2      LEU 152  -4.765  -0.973  -8.453
  980    H    LYS 153           H        LYS 153  -2.883   2.009  -4.213
  981    HA   LYS 153           HA       LYS 153  -5.682   2.324  -3.813
  982   1HB   LYS 153          1HB       LYS 153  -3.314   2.229  -1.906
  983   2HB   LYS 153          2HB       LYS 153  -4.968   2.411  -1.312
  984   1HG   LYS 153          1HG       LYS 153  -5.681   0.341  -2.297
  985   2HG   LYS 153          2HG       LYS 153  -4.155   0.132  -3.161
  986   1HD   LYS 153          1HD       LYS 153  -2.943  -0.009  -0.988
  987   2HD   LYS 153          2HD       LYS 153  -4.477   0.123  -0.120
  988   1HE   LYS 153          1HE       LYS 153  -3.767  -2.079  -2.121
  989   2HE   LYS 153          2HE       LYS 153  -3.569  -2.220  -0.372
  990   1HZ   LYS 153          1HZ       LYS 153  -5.974  -1.904  -0.132
  991   2HZ   LYS 153          2HZ       LYS 153  -6.167  -1.806  -1.754
  992   3HZ   LYS 153          3HZ       LYS 153  -5.660  -3.197  -1.073
  993    H    ARG 154           H        ARG 154  -2.984   4.623  -3.200
  994    HA   ARG 154           HA       ARG 154  -4.663   6.684  -2.047
  995   1HB   ARG 154          1HB       ARG 154  -2.049   6.378  -1.983
  996   2HB   ARG 154          2HB       ARG 154  -2.070   7.257  -3.518
  997   1HG   ARG 154          1HG       ARG 154  -3.394   9.082  -2.306
  998   2HG   ARG 154          2HG       ARG 154  -3.204   8.153  -0.816
  999   1HD   ARG 154          1HD       ARG 154  -1.528   9.868  -0.799
 1000   2HD   ARG 154          2HD       ARG 154  -0.707   8.336  -1.079
 1001    HE   ARG 154           HE       ARG 154  -1.338  10.394  -3.171
 1002   1HH1  ARG 154          1HH1      ARG 154   0.752   7.713  -2.296
 1003   2HH1  ARG 154          2HH1      ARG 154   1.810   8.042  -3.650
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.162  10.659  -4.769
 1005   2HH2  ARG 154          2HH2      ARG 154   1.300   9.720  -5.087
 1006    H    HIS 155           H        HIS 155  -3.545   5.955  -5.378
 1007    HA   HIS 155           HA       HIS 155  -4.644   8.263  -6.668
 1008   1HB   HIS 155          1HB       HIS 155  -3.118   6.846  -7.860
 1009   2HB   HIS 155          2HB       HIS 155  -4.147   5.424  -7.670
 1010    HD1  HIS 155           HD1      HIS 155  -4.142   8.769  -9.567
 1011    HD2  HIS 155           HD2      HIS 155  -6.154   5.077  -9.377
 1012    HE1  HIS 155           HE1      HIS 155  -5.934   8.876 -11.349
 1013    H    GLU 156           H        GLU 156  -6.106   5.158  -5.665
 1014    HA   GLU 156           HA       GLU 156  -8.545   5.331  -7.034
 1015   1HB   GLU 156          1HB       GLU 156  -7.532   3.491  -5.415
 1016   2HB   GLU 156          2HB       GLU 156  -8.475   4.333  -4.173
 1017   1HG   GLU 156          1HG       GLU 156 -10.513   4.056  -5.618
 1018   2HG   GLU 156          2HG       GLU 156  -9.521   3.195  -6.801
 1019    H    LYS 157           H        LYS 157  -7.444   7.121  -4.174
 1020    HA   LYS 157           HA       LYS 157  -9.977   8.049  -3.188
 1021   1HB   LYS 157          1HB       LYS 157  -7.768   8.188  -2.018
 1022   2HB   LYS 157          2HB       LYS 157  -7.286   9.463  -3.150
 1023   1HG   LYS 157          1HG       LYS 157  -8.861  11.005  -2.263
 1024   2HG   LYS 157          2HG       LYS 157  -9.720   9.749  -1.372
 1025   1HD   LYS 157          1HD       LYS 157  -8.225  11.233   0.050
 1026   2HD   LYS 157          2HD       LYS 157  -8.001   9.496   0.219
 1027   1HE   LYS 157          1HE       LYS 157  -5.819  10.421   0.227
 1028   2HE   LYS 157          2HE       LYS 157  -6.025   9.612  -1.322
 1029   1HZ   LYS 157          1HZ       LYS 157  -5.941  12.516  -0.802
 1030   2HZ   LYS 157          2HZ       LYS 157  -5.080  11.629  -1.882
 1031   3HZ   LYS 157          3HZ       LYS 157  -6.621  11.925  -2.196
 1032    H    VAL 158           H        VAL 158  -8.010   8.998  -5.992
 1033    HA   VAL 158           HA       VAL 158  -9.187  11.565  -6.517
 1034    HB   VAL 158           HB       VAL 158  -8.160   9.512  -8.557
 1035   1HG1  VAL 158          1HG1      VAL 158  -7.685  11.515  -9.931
 1036   2HG1  VAL 158          2HG1      VAL 158  -9.425  11.393  -9.598
 1037   3HG1  VAL 158          3HG1      VAL 158  -8.409  12.527  -8.665
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.068  10.905  -8.527
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.809  11.872  -7.232
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.345  10.184  -6.916
 1041    H    HIS 159           H        HIS 159 -10.170   8.236  -7.442
 1042    HA   HIS 159           HA       HIS 159 -12.491   9.161  -8.958
 1043   1HB   HIS 159          1HB       HIS 159 -11.589   6.410  -7.984
 1044   2HB   HIS 159          2HB       HIS 159 -13.058   6.686  -8.941
 1045    HD1  HIS 159           HD1      HIS 159 -12.328   8.424 -11.263
 1046    HD2  HIS 159           HD2      HIS 159  -9.543   5.807  -9.498
 1047    HE1  HIS 159           HE1      HIS 159 -10.411   8.171 -12.930
 1048    H    ALA 160           H        ALA 160 -11.821   8.206  -5.612
 1049    HA   ALA 160           HA       ALA 160 -14.597   7.938  -4.797
 1050   1HB   ALA 160          1HB       ALA 160 -13.705   8.001  -2.533
 1051   2HB   ALA 160          2HB       ALA 160 -12.641   6.987  -3.528
 1052   3HB   ALA 160          3HB       ALA 160 -12.159   8.648  -3.102
 1053    H    GLY 161           H        GLY 161 -12.333  10.640  -5.227
 1054   1HA   GLY 161          1HA       GLY 161 -12.944  12.887  -5.538
 1055   2HA   GLY 161          2HA       GLY 161 -14.553  12.536  -4.943
 1056    H    TYR 162           H        TYR 162 -13.583  14.823  -4.096
 1057    HA   TYR 162           HA       TYR 162 -12.607  14.296  -1.311
 1058   1HB   TYR 162          1HB       TYR 162 -11.988  16.601  -3.188
 1059   2HB   TYR 162          2HB       TYR 162 -11.497  16.534  -1.482
 1060    HD1  TYR 162           HD1      TYR 162 -11.127  14.966  -4.846
 1061    HD2  TYR 162           HD2      TYR 162  -9.642  15.154  -0.795
 1062    HE1  TYR 162           HE1      TYR 162  -9.394  13.350  -5.424
 1063    HE2  TYR 162           HE2      TYR 162  -7.694  13.780  -1.458
 1064    HH   TYR 162           HH       TYR 162  -7.157  12.680  -4.792
 1065    HA   PRO 163           HA       PRO 163 -16.642  16.298  -1.021
 1066   1HB   PRO 163          1HB       PRO 163 -17.554  15.054   1.247
 1067   2HB   PRO 163          2HB       PRO 163 -17.466  14.218  -0.329
 1068   1HG   PRO 163          1HG       PRO 163 -15.474  14.087   1.945
 1069   2HG   PRO 163          2HG       PRO 163 -16.178  12.735   1.003
 1070   1HD   PRO 163          1HD       PRO 163 -13.727  13.838   0.441
 1071   2HD   PRO 163          2HD       PRO 163 -14.797  13.171  -0.837
 1072    H    CYS 164           H        CYS 164 -17.269  18.130   0.021
 1073    HA   CYS 164           HA       CYS 164 -15.383  19.453   1.763
 1074   1HB   CYS 164          1HB       CYS 164 -17.109  20.435   0.046
 1075   2HB   CYS 164          2HB       CYS 164 -18.260  20.333   1.399
 1076    H    LYS 165           H        LYS 165 -15.444  19.881   3.904
 1077    HA   LYS 165           HA       LYS 165 -17.778  19.028   5.511
 1078   1HB   LYS 165          1HB       LYS 165 -15.930  17.171   5.376
 1079   2HB   LYS 165          2HB       LYS 165 -14.976  18.227   6.393
 1080   1HG   LYS 165          1HG       LYS 165 -16.137  16.437   7.635
 1081   2HG   LYS 165          2HG       LYS 165 -16.597  18.025   8.212
 1082   1HD   LYS 165          1HD       LYS 165 -18.499  16.464   8.112
 1083   2HD   LYS 165          2HD       LYS 165 -18.760  17.881   7.097
 1084   1HE   LYS 165          1HE       LYS 165 -18.050  16.541   5.091
 1085   2HE   LYS 165          2HE       LYS 165 -17.830  15.132   6.133
 1086   1HZ   LYS 165          1HZ       LYS 165 -20.405  16.549   5.685
 1087   2HZ   LYS 165          2HZ       LYS 165 -20.000  15.103   5.053
 1088   3HZ   LYS 165          3HZ       LYS 165 -20.216  15.250   6.663
 1089    H    LYS 166           H        LYS 166 -15.988  21.473   4.548
 1090    HA   LYS 166           HA       LYS 166 -14.997  22.701   6.991
 1091   1HB   LYS 166          1HB       LYS 166 -15.869  23.857   4.335
 1092   2HB   LYS 166          2HB       LYS 166 -15.088  24.811   5.595
 1093   1HG   LYS 166          1HG       LYS 166 -13.801  22.379   4.272
 1094   2HG   LYS 166          2HG       LYS 166 -13.599  24.045   3.723
 1095   1HD   LYS 166          1HD       LYS 166 -12.538  24.715   5.768
 1096   2HD   LYS 166          2HD       LYS 166 -12.853  23.133   6.526
 1097   1HE   LYS 166          1HE       LYS 166 -11.467  22.029   4.796
 1098   2HE   LYS 166          2HE       LYS 166 -11.133  23.598   4.056
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.353  22.810   6.816
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.337  22.916   5.544
 1101   3HZ   LYS 166          3HZ       LYS 166 -10.040  24.266   6.139
 1102    H    ASP 167           H        ASP 167 -18.182  22.351   5.566
 1103    HA   ASP 167           HA       ASP 167 -19.358  23.671   7.931
 1104   1HB   ASP 167          1HB       ASP 167 -19.073  25.467   6.137
 1105   2HB   ASP 167          2HB       ASP 167 -20.193  24.550   5.133
 1106    H    ASP 168           H        ASP 168 -21.398  22.862   8.456
 1107    HA   ASP 168           HA       ASP 168 -21.996  20.244   7.534
 1108   1HB   ASP 168          1HB       ASP 168 -22.560  21.185   9.784
 1109   2HB   ASP 168          2HB       ASP 168 -23.804  22.186   9.036
 1110    H    SER 169           H        SER 169 -23.157  23.408   6.427
 1111    HA   SER 169           HA       SER 169 -25.354  22.170   4.845
 1112   1HB   SER 169          1HB       SER 169 -24.533  25.088   5.211
 1113   2HB   SER 169          2HB       SER 169 -25.965  24.519   4.335
 1114    HG   SER 169           HG       SER 169 -26.430  25.134   6.510
 1115    H    CYS 170           H        CYS 170 -22.321  21.897   4.279
 1116    HA   CYS 170           HA       CYS 170 -22.420  22.826   1.436
 1117   1HB   CYS 170          1HB       CYS 170 -20.616  23.772   3.019
 1118   2HB   CYS 170          2HB       CYS 170 -19.934  22.157   3.031
 1119    H    SER 171           H        SER 171 -22.274  21.259  -0.124
 1120    HA   SER 171           HA       SER 171 -21.706  18.441   0.750
 1121   1HB   SER 171          1HB       SER 171 -23.994  19.382  -1.035
 1122   2HB   SER 171          2HB       SER 171 -23.637  17.703  -0.598
 1123    HG   SER 171           HG       SER 171 -25.292  18.617   0.710
 1124    H    PHE 172           H        PHE 172 -20.316  20.689  -0.978
 1125    HA   PHE 172           HA       PHE 172 -20.161  19.724  -3.676
 1126   1HB   PHE 172          1HB       PHE 172 -19.359  21.919  -3.229
 1127   2HB   PHE 172          2HB       PHE 172 -18.372  21.381  -1.884
 1128    HD1  PHE 172           HD1      PHE 172 -16.227  20.235  -2.186
 1129    HD2  PHE 172           HD2      PHE 172 -18.480  21.647  -5.570
 1130    HE1  PHE 172           HE1      PHE 172 -14.250  19.898  -3.634
 1131    HE2  PHE 172           HE2      PHE 172 -16.434  21.491  -6.988
 1132    HZ   PHE 172           HZ       PHE 172 -14.303  20.662  -6.003
 1133    H    VAL 173           H        VAL 173 -18.827  18.229  -4.669
 1134    HA   VAL 173           HA       VAL 173 -16.738  16.905  -2.997
 1135    HB   VAL 173           HB       VAL 173 -18.528  15.498  -5.012
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.360  13.431  -4.215
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.169  14.529  -4.905
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.337  14.404  -3.146
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.481  15.517  -1.968
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.844  15.827  -3.047
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.216  14.182  -2.898
 1142    H    GLY 174           H        GLY 174 -14.791  17.229  -3.817
 1143   1HA   GLY 174          1HA       GLY 174 -14.537  18.282  -6.558
 1144   2HA   GLY 174          2HA       GLY 174 -13.237  18.080  -5.368
 1145    H    LYS 175           H        LYS 175 -13.962  17.207  -8.367
 1146    HA   LYS 175           HA       LYS 175 -13.671  14.369  -8.436
 1147   1HB   LYS 175          1HB       LYS 175 -14.335  16.022 -10.311
 1148   2HB   LYS 175          2HB       LYS 175 -12.604  16.270 -10.565
 1149   1HG   LYS 175          1HG       LYS 175 -12.332  13.849 -11.053
 1150   2HG   LYS 175          2HG       LYS 175 -14.060  13.596 -10.730
 1151   1HD   LYS 175          1HD       LYS 175 -14.613  15.138 -12.623
 1152   2HD   LYS 175          2HD       LYS 175 -12.887  15.402 -12.893
 1153   1HE   LYS 175          1HE       LYS 175 -13.589  13.822 -14.524
 1154   2HE   LYS 175          2HE       LYS 175 -12.607  12.947 -13.347
 1155   1HZ   LYS 175          1HZ       LYS 175 -14.649  11.742 -13.928
 1156   2HZ   LYS 175          2HZ       LYS 175 -14.681  12.127 -12.343
 1157   3HZ   LYS 175          3HZ       LYS 175 -15.583  12.973 -13.413
 1158    H    THR 176           H        THR 176 -11.368  16.826  -7.626
 1159    HA   THR 176           HA       THR 176  -9.271  14.783  -7.290
 1160    HB   THR 176           HB       THR 176  -7.693  16.766  -8.333
 1161    HG1  THR 176           HG1      THR 176  -8.886  17.979  -9.491
 1162   1HG2  THR 176          1HG2      THR 176  -7.393  14.415  -8.806
 1163   2HG2  THR 176          2HG2      THR 176  -8.853  14.408  -9.840
 1164   3HG2  THR 176          3HG2      THR 176  -7.443  15.333 -10.328
 1165    H    TRP 177           H        TRP 177  -7.424  15.616  -6.036
 1166    HA   TRP 177           HA       TRP 177  -8.297  16.911  -3.713
 1167   1HB   TRP 177          1HB       TRP 177  -6.358  15.506  -3.711
 1168   2HB   TRP 177          2HB       TRP 177  -5.543  16.495  -4.899
 1169    HD1  TRP 177           HD1      TRP 177  -3.587  17.494  -3.904
 1170    HE1  TRP 177           HE1      TRP 177  -2.908  18.700  -1.733
 1171    HE3  TRP 177           HE3      TRP 177  -7.879  16.777  -1.275
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.807  18.508   0.994
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.862  17.086   1.185
 1174    HH2  TRP 177           HH2      TRP 177  -5.817  17.893   2.334
 1175    H    THR 178           H        THR 178  -6.543  18.333  -6.531
 1176    HA   THR 178           HA       THR 178  -6.149  20.937  -5.505
 1177    HB   THR 178           HB       THR 178  -6.423  21.651  -7.957
 1178    HG1  THR 178           HG1      THR 178  -6.150  19.057  -8.790
 1179   1HG2  THR 178          1HG2      THR 178  -4.373  19.487  -7.460
 1180   2HG2  THR 178          2HG2      THR 178  -4.342  20.726  -8.726
 1181   3HG2  THR 178          3HG2      THR 178  -4.215  21.199  -7.021
 1182    H    LEU 179           H        LEU 179  -8.981  19.647  -7.328
 1183    HA   LEU 179           HA       LEU 179 -10.400  22.072  -7.451
 1184   1HB   LEU 179          1HB       LEU 179 -11.507  19.231  -7.308
 1185   2HB   LEU 179          2HB       LEU 179 -12.414  20.656  -7.803
 1186    HG   LEU 179           HG       LEU 179 -10.031  19.446  -9.235
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.960  19.704 -10.027
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.667  18.963 -11.000
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.144  18.224  -9.470
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.540  21.084 -11.060
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.663  21.918  -9.961
 1192   3HD2  LEU 179          3HD2      LEU 179  -9.916  21.855  -9.603
 1193    H    TYR 180           H        TYR 180 -10.245  19.680  -4.809
 1194    HA   TYR 180           HA       TYR 180 -12.422  20.869  -3.277
 1195   1HB   TYR 180          1HB       TYR 180 -12.004  18.693  -2.694
 1196   2HB   TYR 180          2HB       TYR 180 -10.249  18.845  -2.753
 1197    HD1  TYR 180           HD1      TYR 180  -9.050  19.027  -0.746
 1198    HD2  TYR 180           HD2      TYR 180 -13.223  20.129  -0.801
 1199    HE1  TYR 180           HE1      TYR 180  -8.977  19.413   1.705
 1200    HE2  TYR 180           HE2      TYR 180 -13.120  20.598   1.649
 1201    HH   TYR 180           HH       TYR 180 -10.144  20.024   3.565
 1202    H    LEU 181           H        LEU 181  -8.821  20.991  -3.076
 1203    HA   LEU 181           HA       LEU 181  -8.659  22.873  -0.973
 1204   1HB   LEU 181          1HB       LEU 181  -6.864  22.345  -3.380
 1205   2HB   LEU 181          2HB       LEU 181  -6.451  23.493  -2.144
 1206    HG   LEU 181           HG       LEU 181  -6.896  20.481  -1.735
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.380  20.658  -1.181
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.843  20.704  -2.885
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.419  22.209  -2.013
 1210   1HD2  LEU 181          1HD2      LEU 181  -6.097  22.615   0.259
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.487  21.517   0.339
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.865  20.861   0.545
 1213    H    LYS 182           H        LYS 182  -8.927  23.439  -4.520
 1214    HA   LYS 182           HA       LYS 182  -8.803  26.307  -4.447
 1215   1HB   LYS 182          1HB       LYS 182  -8.541  24.943  -6.497
 1216   2HB   LYS 182          2HB       LYS 182 -10.237  24.454  -6.410
 1217   1HG   LYS 182          1HG       LYS 182 -10.947  26.795  -6.736
 1218   2HG   LYS 182          2HG       LYS 182  -9.251  27.322  -6.758
 1219   1HD   LYS 182          1HD       LYS 182  -8.849  25.887  -8.750
 1220   2HD   LYS 182          2HD       LYS 182 -10.547  25.395  -8.751
 1221   1HE   LYS 182          1HE       LYS 182  -9.544  28.265  -9.063
 1222   2HE   LYS 182          2HE       LYS 182  -9.965  27.197 -10.405
 1223   1HZ   LYS 182          1HZ       LYS 182 -12.245  27.087  -9.479
 1224   2HZ   LYS 182          2HZ       LYS 182 -11.848  28.174  -8.310
 1225   3HZ   LYS 182          3HZ       LYS 182 -11.828  28.614  -9.877
 1226    H    HIS 183           H        HIS 183 -11.585  24.023  -4.297
 1227    HA   HIS 183           HA       HIS 183 -13.652  25.986  -4.209
 1228   1HB   HIS 183          1HB       HIS 183 -14.263  23.719  -4.629
 1229   2HB   HIS 183          2HB       HIS 183 -13.425  23.122  -3.210
 1230    HD1  HIS 183           HD1      HIS 183 -16.760  24.794  -4.110
 1231    HD2  HIS 183           HD2      HIS 183 -14.617  23.262  -0.827
 1232    HE1  HIS 183           HE1      HIS 183 -18.397  24.706  -2.157
 1233    H    VAL 184           H        VAL 184 -11.695  24.463  -1.614
 1234    HA   VAL 184           HA       VAL 184 -13.076  25.604   0.614
 1235    HB   VAL 184           HB       VAL 184 -10.281  24.528   0.176
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.813  24.691   2.560
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.925  26.300   1.845
 1238   3HG1  VAL 184          3HG1      VAL 184 -11.292  25.667   2.808
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.002  22.895   0.323
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.192  22.878   1.867
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.788  23.710   1.690
 1242    H    ALA 185           H        ALA 185 -10.268  26.766  -1.285
 1243    HA   ALA 185           HA       ALA 185  -9.720  29.008   0.346
 1244   1HB   ALA 185          1HB       ALA 185  -8.162  28.094  -1.351
 1245   2HB   ALA 185          2HB       ALA 185  -9.244  28.646  -2.651
 1246   3HB   ALA 185          3HB       ALA 185  -8.438  29.830  -1.600
 1247    H    GLU 186           H        GLU 186 -12.037  28.564  -2.328
 1248    HA   GLU 186           HA       GLU 186 -12.612  31.456  -2.497
 1249   1HB   GLU 186          1HB       GLU 186 -13.666  29.013  -3.989
 1250   2HB   GLU 186          2HB       GLU 186 -14.271  30.654  -4.250
 1251   1HG   GLU 186          1HG       GLU 186 -11.939  31.408  -4.777
 1252   2HG   GLU 186          2HG       GLU 186 -11.396  29.735  -4.676
 1253    H    CYS 187           H        CYS 187 -14.086  28.542  -1.071
 1254    HA   CYS 187           HA       CYS 187 -16.641  30.027  -0.635
 1255   1HB   CYS 187          1HB       CYS 187 -16.014  27.037  -0.504
 1256   2HB   CYS 187          2HB       CYS 187 -17.609  27.771  -0.284
 1257    HG   CYS 187           HG       CYS 187 -15.594  27.810  -2.896
 1258    H    HIS 188           H        HIS 188 -13.916  28.739   1.190
 1259    HA   HIS 188           HA       HIS 188 -15.429  29.266   3.734
 1260   1HB   HIS 188          1HB       HIS 188 -13.479  26.981   3.224
 1261   2HB   HIS 188          2HB       HIS 188 -14.285  27.337   4.761
 1262    HD1  HIS 188           HD1      HIS 188 -17.163  27.230   4.533
 1263    HD2  HIS 188           HD2      HIS 188 -14.718  25.391   1.650
 1264    HE1  HIS 188           HE1      HIS 188 -18.652  25.553   3.301
 1265    H    GLN 189           H        GLN 189 -13.019  30.442   1.867
 1266    HA   GLN 189           HA       GLN 189 -11.589  31.539   4.251
 1267   1HB   GLN 189          1HB       GLN 189 -10.246  30.442   1.761
 1268   2HB   GLN 189          2HB       GLN 189  -9.412  31.382   2.975
 1269   1HG   GLN 189          1HG       GLN 189 -10.721  28.696   3.588
 1270   2HG   GLN 189          2HG       GLN 189  -9.059  28.896   3.071
 1271   1HE2  GLN 189          1HE2      GLN 189 -11.316  29.603   5.752
 1272   2HE2  GLN 189          2HE2      GLN 189 -10.029  29.916   6.923
 1273    H    ASP 190           H        ASP 190 -13.598  32.294   1.885
 1274    HA   ASP 190           HA       ASP 190 -12.593  35.043   1.630
 1275   1HB   ASP 190          1HB       ASP 190 -11.517  33.845  -0.299
 1276   2HB   ASP 190          2HB       ASP 190 -13.116  33.371  -0.873
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -7.970  29.701 -13.890
    2   2H5*    G   1          2H5*        G   1  -8.892  28.193 -13.776
    3    H4*    G   1           H4*        G   1  -7.942  28.331 -15.960
    4    H3*    G   1           H3*        G   1  -6.417  26.341 -14.260
    5    H2*    G   1           H2*        G   1  -5.357  25.682 -16.348
    6   2HO*    G   1          2HO*        G   1  -7.407  26.168 -17.639
    7    H1*    G   1           H1*        G   1  -4.798  28.245 -17.038
    8    H8     G   1           H8         G   1  -4.559  28.445 -13.292
    9    H1     G   1           H1         G   1   0.526  25.631 -16.059
   10   1H2     G   1          1H2         G   1   0.005  24.930 -18.039
   11   2H2     G   1          2H2         G   1  -1.519  25.353 -18.796
   12   1H5*    G   2          1H5*        G   2  -7.496  24.128 -17.648
   13   2H5*    G   2          2H5*        G   2  -8.133  22.545 -17.189
   14    H4*    G   2           H4*        G   2  -6.333  22.320 -18.814
   15    H3*    G   2           H3*        G   2  -5.592  21.344 -16.042
   16    H2*    G   2           H2*        G   2  -3.638  20.388 -17.112
   17   2HO*    G   2          2HO*        G   2  -4.925  19.944 -19.185
   18    H1*    G   2           H1*        G   2  -3.068  22.670 -18.481
   19    H8     G   2           H8         G   2  -4.531  23.949 -15.237
   20    H1     G   2           H1         G   2   1.485  21.752 -14.646
   21   1H2     G   2          1H2         G   2   1.977  20.480 -16.317
   22   2H2     G   2          2H2         G   2   0.908  20.298 -17.694
   23   1H5*    G   3          1H5*        G   3  -4.781  18.031 -18.442
   24   2H5*    G   3          2H5*        G   3  -5.466  16.557 -17.745
   25    H4*    G   3           H4*        G   3  -3.076  16.283 -18.194
   26    H3*    G   3           H3*        G   3  -3.800  16.404 -15.244
   27    H2*    G   3           H2*        G   3  -1.524  15.706 -14.854
   28   2HO*    G   3          2HO*        G   3  -1.614  14.278 -16.888
   29    H1*    G   3           H1*        G   3  -0.455  17.389 -16.756
   30    H8     G   3           H8         G   3  -3.208  19.345 -15.003
   31    H1     G   3           H1         G   3   2.317  19.023 -11.707
   32   1H2     G   3          1H2         G   3   3.535  17.419 -12.461
   33   2H2     G   3          2H2         G   3   3.098  16.516 -13.898
   34   1H5*    C   4          1H5*        C   4  -1.769  12.805 -15.386
   35   2H5*    C   4          2H5*        C   4  -2.596  11.566 -14.430
   36    H4*    C   4           H4*        C   4  -0.327  11.879 -13.613
   37    H3*    C   4           H3*        C   4  -2.423  13.004 -11.718
   38    H2*    C   4           H2*        C   4  -0.630  13.278 -10.172
   39   2HO*    C   4          2HO*        C   4   0.337  11.116 -10.891
   40    H1*    C   4           H1*        C   4   1.223  14.070 -12.115
   41   1H4     C   4          1H4         C   4  -0.994  19.063  -8.812
   42   2H4     C   4          2H4         C   4  -2.464  19.085  -9.756
   43    H5     C   4           H5         C   4  -2.922  17.518 -11.512
   44    H6     C   4           H6         C   4  -2.105  15.502 -12.640
   45   1H5*    C   5          1H5*        C   5  -1.366  11.654  -8.764
   46   2H5*    C   5          2H5*        C   5  -2.473  10.518  -8.013
   47    H4*    C   5           H4*        C   5  -1.847  12.505  -6.663
   48    H3*    C   5           H3*        C   5  -4.296  11.214  -6.555
   49    H2*    C   5           H2*        C   5  -5.298  12.740  -8.167
   50   2HO*    C   5          2HO*        C   5  -5.712  13.616  -5.498
   51    H1*    C   5           H1*        C   5  -4.071  15.020  -6.677
   52   1H4     C   5          1H4         C   5  -6.035  18.411 -11.628
   53   2H4     C   5          2H4         C   5  -5.731  17.107 -12.746
   54    H5     C   5           H5         C   5  -4.951  14.949 -12.057
   55    H6     C   5           H6         C   5  -4.340  13.576 -10.123
   56   1H5*    A   6          1H5*        A   6  -2.238  14.532  -4.351
   57   2H5*    A   6          2H5*        A   6  -0.892  13.391  -4.330
   58    H4*    A   6           H4*        A   6  -0.256  15.323  -3.281
   59    H3*    A   6           H3*        A   6  -0.534  13.056  -1.383
   60    H2*    A   6           H2*        A   6  -0.228  14.479   0.531
   61   2HO*    A   6          2HO*        A   6   1.469  15.812   0.062
   62    H1*    A   6           H1*        A   6  -1.560  16.694  -0.334
   63    H8     A   6           H8         A   6  -4.087  14.580  -1.694
   64   1H6     A   6          1H6         A   6  -6.054  13.379   4.060
   65   2H6     A   6          2H6         A   6  -6.384  13.148   2.360
   66    H2     A   6           H2         A   6  -2.147  15.452   4.371
   67   1H5*    U   7          1H5*        U   7   3.171  12.451   0.945
   68   2H5*    U   7          2H5*        U   7   2.172  13.790   0.394
   69    H4*    U   7           H4*        U   7   3.938  14.598   1.802
   70    H3*    U   7           H3*        U   7   3.303  15.786  -0.631
   71    H2*    U   7           H2*        U   7   5.086  14.663  -1.770
   72   2HO*    U   7          2HO*        U   7   5.865  17.230  -0.877
   73    H1*    U   7           H1*        U   7   6.861  15.298   0.623
   74    H3     U   7           H3         U   7  10.530  13.608  -1.317
   75    H5     U   7           H5         U   7   7.744  10.501  -1.590
   76    H6     U   7           H6         U   7   5.991  12.076  -0.914
   77   1H5*    A   8          1H5*        A   8   4.118  19.497  -0.680
   78   2H5*    A   8          2H5*        A   8   3.405  20.321   0.711
   79    H4*    A   8           H4*        A   8   2.638  21.443  -1.202
   80    H3*    A   8           H3*        A   8   0.815  20.471   0.580
   81    H2*    A   8           H2*        A   8   0.406  18.497  -0.771
   82   2HO*    A   8          2HO*        A   8  -1.661  19.433  -0.235
   83    H1*    A   8           H1*        A   8   0.169  20.455  -3.050
   84    H8     A   8           H8         A   8   2.348  17.293  -3.002
   85   1H6     A   8          1H6         A   8  -1.437  15.297  -7.489
   86   2H6     A   8          2H6         A   8   0.124  15.081  -6.735
   87    H2     A   8           H2         A   8  -3.249  18.934  -5.687
   88   1H5*    C   9          1H5*        C   9  -2.475  21.888  -0.208
   89   2H5*    C   9          2H5*        C   9  -2.747  23.396   0.672
   90    H4*    C   9           H4*        C   9  -4.316  21.790   1.440
   91    H3*    C   9           H3*        C   9  -2.204  22.350   3.497
   92    H2*    C   9           H2*        C   9  -3.378  20.809   4.944
   93   2HO*    C   9          2HO*        C   9  -5.527  21.598   3.846
   94    H1*    C   9           H1*        C   9  -3.803  18.869   3.086
   95   1H4     C   9          1H4         C   9   1.910  17.602   5.707
   96   2H4     C   9          2H4         C   9   2.653  18.162   4.218
   97    H5     C   9           H5         C   9   1.453  19.419   2.587
   98    H6     C   9           H6         C   9  -0.750  20.179   1.881
   99   1H5*    C  10          1H5*        C  10  -5.593  22.447   5.695
  100   2H5*    C  10          2H5*        C  10  -5.742  23.826   6.790
  101    H4*    C  10           H4*        C  10  -5.798  21.699   8.014
  102    H3*    C  10           H3*        C  10  -3.289  23.332   8.524
  103    H2*    C  10           H2*        C  10  -2.808  21.721  10.246
  104   2HO*    C  10          2HO*        C  10  -5.137  21.471  10.856
  105    H1*    C  10           H1*        C  10  -3.387  19.544   8.671
  106   1H4     C  10          1H4         C  10   2.764  20.129   7.537
  107   2H4     C  10          2H4         C  10   2.397  20.994   6.062
  108    H5     C  10           H5         C  10   0.212  21.847   5.546
  109    H6     C  10           H6         C  10  -2.117  21.919   6.298
  110   1H5*    U  11          1H5*        U  11  -3.833  23.579  12.449
  111   2H5*    U  11          2H5*        U  11  -3.336  25.211  12.931
  112    H4*    U  11           H4*        U  11  -1.762  23.312  13.536
  113    H3*    U  11           H3*        U  11  -0.694  25.547  11.816
  114    H2*    U  11           H2*        U  11   1.467  24.581  12.220
  115   2HO*    U  11          2HO*        U  11   0.861  23.992  14.529
  116    H1*    U  11           H1*        U  11   0.615  22.014  11.825
  117    H3     U  11           H3         U  11   3.220  23.140   8.231
  118    H5     U  11           H5         U  11  -0.381  25.141   7.487
  119    H6     U  11           H6         U  11  -1.187  24.393   9.682
  120   1H5*    C  12          1H5*        C  12   2.384  26.330  15.093
  121   2H5*    C  12          2H5*        C  12   3.081  27.731  14.276
  122    H4*    C  12           H4*        C  12   3.547  24.788  13.879
  123    H3*    C  12           H3*        C  12   5.146  26.792  14.796
  124    H2*    C  12           H2*        C  12   4.885  28.122  12.796
  125   2HO*    C  12          2HO*        C  12   7.327  26.932  13.153
  126    H1*    C  12           H1*        C  12   5.549  25.612  11.223
  127   1H4     C  12          1H4         C  12   4.428  29.749   6.517
  128   2H4     C  12          2H4         C  12   2.894  30.211   7.210
  129    H5     C  12           H5         C  12   2.079  29.337   9.291
  130    H6     C  12           H6         C  12   2.585  27.822  11.153
  131   1H5*    U  13          1H5*        U  13   6.122  22.249  14.962
  132   2H5*    U  13          2H5*        U  13   7.295  22.257  16.279
  133    H4*    U  13           H4*        U  13   7.886  20.271  15.355
  134    H3*    U  13           H3*        U  13   9.789  22.168  14.619
  135    H2*    U  13           H2*        U  13   8.818  22.653  12.528
  136   2HO*    U  13          2HO*        U  13  10.758  20.609  12.258
  137    H1*    U  13           H1*        U  13   8.305  19.700  12.047
  138    H3     U  13           H3         U  13   6.775  20.933   7.950
  139    H5     U  13           H5         U  13   4.845  23.618  10.505
  140    H6     U  13           H6         U  13   6.090  22.648  12.387
  141   1H5*    U  14          1H5*        U  14  11.573  17.055  15.670
  142   2H5*    U  14          2H5*        U  14  13.033  17.153  14.686
  143    H4*    U  14           H4*        U  14  10.164  17.518  13.733
  144    H3*    U  14           H3*        U  14  12.201  15.332  13.575
  145    H2*    U  14           H2*        U  14  12.590  15.593  11.389
  146   2HO*    U  14          2HO*        U  14  10.048  14.643  11.498
  147    H1*    U  14           H1*        U  14  10.306  17.527  10.994
  148    H3     U  14           H3         U  14  12.250  18.162   6.898
  149    H5     U  14           H5         U  14  15.358  18.978   9.593
  150    H6     U  14           H6         U  14  13.894  18.248  11.427
  151   1H5*    G  15          1H5*        G  15   7.117  13.508  14.681
  152   2H5*    G  15          2H5*        G  15   7.507  14.823  13.567
  153    H4*    G  15           H4*        G  15   6.073  15.246  16.219
  154    H3*    G  15           H3*        G  15   5.086  14.718  13.399
  155    H2*    G  15           H2*        G  15   3.113  15.986  14.022
  156   2HO*    G  15          2HO*        G  15   3.140  15.225  16.326
  157    H1*    G  15           H1*        G  15   4.581  18.041  14.999
  158    H8     G  15           H8         G  15   6.957  16.955  12.364
  159    H1     G  15           H1         G  15   1.683  19.660   9.897
  160   1H2     G  15          1H2         G  15   0.069  19.546  11.324
  161   2H2     G  15          2H2         G  15   0.345  19.138  13.005
  162   1H5*    G  16          1H5*        G  16   1.523  13.747  15.545
  163   2H5*    G  16          2H5*        G  16   0.966  12.131  15.082
  164    H4*    G  16           H4*        G  16  -0.863  13.663  14.836
  165    H3*    G  16           H3*        G  16   0.296  12.853  12.151
  166    H2*    G  16           H2*        G  16  -1.604  13.975  11.176
  167   2HO*    G  16          2HO*        G  16  -3.096  13.314  12.984
  168    H1*    G  16           H1*        G  16  -1.319  16.206  12.689
  169    H8     G  16           H8         G  16   2.265  15.191  12.326
  170    H1     G  16           H1         G  16  -0.219  17.065   6.740
  171   1H2     G  16          1H2         G  16  -2.369  17.352   6.904
  172   2H2     G  16          2H2         G  16  -3.238  16.887   8.355
  173   1H5*    G  17          1H5*        G  17  -3.516  11.784  11.117
  174   2H5*    G  17          2H5*        G  17  -3.498  10.223  10.287
  175    H4*    G  17           H4*        G  17  -4.358  12.034   8.871
  176    H3*    G  17           H3*        G  17  -1.732  10.872   7.900
  177    H2*    G  17           H2*        G  17  -2.111  12.273   5.916
  178   2HO*    G  17          2HO*        G  17  -4.517  12.003   6.091
  179    H1*    G  17           H1*        G  17  -2.487  14.500   7.321
  180    H8     G  17           H8         G  17  -0.296  12.783   9.779
  181    H1     G  17           H1         G  17   2.859  15.068   4.673
  182   1H2     G  17          1H2         G  17   1.454  15.617   3.109
  183   2H2     G  17          2H2         G  17  -0.259  15.240   3.236
  184   1H5*    C  18          1H5*        C  18  -3.494  10.550   4.347
  185   2H5*    C  18          2H5*        C  18  -3.268   8.968   3.582
  186    H4*    C  18           H4*        C  18  -2.278  10.696   2.203
  187    H3*    C  18           H3*        C  18  -0.110   9.101   3.589
  188    H2*    C  18           H2*        C  18   1.452  10.344   2.093
  189   2HO*    C  18          2HO*        C  18   0.339  10.894   0.202
  190    H1*    C  18           H1*        C  18   0.482  12.635   2.865
  191   1H4     C  18          1H4         C  18   4.450  11.135   7.588
  192   2H4     C  18          2H4         C  18   3.083  10.651   8.560
  193    H5     C  18           H5         C  18   0.837  10.568   7.725
  194    H6     C  18           H6         C  18  -0.540  10.867   5.742
  195   1H5*    C  19          1H5*        C  19   1.376   9.065  -0.088
  196   2H5*    C  19          2H5*        C  19   1.826   7.439  -0.635
  197    H4*    C  19           H4*        C  19   3.679   9.002  -0.937
  198    H3*    C  19           H3*        C  19   4.146   6.908   1.240
  199    H2*    C  19           H2*        C  19   6.409   7.706   1.235
  200   2HO*    C  19          2HO*        C  19   6.211   8.057  -1.223
  201    H1*    C  19           H1*        C  19   5.757  10.375   1.154
  202   1H4     C  19          1H4         C  19   6.394   8.684   7.284
  203   2H4     C  19          2H4         C  19   4.721   8.183   7.348
  204    H5     C  19           H5         C  19   3.282   8.139   5.431
  205    H6     C  19           H6         C  19   3.131   8.690   3.049
  206   1H5*    U  20          1H5*        U  20   7.496   6.326  -1.082
  207   2H5*    U  20          2H5*        U  20   7.751   4.595  -1.384
  208    H4*    U  20           H4*        U  20   9.704   5.520  -0.389
  209    H3*    U  20           H3*        U  20   8.227   3.815   1.647
  210    H2*    U  20           H2*        U  20  10.329   3.925   2.836
  211   2HO*    U  20          2HO*        U  20  11.755   3.860   0.939
  212    H1*    U  20           H1*        U  20  10.527   6.628   2.411
  213    H3     U  20           H3         U  20   9.394   5.933   6.806
  214    H5     U  20           H5         U  20   5.752   5.623   4.776
  215    H6     U  20           H6         U  20   6.978   5.793   2.649
  216   1H5*    G  21          1H5*        G  21  11.926   1.893   0.869
  217   2H5*    G  21          2H5*        G  21  11.796   0.136   0.937
  218    H4*    G  21           H4*        G  21  13.579   0.963   2.374
  219    H3*    G  21           H3*        G  21  11.263  -0.171   3.984
  220    H2*    G  21           H2*        G  21  12.792   0.041   5.872
  221   2HO*    G  21          2HO*        G  21  14.746  -0.409   4.381
  222    H1*    G  21           H1*        G  21  13.474   2.590   5.225
  223    H8     G  21           H8         G  21   9.849   2.266   4.121
  224    H1     G  21           H1         G  21  10.568   2.795  10.498
  225   1H2     G  21          1H2         G  21  12.632   2.471  11.040
  226   2H2     G  21          2H2         G  21  13.890   2.278   9.837
  227   1H5*    G  22          1H5*        G  22  14.630  -2.126   5.310
  228   2H5*    G  22          2H5*        G  22  14.433  -3.868   5.458
  229    H4*    G  22           H4*        G  22  15.354  -2.906   7.493
  230    H3*    G  22           H3*        G  22  12.537  -3.991   7.856
  231    H2*    G  22           H2*        G  22  12.789  -3.498  10.172
  232   2HO*    G  22          2HO*        G  22  15.053  -4.228  10.288
  233    H1*    G  22           H1*        G  22  14.028  -1.068   9.822
  234    H8     G  22           H8         G  22  11.364  -1.157   7.146
  235    H1     G  22           H1         G  22   8.992  -0.191  13.050
  236   1H2     G  22          1H2         G  22  10.467  -0.695  14.537
  237   2H2     G  22          2H2         G  22  12.105  -1.156  14.108
  238   1H5*    U  23          1H5*        U  23  12.153  -7.937  10.641
  239   2H5*    U  23          2H5*        U  23  11.231  -6.577   9.961
  240    H4*    U  23           H4*        U  23  12.614  -6.553  12.657
  241    H3*    U  23           H3*        U  23   9.712  -6.687  11.756
  242    H2*    U  23           H2*        U  23   9.173  -5.898  13.941
  243   2HO*    U  23          2HO*        U  23  10.999  -7.020  15.051
  244    H1*    U  23           H1*        U  23  11.010  -3.879  13.712
  245    H3     U  23           H3         U  23   6.560  -2.574  12.983
  246    H5     U  23           H5         U  23   8.184  -3.284   9.195
  247    H6     U  23           H6         U  23  10.209  -4.167  10.279
  248   1H5*    U  24          1H5*        U  24   9.138  -8.518  14.863
  249   2H5*    U  24          2H5*        U  24   8.413 -10.128  14.845
  250    H4*    U  24           H4*        U  24   7.029  -8.688  16.168
  251    H3*    U  24           H3*        U  24   5.816  -9.091  13.431
  252    H2*    U  24           H2*        U  24   3.815  -8.214  14.314
  253   2HO*    U  24          2HO*        U  24   3.982  -9.211  16.479
  254    H1*    U  24           H1*        U  24   5.175  -6.166  15.594
  255    H3     U  24           H3         U  24   2.773  -4.580  11.949
  256    H5     U  24           H5         U  24   6.393  -5.941  10.332
  257    H6     U  24           H6         U  24   7.018  -6.781  12.555
  258   1H5*    A  25          1H5*        A  25   4.322 -13.021  11.914
  259   2H5*    A  25          2H5*        A  25   6.029 -13.383  11.772
  260    H4*    A  25           H4*        A  25   5.252 -12.869   9.588
  261    H3*    A  25           H3*        A  25   7.381 -11.377  10.593
  262    H2*    A  25           H2*        A  25   5.862  -9.548  11.176
  263   2HO*    A  25          2HO*        A  25   7.665  -8.749   9.991
  264    H1*    A  25           H1*        A  25   4.763 -10.104   8.361
  265    H8     A  25           H8         A  25   3.125  -9.138  11.801
  266   1H6     A  25          1H6         A  25   0.343  -4.667   8.466
  267   2H6     A  25          2H6         A  25   0.290  -5.565   9.969
  268    H2     A  25           H2         A  25   3.324  -6.689   5.856
  269   1H5*    G  26          1H5*        G  26   7.526 -14.267   5.484
  270   2H5*    G  26          2H5*        G  26   7.640 -12.543   5.225
  271    H4*    G  26           H4*        G  26   5.466 -13.100   7.108
  272    H3*    G  26           H3*        G  26   5.722 -15.299   5.385
  273    H2*    G  26           H2*        G  26   5.659 -13.735   3.582
  274   2HO*    G  26          2HO*        G  26   3.161 -15.107   3.795
  275    H1*    G  26           H1*        G  26   3.139 -12.750   4.981
  276    H8     G  26           H8         G  26   5.459 -12.283   1.976
  277    H1     G  26           H1         G  26   0.752  -7.969   2.350
  278   1H2     G  26          1H2         G  26   0.066  -7.861   4.397
  279   2H2     G  26          2H2         G  26   0.511  -9.055   5.604
  280   1H5*    U  27          1H5*        U  27   4.257 -15.848   8.524
  281   2H5*    U  27          2H5*        U  27   3.459 -17.419   8.744
  282    H4*    U  27           H4*        U  27   3.134 -16.454  10.822
  283    H3*    U  27           H3*        U  27   0.677 -15.585   9.231
  284    H2*    U  27           H2*        U  27  -0.011 -14.308  11.139
  285   2HO*    U  27          2HO*        U  27   1.045 -16.064  12.615
  286    H1*    U  27           H1*        U  27   2.362 -13.147  11.631
  287    H3     U  27           H3         U  27  -0.176 -10.058   9.360
  288    H5     U  27           H5         U  27   2.582 -11.619   6.659
  289    H6     U  27           H6         U  27   2.937 -13.506   8.182
  290   1H5*    A  28          1H5*        A  28  -1.080 -15.876  12.844
  291   2H5*    A  28          2H5*        A  28  -2.357 -17.086  12.771
  292    H4*    A  28           H4*        A  28  -3.289 -15.010  13.586
  293    H3*    A  28           H3*        A  28  -4.137 -15.635  10.729
  294    H2*    A  28           H2*        A  28  -5.583 -13.703  10.910
  295   2HO*    A  28          2HO*        A  28  -6.025 -14.172  13.283
  296    H1*    A  28           H1*        A  28  -3.681 -12.112  12.031
  297    H8     A  28           H8         A  28  -1.479 -13.942   9.688
  298   1H6     A  28          1H6         A  28  -3.647 -10.118   5.275
  299   2H6     A  28          2H6         A  28  -2.402 -11.295   5.659
  300    H2     A  28           H2         A  28  -6.649 -10.317   8.526
  301   1H5*    C  29          1H5*        C  29  -7.755 -14.954  11.829
  302   2H5*    C  29          2H5*        C  29  -8.915 -16.189  11.320
  303    H4*    C  29           H4*        C  29  -9.381 -14.096  10.187
  304    H3*    C  29           H3*        C  29  -8.199 -16.168   8.320
  305    H2*    C  29           H2*        C  29  -8.680 -14.566   6.537
  306   2HO*    C  29          2HO*        C  29 -10.728 -13.804   7.636
  307    H1*    C  29           H1*        C  29  -7.617 -12.478   7.813
  308   1H4     C  29          1H4         C  29  -2.750 -15.205   4.720
  309   2H4     C  29          2H4         C  29  -2.304 -16.054   6.181
  310    H5     C  29           H5         C  29  -3.656 -16.073   8.157
  311    H6     C  29           H6         C  29  -5.709 -15.208   9.159
  312   1H5*    C  30          1H5*        C  30 -11.706 -15.255   6.306
  313   2H5*    C  30          2H5*        C  30 -12.519 -16.702   5.697
  314    H4*    C  30           H4*        C  30 -11.964 -15.148   3.887
  315    H3*    C  30           H3*        C  30 -10.279 -17.668   3.801
  316    H2*    C  30           H2*        C  30  -9.618 -16.876   1.597
  317   2HO*    C  30          2HO*        C  30 -11.858 -15.838   1.259
  318    H1*    C  30           H1*        C  30  -9.151 -14.345   2.514
  319   1H4     C  30          1H4         C  30  -3.810 -17.833   2.925
  320   2H4     C  30          2H4         C  30  -4.213 -18.297   4.563
  321    H5     C  30           H5         C  30  -6.280 -17.692   5.632
  322    H6     C  30           H6         C  30  -8.413 -16.528   5.312
  323   1H5*    U  31          1H5*        U  31 -12.231 -17.277  -0.007
  324   2H5*    U  31          2H5*        U  31 -13.111 -18.745  -0.431
  325    H4*    U  31           H4*        U  31 -11.963 -17.867  -2.367
  326    H3*    U  31           H3*        U  31 -10.685 -20.422  -1.376
  327    H2*    U  31           H2*        U  31  -9.405 -20.382  -3.401
  328   2HO*    U  31          2HO*        U  31 -11.270 -19.482  -4.694
  329    H1*    U  31           H1*        U  31  -8.795 -17.720  -3.214
  330    H3     U  31           H3         U  31  -4.965 -20.065  -2.105
  331    H5     U  31           H5         U  31  -7.071 -19.603   1.492
  332    H6     U  31           H6         U  31  -9.012 -18.835   0.206
  333   1H5*    C  32          1H5*        C  32 -11.678 -21.678  -5.001
  334   2H5*    C  32          2H5*        C  32 -12.368 -23.303  -5.060
  335    H4*    C  32           H4*        C  32 -10.278 -23.235  -6.297
  336    H3*    C  32           H3*        C  32  -9.952 -24.741  -3.680
  337    H2*    C  32           H2*        C  32  -7.722 -25.248  -4.452
  338   2HO*    C  32          2HO*        C  32  -8.591 -25.389  -6.799
  339    H1*    C  32           H1*        C  32  -7.219 -22.709  -5.392
  340   1H4     C  32          1H4         C  32  -4.965 -23.319   0.549
  341   2H4     C  32          2H4         C  32  -6.551 -23.022   1.227
  342    H5     C  32           H5         C  32  -8.507 -22.660  -0.116
  343    H6     C  32           H6         C  32  -9.351 -22.587  -2.413
  344   1H5*    U  33          1H5*        U  33  -7.952 -27.219  -5.794
  345   2H5*    U  33          2H5*        U  33  -8.606 -28.858  -5.801
  346    H4*    U  33           H4*        U  33  -6.295 -28.994  -5.104
  347    H3*    U  33           H3*        U  33  -8.201 -29.261  -2.758
  348    H2*    U  33           H2*        U  33  -6.426 -29.649  -1.391
  349   2HO*    U  33          2HO*        U  33  -4.391 -30.021  -3.383
  350    H1*    U  33           H1*        U  33  -4.626 -27.954  -2.766
  351    H3     U  33           H3         U  33  -4.784 -26.494   1.561
  352    H5     U  33           H5         U  33  -8.687 -25.847   0.203
  353    H6     U  33           H6         U  33  -8.043 -26.816  -1.961
  354   1H5*    U  34          1H5*        U  34  -8.197 -34.905  -2.334
  355   2H5*    U  34          2H5*        U  34  -7.535 -33.994  -0.973
  356    H4*    U  34           H4*        U  34  -6.316 -36.078  -1.333
  357    H3*    U  34           H3*        U  34  -5.003 -33.722  -0.831
  358    H2*    U  34           H2*        U  34  -4.645 -33.212  -3.149
  359   2HO*    U  34          2HO*        U  34  -2.382 -34.642  -2.149
  360    H1*    U  34           H1*        U  34  -3.839 -36.125  -3.510
  361    H3     U  34           H3         U  34  -2.727 -35.389  -7.824
  362    H5     U  34           H5         U  34  -6.173 -33.057  -7.390
  363    H6     U  34           H6         U  34  -6.279 -33.745  -5.035
  364   1H5*    C  35          1H5*        C  35  -1.559 -33.859  -0.011
  365   2H5*    C  35          2H5*        C  35  -1.223 -34.810   1.437
  366    H4*    C  35           H4*        C  35  -0.268 -32.582   1.581
  367    H3*    C  35           H3*        C  35  -1.517 -33.757   3.708
  368    H2*    C  35           H2*        C  35  -3.660 -32.811   3.202
  369   2HO*    C  35          2HO*        C  35  -2.301 -31.147   5.071
  370    H1*    C  35           H1*        C  35  -2.354 -30.107   2.749
  371   1H4     C  35          1H4         C  35  -8.517 -29.311   1.275
  372   2H4     C  35          2H4         C  35  -8.422 -30.560   0.044
  373    H5     C  35           H5         C  35  -6.484 -31.909  -0.274
  374    H6     C  35           H6         C  35  -4.133 -32.183   0.317
  375   1H5*    G  36          1H5*        G  36   2.876 -30.388   3.991
  376   2H5*    G  36          2H5*        G  36   1.354 -30.439   3.087
  377    H4*    G  36           H4*        G  36   3.962 -31.723   2.192
  378    H3*    G  36           H3*        G  36   2.443 -29.261   1.255
  379    H2*    G  36           H2*        G  36   3.332 -29.682  -0.902
  380   2HO*    G  36          2HO*        G  36   5.536 -30.198   0.225
  381    H1*    G  36           H1*        G  36   3.422 -32.502  -0.537
  382    H8     G  36           H8         G  36   2.200 -32.881  -2.833
  383    H1     G  36           H1         G  36  -2.576 -28.842  -1.291
  384   1H2     G  36          1H2         G  36  -2.222 -27.940   0.610
  385   2H2     G  36          2H2         G  36  -0.777 -28.254   1.547
  386   1H5*    G  37          1H5*        G  37   5.039 -28.091  -0.612
  387   2H5*    G  37          2H5*        G  37   5.466 -26.380  -0.560
  388    H4*    G  37           H4*        G  37   4.243 -27.239  -2.641
  389    H3*    G  37           H3*        G  37   3.035 -24.906  -1.108
  390    H2*    G  37           H2*        G  37   1.569 -24.756  -3.086
  391   2HO*    G  37          2HO*        G  37   3.406 -25.634  -4.553
  392    H1*    G  37           H1*        G  37   0.967 -27.378  -3.034
  393    H8     G  37           H8         G  37   1.576 -26.256   0.587
  394    H1     G  37           H1         G  37  -3.958 -24.146  -1.904
  395   1H2     G  37          1H2         G  37  -4.029 -24.585  -4.014
  396   2H2     G  37          2H2         G  37  -2.817 -25.575  -4.801
  397   1H5*    U  38          1H5*        U  38   2.669 -23.746  -4.916
  398   2H5*    U  38          2H5*        U  38   3.350 -22.178  -5.323
  399    H4*    U  38           H4*        U  38   1.064 -22.371  -6.104
  400    H3*    U  38           H3*        U  38   1.323 -20.417  -3.840
  401    H2*    U  38           H2*        U  38  -0.884 -19.668  -4.433
  402   2HO*    U  38          2HO*        U  38  -0.755 -19.913  -6.751
  403    H1*    U  38           H1*        U  38  -1.866 -22.210  -4.491
  404    H3     U  38           H3         U  38  -3.202 -20.631  -0.389
  405    H5     U  38           H5         U  38   0.699 -21.994   0.240
  406    H6     U  38           H6         U  38   0.926 -22.304  -2.178
  407   1H5*    G  39          1H5*        G  39   0.439 -17.998  -7.068
  408   2H5*    G  39          2H5*        G  39   1.264 -16.446  -6.951
  409    H4*    G  39           H4*        G  39  -1.101 -16.144  -7.166
  410    H3*    G  39           H3*        G  39  -0.271 -15.447  -4.345
  411    H2*    G  39           H2*        G  39  -2.570 -14.631  -4.145
  412   2HO*    G  39          2HO*        G  39  -2.626 -14.012  -6.558
  413    H1*    G  39           H1*        G  39  -3.600 -16.923  -5.123
  414    H8     G  39           H8         G  39  -0.314 -17.813  -3.349
  415    H1     G  39           H1         G  39  -5.233 -16.706   0.633
  416   1H2     G  39          1H2         G  39  -6.840 -15.744  -0.442
  417   2H2     G  39          2H2         G  39  -6.820 -15.568  -2.183
  418   1H5*    G  40          1H5*        G  40  -2.443 -12.286  -5.666
  419   2H5*    G  40          2H5*        G  40  -1.802 -10.726  -5.129
  420    H4*    G  40           H4*        G  40  -4.164 -10.929  -4.608
  421    H3*    G  40           H3*        G  40  -2.238 -10.807  -2.258
  422    H2*    G  40           H2*        G  40  -4.248 -10.570  -0.892
  423   2HO*    G  40          2HO*        G  40  -5.365  -9.273  -2.696
  424    H1*    G  40           H1*        G  40  -5.577 -12.582  -2.098
  425    H8     G  40           H8         G  40  -2.024 -13.821  -2.193
  426    H1     G  40           H1         G  40  -4.521 -13.830   3.727
  427   1H2     G  40          1H2         G  40  -6.349 -12.686   3.769
  428   2H2     G  40          2H2         G  40  -7.005 -11.931   2.329
  429   1H5*    G  41          1H5*        G  41  -4.618  -8.346  -0.732
  430   2H5*    G  41          2H5*        G  41  -3.854  -6.832  -0.248
  431    H4*    G  41           H4*        G  41  -4.718  -7.858   1.736
  432    H3*    G  41           H3*        G  41  -1.717  -8.222   1.542
  433    H2*    G  41           H2*        G  41  -1.853  -9.001   3.851
  434   2HO*    G  41          2HO*        G  41  -3.652  -7.709   4.592
  435    H1*    G  41           H1*        G  41  -3.746 -10.800   3.237
  436    H8     G  41           H8         G  41  -1.933 -10.408  -0.058
  437    H1     G  41           H1         G  41   1.209 -14.120   4.132
  438   1H2     G  41          1H2         G  41   0.307 -14.007   6.074
  439   2H2     G  41          2H2         G  41  -1.059 -12.969   6.436
  440   1H5*    A  42          1H5*        A  42  -0.723  -4.342   5.152
  441   2H5*    A  42          2H5*        A  42  -0.536  -5.712   6.258
  442    H4*    A  42           H4*        A  42  -3.137  -4.766   4.982
  443    H3*    A  42           H3*        A  42  -2.095  -4.963   7.824
  444    H2*    A  42           H2*        A  42  -4.380  -5.298   8.549
  445   2HO*    A  42          2HO*        A  42  -5.260  -3.856   6.741
  446    H1*    A  42           H1*        A  42  -4.846  -7.260   6.777
  447    H8     A  42           H8         A  42  -1.344  -8.125   6.995
  448   1H6     A  42          1H6         A  42  -2.281 -10.181  12.795
  449   2H6     A  42          2H6         A  42  -1.243 -10.297  11.391
  450    H2     A  42           H2         A  42  -5.774  -7.701  11.650
  451   1H5*    A  43          1H5*        A  43  -4.818  -2.432   8.196
  452   2H5*    A  43          2H5*        A  43  -4.828  -0.854   8.948
  453    H4*    A  43           H4*        A  43  -6.238  -2.323  10.237
  454    H3*    A  43           H3*        A  43  -3.584  -1.848  11.655
  455    H2*    A  43           H2*        A  43  -4.376  -3.284  13.425
  456   2HO*    A  43          2HO*        A  43  -6.675  -2.363  13.084
  457    H1*    A  43           H1*        A  43  -5.466  -5.195  11.740
  458    H8     A  43           H8         A  43  -2.391  -4.409   9.873
  459   1H6     A  43          1H6         A  43   0.659  -8.106  13.805
  460   2H6     A  43          2H6         A  43   0.695  -7.363  12.217
  461    H2     A  43           H2         A  43  -3.210  -7.007  15.690
  462   1H5*    U  44          1H5*        U  44  -5.694  -1.232  14.830
  463   2H5*    U  44          2H5*        U  44  -5.277   0.279  15.658
  464    H4*    U  44           H4*        U  44  -4.635  -1.571  17.071
  465    H3*    U  44           H3*        U  44  -2.231  -0.296  15.723
  466    H2*    U  44           H2*        U  44  -0.891  -1.673  17.163
  467   2HO*    U  44          2HO*        U  44  -2.558  -1.460  18.990
  468    H1*    U  44           H1*        U  44  -2.369  -3.924  16.720
  469    H3     U  44           H3         U  44   1.483  -4.518  14.275
  470    H5     U  44           H5         U  44  -0.883  -2.053  11.863
  471    H6     U  44           H6         U  44  -2.437  -1.801  13.740
  472   1H5*    A  45          1H5*        A  45  -1.191  -0.097  19.677
  473   2H5*    A  45          2H5*        A  45  -0.373   1.414  20.087
  474    H4*    A  45           H4*        A  45   1.031  -0.510  20.579
  475    H3*    A  45           H3*        A  45   2.094   1.090  18.219
  476    H2*    A  45           H2*        A  45   4.078  -0.258  18.492
  477   2HO*    A  45          2HO*        A  45   3.752  -0.403  20.945
  478    H1*    A  45           H1*        A  45   2.670  -2.575  18.579
  479    H8     A  45           H8         A  45   0.667  -0.219  16.348
  480   1H6     A  45          1H6         A  45   4.495  -1.928  11.747
  481   2H6     A  45          2H6         A  45   2.967  -1.160  12.129
  482    H2     A  45           H2         A  45   6.137  -3.495  15.550
  483   1H5*    C  46          1H5*        C  46   5.119   0.987  20.984
  484   2H5*    C  46          2H5*        C  46   5.903   2.554  21.186
  485    H4*    C  46           H4*        C  46   7.529   0.825  20.688
  486    H3*    C  46           H3*        C  46   7.168   2.773  18.377
  487    H2*    C  46           H2*        C  46   9.196   1.770  17.535
  488   2HO*    C  46          2HO*        C  46  10.092   1.449  19.808
  489    H1*    C  46           H1*        C  46   8.314  -0.779  18.037
  490   1H4     C  46          1H4         C  46   6.543   0.645  12.076
  491   2H4     C  46          2H4         C  46   4.999   1.227  12.658
  492    H5     C  46           H5         C  46   4.470   1.454  14.990
  493    H6     C  46           H6         C  46   5.323   1.127  17.267
  494   1H5*    C  47          1H5*        C  47  11.172   3.071  19.436
  495   2H5*    C  47          2H5*        C  47  11.722   4.750  19.430
  496    H4*    C  47           H4*        C  47  13.115   3.365  17.992
  497    H3*    C  47           H3*        C  47  11.369   5.287  16.422
  498    H2*    C  47           H2*        C  47  12.823   4.715  14.567
  499   2HO*    C  47          2HO*        C  47  14.796   4.509  15.969
  500    H1*    C  47           H1*        C  47  12.693   2.030  15.132
  501   1H4     C  47          1H4         C  47   8.029   3.247  10.960
  502   2H4     C  47          2H4         C  47   6.944   3.694  12.257
  503    H5     C  47           H5         C  47   7.620   3.822  14.559
  504    H6     C  47           H6         C  47   9.505   3.522  16.100
  505   1H5*    A  48          1H5*        A  48  15.416   6.347  15.546
  506   2H5*    A  48          2H5*        A  48  15.599   8.099  15.432
  507    H4*    A  48           H4*        A  48  16.455   6.989  13.439
  508    H3*    A  48           H3*        A  48  13.913   8.552  12.902
  509    H2*    A  48           H2*        A  48  14.458   8.188  10.556
  510   2HO*    A  48          2HO*        A  48  16.883   8.266  11.008
  511    H1*    A  48           H1*        A  48  14.889   5.534  10.937
  512    H8     A  48           H8         A  48  12.203   6.492  13.454
  513   1H6     A  48          1H6         A  48   8.139   5.965   8.771
  514   2H6     A  48          2H6         A  48   8.318   6.170  10.501
  515    H2     A  48           H2         A  48  12.232   5.788   7.060
  516   1H5*    G  49          1H5*        G  49  16.761  10.106  10.259
  517   2H5*    G  49          2H5*        G  49  16.684  11.865  10.139
  518    H4*    G  49           H4*        G  49  16.585  10.818   7.943
  519    H3*    G  49           H3*        G  49  13.948  12.120   8.722
  520    H2*    G  49           H2*        G  49  13.349  11.710   6.389
  521   2HO*    G  49          2HO*        G  49  15.748  12.014   5.716
  522    H1*    G  49           H1*        G  49  14.208   9.138   6.450
  523    H8     G  49           H8         G  49  12.907   9.663   9.958
  524    H1     G  49           H1         G  49   8.236   9.220   5.560
  525   1H2     G  49          1H2         G  49   9.047   9.562   3.588
  526   2H2     G  49          2H2         G  49  10.772   9.657   3.298
  527   1H5*    G  50          1H5*        G  50  14.729  13.578   5.018
  528   2H5*    G  50          2H5*        G  50  14.586  15.324   4.873
  529    H4*    G  50           H4*        G  50  13.318  14.170   3.136
  530    H3*    G  50           H3*        G  50  11.547  15.610   5.139
  531    H2*    G  50           H2*        G  50   9.734  15.074   3.576
  532   2HO*    G  50          2HO*        G  50  11.361  15.268   1.670
  533    H1*    G  50           H1*        G  50  10.527  12.482   3.253
  534    H8     G  50           H8         G  50  11.334  12.916   6.871
  535    H1     G  50           H1         G  50   5.021  12.371   5.719
  536   1H2     G  50          1H2         G  50   4.634  12.593   3.619
  537   2H2     G  50          2H2         G  50   5.882  13.073   2.486
  538   1H5*    U  51          1H5*        U  51  10.294  16.836   1.438
  539   2H5*    U  51          2H5*        U  51  10.435  18.564   1.126
  540    H4*    U  51           H4*        U  51   8.253  17.737   0.424
  541    H3*    U  51           H3*        U  51   8.624  19.963   2.085
  542    H2*    U  51           H2*        U  51   7.919  19.004   4.012
  543   2HO*    U  51          2HO*        U  51   5.230  19.319   3.118
  544    H1*    U  51           H1*        U  51   5.843  17.305   2.636
  545    H3     U  51           H3         U  51   4.704  15.602   6.608
  546    H5     U  51           H5         U  51   8.813  16.243   7.082
  547    H6     U  51           H6         U  51   8.917  16.962   4.740
  548   1H5*    G  52          1H5*        G  52   7.609  22.007  -2.081
  549   2H5*    G  52          2H5*        G  52   5.993  22.185  -2.735
  550    H4*    G  52           H4*        G  52   7.427  19.533  -2.291
  551    H3*    G  52           H3*        G  52   6.579  21.164  -4.725
  552    H2*    G  52           H2*        G  52   6.578  19.093  -5.945
  553   2HO*    G  52          2HO*        G  52   8.488  18.232  -4.653
  554    H1*    G  52           H1*        G  52   5.207  17.784  -3.969
  555    H8     G  52           H8         G  52   3.838  21.333  -4.026
  556    H1     G  52           H1         G  52   1.376  17.452  -8.526
  557   1H2     G  52          1H2         G  52   2.694  15.777  -8.861
  558   2H2     G  52          2H2         G  52   4.110  15.491  -7.869
  559   1H5*    C  53          1H5*        C  53   9.492  18.761  -6.465
  560   2H5*    C  53          2H5*        C  53  10.487  19.688  -7.593
  561    H4*    C  53           H4*        C  53   9.491  17.766  -8.685
  562    H3*    C  53           H3*        C  53   8.241  20.354  -9.672
  563    H2*    C  53           H2*        C  53   7.294  18.950 -11.402
  564   2HO*    C  53          2HO*        C  53   9.288  17.492 -11.424
  565    H1*    C  53           H1*        C  53   6.484  17.042  -9.622
  566   1H4     C  53          1H4         C  53   1.612  21.106 -10.045
  567   2H4     C  53          2H4         C  53   2.290  22.084  -8.762
  568    H5     C  53           H5         C  53   4.499  21.759  -7.886
  569    H6     C  53           H6         C  53   6.439  20.265  -7.910
  570   1H5*    C  54          1H5*        C  54   9.665  18.511 -13.132
  571   2H5*    C  54          2H5*        C  54  10.413  19.673 -14.231
  572    H4*    C  54           H4*        C  54   8.659  18.411 -15.350
  573    H3*    C  54           H3*        C  54   7.876  21.316 -14.917
  574    H2*    C  54           H2*        C  54   6.070  20.817 -16.446
  575   2HO*    C  54          2HO*        C  54   7.488  19.239 -17.717
  576    H1*    C  54           H1*        C  54   5.440  18.475 -15.173
  577   1H4     C  54          1H4         C  54   1.920  23.013 -12.418
  578   2H4     C  54          2H4         C  54   3.193  23.327 -11.260
  579    H5     C  54           H5         C  54   5.371  22.328 -11.393
  580    H6     C  54           H6         C  54   6.755  20.734 -12.638
  581   1H5*    C  55          1H5*        C  55   7.473  20.799 -19.037
  582   2H5*    C  55          2H5*        C  55   8.183  22.159 -19.915
  583    H4*    C  55           H4*        C  55   5.865  21.810 -20.584
  584    H3*    C  55           H3*        C  55   6.313  24.347 -18.977
  585    H2*    C  55           H2*        C  55   4.071  24.936 -19.553
  586   2HO*    C  55          2HO*        C  55   4.284  24.060 -21.809
  587    H1*    C  55           H1*        C  55   3.063  22.381 -19.171
  588   1H4     C  55          1H4         C  55   2.041  25.827 -13.888
  589   2H4     C  55          2H4         C  55   3.656  25.480 -13.313
  590    H5     C  55           H5         C  55   5.262  24.219 -14.572
  591    H6     C  55           H6         C  55   5.661  23.061 -16.696
  592   1H    MET 104          1H        MET 104  10.212 -15.362   3.500
  593    HA   MET 104           HA       MET 104  10.947 -12.535   2.951
  594   1HB   MET 104          1HB       MET 104  12.785 -13.649   4.312
  595   2HB   MET 104          2HB       MET 104  13.009 -14.789   2.994
  596   1HG   MET 104          1HG       MET 104  14.399 -13.366   2.012
  597   2HG   MET 104          2HG       MET 104  13.119 -12.176   1.820
  598   1HE   MET 104          1HE       MET 104  12.312 -10.934   4.296
  599   2HE   MET 104          2HE       MET 104  13.553  -9.821   4.897
  600   3HE   MET 104          3HE       MET 104  13.132  -9.811   3.175
  601    H    TYR 105           H        TYR 105  10.666 -12.070   0.858
  602    HA   TYR 105           HA       TYR 105  10.256 -14.349  -1.052
  603   1HB   TYR 105          1HB       TYR 105   9.017 -11.597  -0.778
  604   2HB   TYR 105          2HB       TYR 105   8.965 -12.452  -2.312
  605    HD1  TYR 105           HD1      TYR 105   8.145 -13.122   1.421
  606    HD2  TYR 105           HD2      TYR 105   7.375 -14.085  -2.752
  607    HE1  TYR 105           HE1      TYR 105   6.483 -14.789   2.096
  608    HE2  TYR 105           HE2      TYR 105   5.551 -15.607  -2.025
  609    HH   TYR 105           HH       TYR 105   4.736 -16.096   1.427
  610    H    VAL 106           H        VAL 106  11.649 -14.642  -2.661
  611    HA   VAL 106           HA       VAL 106  13.746 -12.540  -3.051
  612    HB   VAL 106           HB       VAL 106  13.826 -15.541  -3.526
  613   1HG1  VAL 106          1HG1      VAL 106  16.289 -15.292  -3.612
  614   2HG1  VAL 106          2HG1      VAL 106  15.513 -14.429  -4.927
  615   3HG1  VAL 106          3HG1      VAL 106  16.120 -13.529  -3.516
  616   1HG2  VAL 106          1HG2      VAL 106  13.644 -15.054  -1.137
  617   2HG2  VAL 106          2HG2      VAL 106  15.258 -15.647  -1.562
  618   3HG2  VAL 106          3HG2      VAL 106  15.001 -13.898  -1.269
  619    H    CYS 107           H        CYS 107  14.323 -11.787  -5.023
  620    HA   CYS 107           HA       CYS 107  12.688 -12.413  -7.368
  621   1HB   CYS 107          1HB       CYS 107  13.501 -10.106  -6.903
  622   2HB   CYS 107          2HB       CYS 107  15.167 -10.682  -7.018
  623    H    HIS 108           H        HIS 108  13.154 -13.861  -8.902
  624    HA   HIS 108           HA       HIS 108  15.800 -15.239  -8.755
  625   1HB   HIS 108          1HB       HIS 108  13.107 -16.270  -9.760
  626   2HB   HIS 108          2HB       HIS 108  14.618 -17.191  -9.744
  627    HD2  HIS 108           HD2      HIS 108  11.648 -17.265  -7.846
  628    HE1  HIS 108           HE1      HIS 108  14.513 -17.333  -4.676
  629    HE2  HIS 108           HE2      HIS 108  12.068 -17.742  -5.290
  630    H    PHE 109           H        PHE 109  15.009 -12.714 -10.288
  631    HA   PHE 109           HA       PHE 109  15.114 -13.327 -13.112
  632   1HB   PHE 109          1HB       PHE 109  14.650 -11.041 -11.837
  633   2HB   PHE 109          2HB       PHE 109  16.392 -10.845 -11.896
  634    HD1  PHE 109           HD1      PHE 109  13.251 -10.849 -13.703
  635    HD2  PHE 109           HD2      PHE 109  17.530 -10.485 -14.032
  636    HE1  PHE 109           HE1      PHE 109  12.965 -10.033 -16.038
  637    HE2  PHE 109           HE2      PHE 109  17.252  -9.631 -16.393
  638    HZ   PHE 109           HZ       PHE 109  14.955  -9.396 -17.373
  639    H    GLU 110           H        GLU 110  16.995 -13.159 -14.518
  640    HA   GLU 110           HA       GLU 110  19.002 -14.942 -13.759
  641   1HB   GLU 110          1HB       GLU 110  19.060 -12.801 -15.939
  642   2HB   GLU 110          2HB       GLU 110  20.238 -14.113 -15.786
  643   1HG   GLU 110          1HG       GLU 110  18.391 -15.779 -15.985
  644   2HG   GLU 110          2HG       GLU 110  17.243 -14.460 -16.231
  645    H    ASN 111           H        ASN 111  20.462 -14.744 -12.166
  646    HA   ASN 111           HA       ASN 111  22.402 -14.056 -11.113
  647   1HB   ASN 111          1HB       ASN 111  23.055 -13.352 -13.541
  648   2HB   ASN 111          2HB       ASN 111  22.655 -11.706 -13.043
  649   1HD2  ASN 111          1HD2      ASN 111  24.731 -10.836 -13.105
  650   2HD2  ASN 111          2HD2      ASN 111  26.020 -11.413 -12.058
  651    H    CYS 112           H        CYS 112  19.546 -12.720 -10.782
  652    HA   CYS 112           HA       CYS 112  20.227 -10.119  -9.603
  653   1HB   CYS 112          1HB       CYS 112  18.140 -10.459 -10.837
  654   2HB   CYS 112          2HB       CYS 112  17.574 -11.640  -9.631
  655    H    GLY 113           H        GLY 113  18.169 -12.710  -8.161
  656   1HA   GLY 113          1HA       GLY 113  18.263 -13.807  -6.126
  657   2HA   GLY 113          2HA       GLY 113  19.969 -13.333  -6.021
  658    H    LYS 114           H        LYS 114  17.801 -10.619  -6.351
  659    HA   LYS 114           HA       LYS 114  18.453  -9.623  -3.697
  660   1HB   LYS 114          1HB       LYS 114  17.871  -8.372  -5.908
  661   2HB   LYS 114          2HB       LYS 114  16.188  -8.555  -5.402
  662   1HG   LYS 114          1HG       LYS 114  16.603  -7.224  -3.405
  663   2HG   LYS 114          2HG       LYS 114  18.367  -7.324  -3.635
  664   1HD   LYS 114          1HD       LYS 114  18.208  -6.036  -5.726
  665   2HD   LYS 114          2HD       LYS 114  16.456  -6.023  -5.577
  666   1HE   LYS 114          1HE       LYS 114  17.253  -3.893  -5.019
  667   2HE   LYS 114          2HE       LYS 114  16.562  -4.645  -3.571
  668   1HZ   LYS 114          1HZ       LYS 114  19.476  -4.473  -4.181
  669   2HZ   LYS 114          2HZ       LYS 114  18.693  -3.543  -3.095
  670   3HZ   LYS 114          3HZ       LYS 114  18.840  -5.144  -2.831
  671    H    ALA 115           H        ALA 115  17.182  -9.442  -1.839
  672    HA   ALA 115           HA       ALA 115  14.722 -11.160  -1.807
  673   1HB   ALA 115          1HB       ALA 115  16.835 -10.810   0.365
  674   2HB   ALA 115          2HB       ALA 115  15.388 -11.848   0.441
  675   3HB   ALA 115          3HB       ALA 115  16.665 -12.210  -0.729
  676    H    PHE 116           H        PHE 116  12.902 -10.425  -0.838
  677    HA   PHE 116           HA       PHE 116  13.017  -7.721   0.449
  678   1HB   PHE 116          1HB       PHE 116  10.737  -8.836  -1.230
  679   2HB   PHE 116          2HB       PHE 116  10.955  -7.218  -0.611
  680    HD1  PHE 116           HD1      PHE 116  12.296  -5.578  -1.805
  681    HD2  PHE 116           HD2      PHE 116  12.205  -9.698  -3.077
  682    HE1  PHE 116           HE1      PHE 116  13.799  -5.047  -3.738
  683    HE2  PHE 116           HE2      PHE 116  13.676  -9.171  -4.973
  684    HZ   PHE 116           HZ       PHE 116  14.508  -6.895  -5.275
  685    H    LYS 117           H        LYS 117  11.378  -7.219   1.985
  686    HA   LYS 117           HA       LYS 117  10.791  -9.312   3.822
  687   1HB   LYS 117          1HB       LYS 117  10.997  -6.867   4.367
  688   2HB   LYS 117          2HB       LYS 117   9.423  -6.572   3.600
  689   1HG   LYS 117          1HG       LYS 117   8.313  -8.007   5.192
  690   2HG   LYS 117          2HG       LYS 117   9.863  -8.605   5.787
  691   1HD   LYS 117          1HD       LYS 117  10.193  -6.066   6.494
  692   2HD   LYS 117          2HD       LYS 117   8.443  -5.958   6.224
  693   1HE   LYS 117          1HE       LYS 117   8.938  -6.468   8.581
  694   2HE   LYS 117          2HE       LYS 117   8.034  -7.779   7.795
  695   1HZ   LYS 117          1HZ       LYS 117   9.906  -8.511   9.214
  696   2HZ   LYS 117          2HZ       LYS 117   9.953  -9.094   7.697
  697   3HZ   LYS 117          3HZ       LYS 117  10.962  -7.830   8.110
  698    H    LYS 118           H        LYS 118   8.810  -7.736   1.276
  699    HA   LYS 118           HA       LYS 118   6.705  -9.832   1.732
  700   1HB   LYS 118          1HB       LYS 118   6.294  -6.851   1.219
  701   2HB   LYS 118          2HB       LYS 118   5.001  -8.024   1.356
  702   1HG   LYS 118          1HG       LYS 118   7.002  -7.438   3.593
  703   2HG   LYS 118          2HG       LYS 118   5.480  -6.591   3.427
  704   1HD   LYS 118          1HD       LYS 118   4.165  -8.405   3.905
  705   2HD   LYS 118          2HD       LYS 118   5.392  -9.570   3.414
  706   1HE   LYS 118          1HE       LYS 118   5.647  -8.080   6.009
  707   2HE   LYS 118          2HE       LYS 118   4.700  -9.583   5.826
  708   1HZ   LYS 118          1HZ       LYS 118   7.117  -9.888   6.482
  709   2HZ   LYS 118          2HZ       LYS 118   6.453 -10.815   5.332
  710   3HZ   LYS 118          3HZ       LYS 118   7.457  -9.625   4.899
  711    H    HIS 119           H        HIS 119   5.473 -10.477  -0.070
  712    HA   HIS 119           HA       HIS 119   6.930 -10.616  -2.517
  713   1HB   HIS 119          1HB       HIS 119   4.882 -11.632  -3.457
  714   2HB   HIS 119          2HB       HIS 119   5.408 -12.328  -1.953
  715    HD1  HIS 119           HD1      HIS 119   2.599  -9.674  -2.778
  716    HD2  HIS 119           HD2      HIS 119   3.572 -13.173  -0.614
  717    HE1  HIS 119           HE1      HIS 119   0.413 -10.459  -1.613
  718    HE2  HIS 119           HE2      HIS 119   1.041 -12.557  -0.320
  719    H    ASN 120           H        ASN 120   4.498  -8.292  -1.402
  720    HA   ASN 120           HA       ASN 120   3.910  -7.135  -3.969
  721   1HB   ASN 120          1HB       ASN 120   3.659  -6.221  -1.082
  722   2HB   ASN 120          2HB       ASN 120   3.470  -5.044  -2.388
  723   1HD2  ASN 120          1HD2      ASN 120   1.562  -7.123  -0.495
  724   2HD2  ASN 120          2HD2      ASN 120   0.320  -7.371  -1.726
  725    H    GLN 121           H        GLN 121   6.614  -6.729  -1.675
  726    HA   GLN 121           HA       GLN 121   7.793  -4.440  -3.098
  727   1HB   GLN 121          1HB       GLN 121   9.128  -6.369  -1.194
  728   2HB   GLN 121          2HB       GLN 121   9.691  -4.762  -1.711
  729   1HG   GLN 121          1HG       GLN 121   7.792  -3.740  -0.534
  730   2HG   GLN 121          2HG       GLN 121   7.340  -5.348   0.085
  731   1HE2  GLN 121          1HE2      GLN 121   8.616  -2.662   1.281
  732   2HE2  GLN 121          2HE2      GLN 121   9.836  -3.336   2.352
  733    H    LEU 122           H        LEU 122   8.186  -8.030  -3.035
  734    HA   LEU 122           HA       LEU 122  10.347  -8.199  -4.851
  735   1HB   LEU 122          1HB       LEU 122   9.596 -10.113  -3.570
  736   2HB   LEU 122          2HB       LEU 122   8.001 -10.058  -4.294
  737    HG   LEU 122           HG       LEU 122   8.810 -10.804  -6.429
  738   1HD1  LEU 122          1HD1      LEU 122  11.077 -11.441  -6.753
  739   2HD1  LEU 122          2HD1      LEU 122  11.073  -9.737  -6.343
  740   3HD1  LEU 122          3HD1      LEU 122  11.529 -10.927  -5.098
  741   1HD2  LEU 122          1HD2      LEU 122   9.555 -13.060  -5.826
  742   2HD2  LEU 122          2HD2      LEU 122   9.985 -12.547  -4.192
  743   3HD2  LEU 122          3HD2      LEU 122   8.282 -12.541  -4.708
  744    H    LYS 123           H        LYS 123   6.790  -8.344  -5.529
  745    HA   LYS 123           HA       LYS 123   6.902  -8.288  -8.336
  746   1HB   LYS 123          1HB       LYS 123   4.880  -7.109  -6.379
  747   2HB   LYS 123          2HB       LYS 123   4.650  -7.045  -8.131
  748   1HG   LYS 123          1HG       LYS 123   4.867  -9.512  -8.272
  749   2HG   LYS 123          2HG       LYS 123   5.005  -9.611  -6.520
  750   1HD   LYS 123          1HD       LYS 123   2.588  -8.567  -8.069
  751   2HD   LYS 123          2HD       LYS 123   2.750 -10.167  -7.330
  752   1HE   LYS 123          1HE       LYS 123   3.083  -9.007  -5.100
  753   2HE   LYS 123          2HE       LYS 123   2.643  -7.484  -5.890
  754   1HZ   LYS 123          1HZ       LYS 123   0.912  -9.901  -5.696
  755   2HZ   LYS 123          2HZ       LYS 123   0.708  -8.492  -4.854
  756   3HZ   LYS 123          3HZ       LYS 123   0.501  -8.516  -6.472
  757    H    VAL 124           H        VAL 124   7.019  -5.528  -6.028
  758    HA   VAL 124           HA       VAL 124   7.068  -3.411  -7.929
  759    HB   VAL 124           HB       VAL 124   8.166  -3.746  -5.142
  760   1HG1  VAL 124          1HG1      VAL 124   8.484  -1.226  -6.796
  761   2HG1  VAL 124          2HG1      VAL 124   8.605  -1.311  -5.026
  762   3HG1  VAL 124          3HG1      VAL 124   9.781  -2.167  -6.023
  763   1HG2  VAL 124          1HG2      VAL 124   6.356  -2.524  -4.527
  764   2HG2  VAL 124          2HG2      VAL 124   6.257  -1.722  -6.138
  765   3HG2  VAL 124          3HG2      VAL 124   5.691  -3.387  -5.900
  766    H    HIS 125           H        HIS 125   9.750  -5.411  -6.606
  767    HA   HIS 125           HA       HIS 125  11.820  -3.934  -7.894
  768   1HB   HIS 125          1HB       HIS 125  12.262  -5.322  -5.987
  769   2HB   HIS 125          2HB       HIS 125  11.677  -6.772  -6.805
  770    HD1  HIS 125           HD1      HIS 125  14.656  -4.320  -7.011
  771    HD2  HIS 125           HD2      HIS 125  13.308  -8.096  -8.305
  772    HE1  HIS 125           HE1      HIS 125  16.671  -5.474  -8.045
  773    H    GLN 126           H        GLN 126  10.097  -6.977  -8.819
  774    HA   GLN 126           HA       GLN 126  11.673  -7.480 -11.148
  775   1HB   GLN 126          1HB       GLN 126   8.868  -8.389 -10.355
  776   2HB   GLN 126          2HB       GLN 126   9.715  -8.917 -11.843
  777   1HG   GLN 126          1HG       GLN 126  11.715  -9.497 -10.387
  778   2HG   GLN 126          2HG       GLN 126  10.741  -9.212  -8.955
  779   1HE2  GLN 126          1HE2      GLN 126  12.138 -11.540  -9.516
  780   2HE2  GLN 126          2HE2      GLN 126  10.953 -12.854  -9.753
  781    H    PHE 127           H        PHE 127   8.794  -5.463 -10.644
  782    HA   PHE 127           HA       PHE 127   8.065  -4.985 -13.333
  783   1HB   PHE 127          1HB       PHE 127   6.619  -3.723 -12.371
  784   2HB   PHE 127          2HB       PHE 127   7.339  -4.033 -10.847
  785    HD1  PHE 127           HD1      PHE 127   7.262  -2.261  -9.529
  786    HD2  PHE 127           HD2      PHE 127   8.059  -1.487 -13.672
  787    HE1  PHE 127           HE1      PHE 127   7.731  -0.001  -8.919
  788    HE2  PHE 127           HE2      PHE 127   8.430   0.871 -13.166
  789    HZ   PHE 127           HZ       PHE 127   8.433   1.661 -10.768
  790    H    SER 128           H        SER 128  10.870  -3.857 -11.496
  791    HA   SER 128           HA       SER 128  11.646  -1.727 -13.319
  792   1HB   SER 128          1HB       SER 128  12.418  -2.036 -10.926
  793   2HB   SER 128          2HB       SER 128  13.462  -3.361 -11.498
  794    HG   SER 128           HG       SER 128  14.542  -1.313 -11.434
  795    H    HIS 129           H        HIS 129  12.617  -5.212 -12.972
  796    HA   HIS 129           HA       HIS 129  14.493  -5.215 -15.161
  797   1HB   HIS 129          1HB       HIS 129  12.816  -7.472 -13.985
  798   2HB   HIS 129          2HB       HIS 129  14.089  -7.653 -15.164
  799    HD1  HIS 129           HD1      HIS 129  16.674  -7.105 -14.242
  800    HD2  HIS 129           HD2      HIS 129  13.542  -8.132 -11.669
  801    HE1  HIS 129           HE1      HIS 129  17.735  -8.118 -12.135
  802    H    THR 130           H        THR 130  10.975  -5.798 -14.965
  803    HA   THR 130           HA       THR 130  10.756  -6.583 -17.787
  804    HB   THR 130           HB       THR 130   8.314  -6.538 -17.341
  805    HG1  THR 130           HG1      THR 130   9.130  -5.418 -14.917
  806   1HG2  THR 130          1HG2      THR 130   9.577  -7.826 -14.862
  807   2HG2  THR 130          2HG2      THR 130   8.138  -8.307 -15.755
  808   3HG2  THR 130          3HG2      THR 130   9.750  -8.540 -16.479
  809    H    GLN 131           H        GLN 131  10.748  -3.614 -15.996
  810    HA   GLN 131           HA       GLN 131  10.368  -1.426 -16.516
  811   1HB   GLN 131          1HB       GLN 131  11.851  -2.304 -18.593
  812   2HB   GLN 131          2HB       GLN 131  10.381  -1.924 -19.488
  813   1HG   GLN 131          1HG       GLN 131  11.264   0.191 -19.508
  814   2HG   GLN 131          2HG       GLN 131  10.560   0.325 -17.896
  815   1HE2  GLN 131          1HE2      GLN 131  12.435  -1.053 -16.203
  816   2HE2  GLN 131          2HE2      GLN 131  13.966  -0.240 -16.403
  817    H    GLN 132           H        GLN 132   8.049  -3.304 -16.273
  818    HA   GLN 132           HA       GLN 132   6.066  -1.377 -17.440
  819   1HB   GLN 132          1HB       GLN 132   4.439  -3.158 -17.738
  820   2HB   GLN 132          2HB       GLN 132   5.855  -3.367 -18.755
  821   1HG   GLN 132          1HG       GLN 132   5.172  -5.525 -18.071
  822   2HG   GLN 132          2HG       GLN 132   6.657  -5.143 -17.225
  823   1HE2  GLN 132          1HE2      GLN 132   6.643  -5.482 -15.053
  824   2HE2  GLN 132          2HE2      GLN 132   5.191  -5.612 -14.047
  825    H    LEU 133           H        LEU 133   4.081  -1.185 -16.141
  826    HA   LEU 133           HA       LEU 133   4.892  -1.200 -13.310
  827   1HB   LEU 133          1HB       LEU 133   2.832   0.330 -14.910
  828   2HB   LEU 133          2HB       LEU 133   2.808   0.402 -13.142
  829    HG   LEU 133           HG       LEU 133   5.403   0.930 -14.735
  830   1HD1  LEU 133          1HD1      LEU 133   4.938   3.323 -14.501
  831   2HD1  LEU 133          2HD1      LEU 133   3.675   2.553 -15.473
  832   3HD1  LEU 133          3HD1      LEU 133   3.354   2.975 -13.773
  833   1HD2  LEU 133          1HD2      LEU 133   4.592   1.826 -11.983
  834   2HD2  LEU 133          2HD2      LEU 133   5.628   0.419 -12.317
  835   3HD2  LEU 133          3HD2      LEU 133   6.152   2.042 -12.779
  836    HA   PRO 134           HA       PRO 134   2.268  -4.617 -12.485
  837   1HB   PRO 134          1HB       PRO 134   2.459  -4.429  -9.668
  838   2HB   PRO 134          2HB       PRO 134   3.587  -5.297 -10.755
  839   1HG   PRO 134          1HG       PRO 134   3.989  -2.806  -9.252
  840   2HG   PRO 134          2HG       PRO 134   5.178  -3.812 -10.094
  841   1HD   PRO 134          1HD       PRO 134   4.052  -1.303 -10.925
  842   2HD   PRO 134          2HD       PRO 134   5.173  -2.356 -11.786
  843    H    TYR 135           H        TYR 135   1.631  -1.596 -10.679
  844    HA   TYR 135           HA       TYR 135  -1.023  -2.621  -9.846
  845   1HB   TYR 135          1HB       TYR 135   0.477  -0.105  -8.980
  846   2HB   TYR 135          2HB       TYR 135  -0.979  -0.747  -8.253
  847    HD1  TYR 135           HD1      TYR 135  -0.971  -2.966  -7.118
  848    HD2  TYR 135           HD2      TYR 135   2.657  -0.980  -8.345
  849    HE1  TYR 135           HE1      TYR 135   0.407  -4.564  -5.729
  850    HE2  TYR 135           HE2      TYR 135   4.000  -2.445  -6.830
  851    HH   TYR 135           HH       TYR 135   3.961  -4.384  -5.536
  852    H    GLU 136           H        GLU 136  -2.431  -2.354 -11.529
  853    HA   GLU 136           HA       GLU 136  -2.412   0.276 -12.957
  854   1HB   GLU 136          1HB       GLU 136  -3.729  -2.356 -13.764
  855   2HB   GLU 136          2HB       GLU 136  -3.587  -0.895 -14.750
  856   1HG   GLU 136          1HG       GLU 136  -1.105  -1.131 -14.714
  857   2HG   GLU 136          2HG       GLU 136  -1.256  -2.629 -13.795
  858    H    CYS 137           H        CYS 137  -4.204   1.575 -12.989
  859    HA   CYS 137           HA       CYS 137  -6.343   1.097 -11.069
  860   1HB   CYS 137          1HB       CYS 137  -5.566   3.346 -11.436
  861   2HB   CYS 137          2HB       CYS 137  -5.850   3.239 -13.160
  862    HA   PRO 138           HA       PRO 138  -8.665  -1.165 -14.148
  863   1HB   PRO 138          1HB       PRO 138 -10.365  -2.496 -12.518
  864   2HB   PRO 138          2HB       PRO 138  -8.597  -2.732 -12.374
  865   1HG   PRO 138          1HG       PRO 138 -10.362  -0.870 -10.731
  866   2HG   PRO 138          2HG       PRO 138  -9.181  -2.075 -10.132
  867   1HD   PRO 138          1HD       PRO 138  -8.584   0.614 -10.480
  868   2HD   PRO 138          2HD       PRO 138  -7.374  -0.701 -10.632
  869    H    HIS 139           H        HIS 139  -9.693   1.675 -12.753
  870    HA   HIS 139           HA       HIS 139 -12.554   1.516 -12.856
  871   1HB   HIS 139          1HB       HIS 139 -11.175   3.275 -11.678
  872   2HB   HIS 139          2HB       HIS 139 -10.824   3.994 -13.254
  873    HD2  HIS 139           HD2      HIS 139 -12.638   5.633 -14.221
  874    HE1  HIS 139           HE1      HIS 139 -15.859   4.781 -11.559
  875    HE2  HIS 139           HE2      HIS 139 -15.085   6.265 -13.480
  876    H    GLU 140           H        GLU 140 -14.061   2.226 -14.399
  877    HA   GLU 140           HA       GLU 140 -13.421   1.651 -17.141
  878   1HB   GLU 140          1HB       GLU 140 -15.839   3.024 -15.872
  879   2HB   GLU 140          2HB       GLU 140 -15.727   2.550 -17.573
  880   1HG   GLU 140          1HG       GLU 140 -15.385   0.179 -16.880
  881   2HG   GLU 140          2HG       GLU 140 -15.572   0.652 -15.191
  882    H    GLY 141           H        GLY 141 -12.405   2.898 -18.599
  883   1HA   GLY 141          1HA       GLY 141 -12.156   4.849 -19.925
  884   2HA   GLY 141          2HA       GLY 141 -12.961   5.810 -18.671
  885    H    CYS 142           H        CYS 142 -10.739   3.942 -17.035
  886    HA   CYS 142           HA       CYS 142  -8.641   6.072 -17.185
  887   1HB   CYS 142          1HB       CYS 142  -9.985   5.601 -15.009
  888   2HB   CYS 142          2HB       CYS 142  -9.060   4.110 -14.907
  889    H    ASP 143           H        ASP 143  -6.407   5.398 -17.013
  890    HA   ASP 143           HA       ASP 143  -5.790   2.530 -17.443
  891   1HB   ASP 143          1HB       ASP 143  -6.250   3.671 -19.714
  892   2HB   ASP 143          2HB       ASP 143  -4.800   4.628 -19.422
  893    H    LYS 144           H        LYS 144  -5.249   5.017 -15.553
  894    HA   LYS 144           HA       LYS 144  -2.408   5.534 -15.654
  895   1HB   LYS 144          1HB       LYS 144  -4.674   6.080 -13.780
  896   2HB   LYS 144          2HB       LYS 144  -3.136   5.808 -13.006
  897   1HG   LYS 144          1HG       LYS 144  -3.230   8.127 -13.282
  898   2HG   LYS 144          2HG       LYS 144  -2.074   7.536 -14.468
  899   1HD   LYS 144          1HD       LYS 144  -3.322   9.156 -15.647
  900   2HD   LYS 144          2HD       LYS 144  -4.003   7.623 -16.175
  901   1HE   LYS 144          1HE       LYS 144  -5.936   8.807 -15.764
  902   2HE   LYS 144          2HE       LYS 144  -5.723   7.996 -14.213
  903   1HZ   LYS 144          1HZ       LYS 144  -4.976  10.823 -14.837
  904   2HZ   LYS 144          2HZ       LYS 144  -6.222  10.339 -13.922
  905   3HZ   LYS 144          3HZ       LYS 144  -4.712  10.106 -13.371
  906    H    ARG 145           H        ARG 145  -0.684   4.566 -14.606
  907    HA   ARG 145           HA       ARG 145  -1.205   2.043 -13.051
  908   1HB   ARG 145          1HB       ARG 145   1.112   2.218 -15.009
  909   2HB   ARG 145          2HB       ARG 145   0.298   0.799 -14.290
  910   1HG   ARG 145          1HG       ARG 145  -1.728   1.317 -15.671
  911   2HG   ARG 145          2HG       ARG 145  -0.826   2.653 -16.423
  912   1HD   ARG 145          1HD       ARG 145   0.809   1.035 -17.320
  913   2HD   ARG 145          2HD       ARG 145  -0.201  -0.280 -16.703
  914    HE   ARG 145           HE       ARG 145  -1.519   1.767 -18.412
  915   1HH1  ARG 145          1HH1      ARG 145  -0.633  -1.617 -18.258
  916   2HH1  ARG 145          2HH1      ARG 145  -0.941  -1.851 -19.955
  917   1HH2  ARG 145          1HH2      ARG 145  -2.304   1.272 -20.373
  918   2HH2  ARG 145          2HH2      ARG 145  -1.977  -0.289 -21.090
  919    H    PHE 146           H        PHE 146   0.351   1.510 -11.523
  920    HA   PHE 146           HA       PHE 146   2.165   3.769 -10.773
  921   1HB   PHE 146          1HB       PHE 146   0.383   2.170  -8.863
  922   2HB   PHE 146          2HB       PHE 146   1.376   3.535  -8.479
  923    HD1  PHE 146           HD1      PHE 146  -1.768   2.534 -10.151
  924    HD2  PHE 146           HD2      PHE 146   0.896   5.808  -9.216
  925    HE1  PHE 146           HE1      PHE 146  -3.472   4.112 -10.896
  926    HE2  PHE 146           HE2      PHE 146  -0.801   7.408 -10.066
  927    HZ   PHE 146           HZ       PHE 146  -2.934   6.572 -10.964
  928    H    SER 147           H        SER 147   3.806   3.271  -9.243
  929    HA   SER 147           HA       SER 147   5.080   0.734  -9.924
  930   1HB   SER 147          1HB       SER 147   6.887   1.856  -8.322
  931   2HB   SER 147          2HB       SER 147   6.581   2.510  -9.945
  932    HG   SER 147           HG       SER 147   5.940   4.285  -9.112
  933    H    LEU 148           H        LEU 148   3.318   2.103  -7.192
  934    HA   LEU 148           HA       LEU 148   3.926  -0.373  -5.614
  935   1HB   LEU 148          1HB       LEU 148   4.090   2.517  -4.781
  936   2HB   LEU 148          2HB       LEU 148   3.498   1.392  -3.608
  937    HG   LEU 148           HG       LEU 148   5.836   1.896  -3.265
  938   1HD1  LEU 148          1HD1      LEU 148   5.166  -0.946  -4.045
  939   2HD1  LEU 148          2HD1      LEU 148   6.690  -0.521  -3.218
  940   3HD1  LEU 148          3HD1      LEU 148   5.139  -0.219  -2.423
  941   1HD2  LEU 148          1HD2      LEU 148   6.534   0.383  -5.779
  942   2HD2  LEU 148          2HD2      LEU 148   6.474   2.153  -5.709
  943   3HD2  LEU 148          3HD2      LEU 148   7.611   1.251  -4.684
  944    HA   PRO 149           HA       PRO 149  -0.457  -0.751  -5.181
  945   1HB   PRO 149          1HB       PRO 149  -0.673  -1.784  -2.585
  946   2HB   PRO 149          2HB       PRO 149  -0.246  -2.711  -4.036
  947   1HG   PRO 149          1HG       PRO 149   1.550  -1.704  -1.865
  948   2HG   PRO 149          2HG       PRO 149   1.679  -3.192  -2.870
  949   1HD   PRO 149          1HD       PRO 149   3.168  -0.888  -3.282
  950   2HD   PRO 149          2HD       PRO 149   2.831  -2.079  -4.502
  951    H    SER 150           H        SER 150   1.256   0.782  -2.423
  952    HA   SER 150           HA       SER 150  -0.966   2.156  -1.290
  953   1HB   SER 150          1HB       SER 150   1.937   3.077  -1.401
  954   2HB   SER 150          2HB       SER 150   0.701   3.597  -0.234
  955    HG   SER 150           HG       SER 150   2.069   1.942   0.597
  956    H    ARG 151           H        ARG 151   1.114   2.927  -4.073
  957    HA   ARG 151           HA       ARG 151   0.212   5.692  -4.335
  958   1HB   ARG 151          1HB       ARG 151   1.676   3.812  -6.247
  959   2HB   ARG 151          2HB       ARG 151   1.351   5.524  -6.591
  960   1HG   ARG 151          1HG       ARG 151   2.608   6.215  -4.606
  961   2HG   ARG 151          2HG       ARG 151   2.815   4.540  -4.108
  962   1HD   ARG 151          1HD       ARG 151   4.078   4.226  -6.363
  963   2HD   ARG 151          2HD       ARG 151   4.193   6.000  -6.355
  964    HE   ARG 151           HE       ARG 151   4.886   4.966  -3.760
  965   1HH1  ARG 151          1HH1      ARG 151   6.426   4.774  -6.923
  966   2HH1  ARG 151          2HH1      ARG 151   8.007   4.814  -6.197
  967   1HH2  ARG 151          1HH2      ARG 151   6.705   4.699  -2.998
  968   2HH2  ARG 151          2HH2      ARG 151   8.192   4.680  -3.959
  969    H    LEU 152           H        LEU 152  -0.741   2.534  -5.741
  970    HA   LEU 152           HA       LEU 152  -2.746   3.613  -7.554
  971   1HB   LEU 152          1HB       LEU 152  -1.835   1.391  -7.863
  972   2HB   LEU 152          2HB       LEU 152  -2.317   0.909  -6.234
  973    HG   LEU 152           HG       LEU 152  -4.668   0.935  -6.835
  974   1HD1  LEU 152          1HD1      LEU 152  -3.761   1.729  -9.637
  975   2HD1  LEU 152          2HD1      LEU 152  -5.410   1.286  -9.147
  976   3HD1  LEU 152          3HD1      LEU 152  -4.694   2.776  -8.546
  977   1HD2  LEU 152          1HD2      LEU 152  -3.086  -0.520  -8.984
  978   2HD2  LEU 152          2HD2      LEU 152  -3.151  -1.071  -7.303
  979   3HD2  LEU 152          3HD2      LEU 152  -4.641  -0.994  -8.281
  980    H    LYS 153           H        LYS 153  -2.821   2.225  -4.200
  981    HA   LYS 153           HA       LYS 153  -5.588   2.510  -3.682
  982   1HB   LYS 153          1HB       LYS 153  -3.149   2.677  -1.874
  983   2HB   LYS 153          2HB       LYS 153  -4.786   2.825  -1.235
  984   1HG   LYS 153          1HG       LYS 153  -5.405   0.625  -1.978
  985   2HG   LYS 153          2HG       LYS 153  -3.903   0.422  -2.884
  986   1HD   LYS 153          1HD       LYS 153  -2.606   0.551  -0.755
  987   2HD   LYS 153          2HD       LYS 153  -4.128   0.715   0.146
  988   1HE   LYS 153          1HE       LYS 153  -4.868  -1.497  -0.729
  989   2HE   LYS 153          2HE       LYS 153  -3.347  -1.652  -1.617
  990   1HZ   LYS 153          1HZ       LYS 153  -3.247  -2.834   0.507
  991   2HZ   LYS 153          2HZ       LYS 153  -2.173  -1.610   0.534
  992   3HZ   LYS 153          3HZ       LYS 153  -3.585  -1.479   1.344
  993    H    ARG 154           H        ARG 154  -2.965   4.945  -3.459
  994    HA   ARG 154           HA       ARG 154  -4.642   7.095  -2.470
  995   1HB   ARG 154          1HB       ARG 154  -1.888   6.770  -3.531
  996   2HB   ARG 154          2HB       ARG 154  -2.640   8.291  -3.980
  997   1HG   ARG 154          1HG       ARG 154  -3.037   8.892  -1.672
  998   2HG   ARG 154          2HG       ARG 154  -2.508   7.301  -1.104
  999   1HD   ARG 154          1HD       ARG 154  -0.796   9.179  -0.865
 1000   2HD   ARG 154          2HD       ARG 154  -0.248   7.712  -1.707
 1001    HE   ARG 154           HE       ARG 154  -1.276   9.967  -3.353
 1002   1HH1  ARG 154          1HH1      ARG 154   1.638   8.244  -2.420
 1003   2HH1  ARG 154          2HH1      ARG 154   2.529   8.957  -3.743
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.210  10.704  -4.890
 1005   2HH2  ARG 154          2HH2      ARG 154   1.530  10.463  -5.060
 1006    H    HIS 155           H        HIS 155  -3.645   6.040  -5.755
 1007    HA   HIS 155           HA       HIS 155  -4.869   8.133  -7.207
 1008   1HB   HIS 155          1HB       HIS 155  -3.334   6.578  -8.237
 1009   2HB   HIS 155          2HB       HIS 155  -4.433   5.215  -7.987
 1010    HD1  HIS 155           HD1      HIS 155  -4.326   8.491 -10.001
 1011    HD2  HIS 155           HD2      HIS 155  -6.407   4.853  -9.664
 1012    HE1  HIS 155           HE1      HIS 155  -6.104   8.554 -11.803
 1013    H    GLU 156           H        GLU 156  -6.285   5.088  -5.917
 1014    HA   GLU 156           HA       GLU 156  -8.763   5.182  -7.209
 1015   1HB   GLU 156          1HB       GLU 156  -8.010   4.217  -4.411
 1016   2HB   GLU 156          2HB       GLU 156  -9.634   4.072  -5.061
 1017   1HG   GLU 156          1HG       GLU 156  -8.745   2.821  -7.027
 1018   2HG   GLU 156          2HG       GLU 156  -7.145   2.838  -6.294
 1019    H    LYS 157           H        LYS 157  -7.590   7.203  -4.507
 1020    HA   LYS 157           HA       LYS 157 -10.122   8.205  -3.568
 1021   1HB   LYS 157          1HB       LYS 157  -7.438   9.615  -3.704
 1022   2HB   LYS 157          2HB       LYS 157  -8.811  10.114  -2.741
 1023   1HG   LYS 157          1HG       LYS 157  -8.552   8.379  -1.169
 1024   2HG   LYS 157          2HG       LYS 157  -7.524   7.418  -2.242
 1025   1HD   LYS 157          1HD       LYS 157  -6.181   8.505  -0.470
 1026   2HD   LYS 157          2HD       LYS 157  -5.719   9.013  -2.094
 1027   1HE   LYS 157          1HE       LYS 157  -7.260  11.059  -1.712
 1028   2HE   LYS 157          2HE       LYS 157  -7.197  10.620   0.003
 1029   1HZ   LYS 157          1HZ       LYS 157  -4.896  11.209  -1.788
 1030   2HZ   LYS 157          2HZ       LYS 157  -5.420  12.197  -0.588
 1031   3HZ   LYS 157          3HZ       LYS 157  -4.728  10.761  -0.216
 1032    H    VAL 158           H        VAL 158  -8.183   8.942  -6.444
 1033    HA   VAL 158           HA       VAL 158  -9.356  11.465  -7.135
 1034    HB   VAL 158           HB       VAL 158  -8.352   9.315  -9.081
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.492  11.317 -10.112
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.318  12.343  -9.227
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.762  11.240 -10.483
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.553   9.888  -7.398
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.199  10.612  -8.984
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.943  11.594  -7.675
 1041    H    HIS 159           H        HIS 159 -10.369   8.091  -7.803
 1042    HA   HIS 159           HA       HIS 159 -12.686   8.923  -9.389
 1043   1HB   HIS 159          1HB       HIS 159 -11.797   6.246  -8.221
 1044   2HB   HIS 159          2HB       HIS 159 -13.278   6.463  -9.181
 1045    HD1  HIS 159           HD1      HIS 159 -12.614   7.945 -11.659
 1046    HD2  HIS 159           HD2      HIS 159  -9.705   5.640  -9.681
 1047    HE1  HIS 159           HE1      HIS 159 -10.647   7.696 -13.274
 1048    H    ALA 160           H        ALA 160 -12.023   7.992  -6.000
 1049    HA   ALA 160           HA       ALA 160 -14.801   7.814  -5.198
 1050   1HB   ALA 160          1HB       ALA 160 -12.341   8.377  -3.482
 1051   2HB   ALA 160          2HB       ALA 160 -13.910   7.769  -2.925
 1052   3HB   ALA 160          3HB       ALA 160 -12.892   6.751  -3.964
 1053    H    GLY 161           H        GLY 161 -12.460  10.479  -5.472
 1054   1HA   GLY 161          1HA       GLY 161 -13.047  12.761  -5.675
 1055   2HA   GLY 161          2HA       GLY 161 -14.631  12.417  -5.017
 1056    H    TYR 162           H        TYR 162 -13.599  14.610  -4.075
 1057    HA   TYR 162           HA       TYR 162 -12.441  13.910  -1.398
 1058   1HB   TYR 162          1HB       TYR 162 -11.838  16.271  -3.208
 1059   2HB   TYR 162          2HB       TYR 162 -11.297  16.146  -1.518
 1060    HD1  TYR 162           HD1      TYR 162 -11.091  14.623  -4.919
 1061    HD2  TYR 162           HD2      TYR 162  -9.481  14.673  -0.911
 1062    HE1  TYR 162           HE1      TYR 162  -9.418  12.959  -5.584
 1063    HE2  TYR 162           HE2      TYR 162  -7.593  13.238  -1.665
 1064    HH   TYR 162           HH       TYR 162  -7.124  12.298  -5.021
 1065    HA   PRO 163           HA       PRO 163 -16.403  15.982  -0.749
 1066   1HB   PRO 163          1HB       PRO 163 -17.185  14.660   1.523
 1067   2HB   PRO 163          2HB       PRO 163 -17.227  13.894  -0.088
 1068   1HG   PRO 163          1HG       PRO 163 -15.076  13.627   2.028
 1069   2HG   PRO 163          2HG       PRO 163 -15.880  12.328   1.087
 1070   1HD   PRO 163          1HD       PRO 163 -13.455  13.392   0.391
 1071   2HD   PRO 163          2HD       PRO 163 -14.630  12.819  -0.836
 1072    H    CYS 164           H        CYS 164 -16.945  17.765   0.430
 1073    HA   CYS 164           HA       CYS 164 -14.920  18.982   2.102
 1074   1HB   CYS 164          1HB       CYS 164 -16.724  20.069   0.529
 1075   2HB   CYS 164          2HB       CYS 164 -17.788  19.942   1.947
 1076    H    LYS 165           H        LYS 165 -14.834  19.299   4.258
 1077    HA   LYS 165           HA       LYS 165 -17.076  18.385   5.971
 1078   1HB   LYS 165          1HB       LYS 165 -14.198  17.419   6.204
 1079   2HB   LYS 165          2HB       LYS 165 -15.328  17.286   7.532
 1080   1HG   LYS 165          1HG       LYS 165 -15.995  15.991   4.869
 1081   2HG   LYS 165          2HG       LYS 165 -14.864  15.261   5.983
 1082   1HD   LYS 165          1HD       LYS 165 -17.043  14.284   6.318
 1083   2HD   LYS 165          2HD       LYS 165 -16.506  15.138   7.750
 1084   1HE   LYS 165          1HE       LYS 165 -18.838  15.533   7.510
 1085   2HE   LYS 165          2HE       LYS 165 -18.014  17.051   7.168
 1086   1HZ   LYS 165          1HZ       LYS 165 -19.774  16.567   5.546
 1087   2HZ   LYS 165          2HZ       LYS 165 -18.333  16.611   4.784
 1088   3HZ   LYS 165          3HZ       LYS 165 -19.052  15.170   5.106
 1089    H    LYS 166           H        LYS 166 -15.352  20.883   4.999
 1090    HA   LYS 166           HA       LYS 166 -14.213  22.006   7.432
 1091   1HB   LYS 166          1HB       LYS 166 -14.953  23.013   4.698
 1092   2HB   LYS 166          2HB       LYS 166 -14.789  24.198   5.984
 1093   1HG   LYS 166          1HG       LYS 166 -12.733  23.987   4.719
 1094   2HG   LYS 166          2HG       LYS 166 -12.524  23.597   6.432
 1095   1HD   LYS 166          1HD       LYS 166 -12.540  21.142   5.831
 1096   2HD   LYS 166          2HD       LYS 166 -12.731  21.604   4.135
 1097   1HE   LYS 166          1HE       LYS 166 -10.418  21.175   4.417
 1098   2HE   LYS 166          2HE       LYS 166 -10.571  22.926   4.337
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.395  22.974   6.779
 1100   2HZ   LYS 166          2HZ       LYS 166 -10.294  21.344   6.843
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.099  22.208   6.146
 1102    H    ASP 167           H        ASP 167 -17.482  21.697   6.220
 1103    HA   ASP 167           HA       ASP 167 -18.496  22.942   8.698
 1104   1HB   ASP 167          1HB       ASP 167 -18.349  24.802   6.969
 1105   2HB   ASP 167          2HB       ASP 167 -19.496  23.902   5.980
 1106    H    ASP 168           H        ASP 168 -20.538  22.169   9.307
 1107    HA   ASP 168           HA       ASP 168 -21.179  19.551   8.409
 1108   1HB   ASP 168          1HB       ASP 168 -21.636  20.487  10.684
 1109   2HB   ASP 168          2HB       ASP 168 -22.908  21.498   9.998
 1110    H    SER 169           H        SER 169 -22.434  22.729   7.412
 1111    HA   SER 169           HA       SER 169 -24.671  21.477   5.900
 1112   1HB   SER 169          1HB       SER 169 -23.918  24.405   6.322
 1113   2HB   SER 169          2HB       SER 169 -25.377  23.822   5.505
 1114    HG   SER 169           HG       SER 169 -25.746  24.353   7.718
 1115    H    CYS 170           H        CYS 170 -21.652  21.333   5.184
 1116    HA   CYS 170           HA       CYS 170 -21.923  22.348   2.381
 1117   1HB   CYS 170          1HB       CYS 170 -20.066  23.299   3.888
 1118   2HB   CYS 170          2HB       CYS 170 -19.350  21.700   3.841
 1119    H    SER 171           H        SER 171 -21.937  20.822   0.799
 1120    HA   SER 171           HA       SER 171 -21.166  18.011   1.515
 1121   1HB   SER 171          1HB       SER 171 -23.203  17.256   0.302
 1122   2HB   SER 171          2HB       SER 171 -23.584  18.252   1.710
 1123    HG   SER 171           HG       SER 171 -24.804  18.867  -0.141
 1124    H    PHE 172           H        PHE 172 -20.064  20.379  -0.279
 1125    HA   PHE 172           HA       PHE 172 -20.078  19.502  -3.000
 1126   1HB   PHE 172          1HB       PHE 172 -19.266  21.687  -2.544
 1127   2HB   PHE 172          2HB       PHE 172 -18.189  21.125  -1.281
 1128    HD1  PHE 172           HD1      PHE 172 -16.067  19.970  -1.760
 1129    HD2  PHE 172           HD2      PHE 172 -18.517  21.541  -4.929
 1130    HE1  PHE 172           HE1      PHE 172 -14.190  19.684  -3.344
 1131    HE2  PHE 172           HE2      PHE 172 -16.560  21.455  -6.474
 1132    HZ   PHE 172           HZ       PHE 172 -14.379  20.574  -5.665
 1133    H    VAL 173           H        VAL 173 -18.796  18.068  -4.149
 1134    HA   VAL 173           HA       VAL 173 -16.605  16.676  -2.668
 1135    HB   VAL 173           HB       VAL 173 -18.518  15.369  -4.642
 1136   1HG1  VAL 173          1HG1      VAL 173 -16.172  14.392  -4.714
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.235  14.185  -2.955
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.325  13.265  -4.001
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.085  13.961  -2.550
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.302  15.262  -1.607
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.721  15.606  -2.600
 1142    H    GLY 174           H        GLY 174 -14.717  17.101  -3.567
 1143   1HA   GLY 174          1HA       GLY 174 -14.617  18.245  -6.276
 1144   2HA   GLY 174          2HA       GLY 174 -13.256  18.019  -5.163
 1145    H    LYS 175           H        LYS 175 -14.146  17.236  -8.147
 1146    HA   LYS 175           HA       LYS 175 -13.884  14.424  -8.331
 1147   1HB   LYS 175          1HB       LYS 175 -14.088  16.641 -10.132
 1148   2HB   LYS 175          2HB       LYS 175 -12.673  15.752 -10.642
 1149   1HG   LYS 175          1HG       LYS 175 -15.509  14.695 -10.290
 1150   2HG   LYS 175          2HG       LYS 175 -14.675  14.984 -11.814
 1151   1HD   LYS 175          1HD       LYS 175 -13.987  12.835  -9.763
 1152   2HD   LYS 175          2HD       LYS 175 -14.795  12.591 -11.308
 1153   1HE   LYS 175          1HE       LYS 175 -12.835  13.128 -12.561
 1154   2HE   LYS 175          2HE       LYS 175 -12.022  13.826 -11.153
 1155   1HZ   LYS 175          1HZ       LYS 175 -12.710  10.962 -11.409
 1156   2HZ   LYS 175          2HZ       LYS 175 -11.215  11.594 -11.626
 1157   3HZ   LYS 175          3HZ       LYS 175 -11.922  11.660 -10.140
 1158    H    THR 176           H        THR 176 -11.484  16.755  -7.485
 1159    HA   THR 176           HA       THR 176  -9.451  14.636  -7.322
 1160    HB   THR 176           HB       THR 176  -7.864  16.678  -8.324
 1161    HG1  THR 176           HG1      THR 176  -9.080  17.869  -9.479
 1162   1HG2  THR 176          1HG2      THR 176  -7.580  14.308  -8.799
 1163   2HG2  THR 176          2HG2      THR 176  -9.029  14.340  -9.853
 1164   3HG2  THR 176          3HG2      THR 176  -7.597  15.252 -10.307
 1165    H    TRP 177           H        TRP 177  -7.535  15.356  -6.083
 1166    HA   TRP 177           HA       TRP 177  -8.289  16.599  -3.685
 1167   1HB   TRP 177          1HB       TRP 177  -6.393  15.130  -3.797
 1168   2HB   TRP 177          2HB       TRP 177  -5.581  16.139  -4.970
 1169    HD1  TRP 177           HD1      TRP 177  -3.573  17.080  -3.987
 1170    HE1  TRP 177           HE1      TRP 177  -2.842  18.237  -1.805
 1171    HE3  TRP 177           HE3      TRP 177  -7.791  16.290  -1.269
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.668  17.984   0.939
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.708  16.537   1.197
 1174    HH2  TRP 177           HH2      TRP 177  -5.640  17.325   2.311
 1175    H    THR 178           H        THR 178  -6.621  18.036  -6.541
 1176    HA   THR 178           HA       THR 178  -6.116  20.610  -5.468
 1177    HB   THR 178           HB       THR 178  -6.454  21.377  -7.900
 1178    HG1  THR 178           HG1      THR 178  -6.249  18.797  -8.785
 1179   1HG2  THR 178          1HG2      THR 178  -4.229  20.868  -7.040
 1180   2HG2  THR 178          2HG2      THR 178  -4.439  19.162  -7.470
 1181   3HG2  THR 178          3HG2      THR 178  -4.413  20.397  -8.740
 1182    H    LEU 179           H        LEU 179  -9.032  19.431  -7.240
 1183    HA   LEU 179           HA       LEU 179 -10.398  21.900  -7.254
 1184   1HB   LEU 179          1HB       LEU 179 -11.563  19.081  -7.174
 1185   2HB   LEU 179          2HB       LEU 179 -12.454  20.539  -7.598
 1186    HG   LEU 179           HG       LEU 179 -10.127  19.353  -9.133
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.203  18.107  -9.383
 1188   2HD1  LEU 179          2HD1      LEU 179 -13.086  19.598  -9.803
 1189   3HD1  LEU 179          3HD1      LEU 179 -11.826  18.957 -10.880
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.035  21.777  -9.432
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.693  21.048 -10.893
 1192   3HD2  LEU 179          3HD2      LEU 179 -11.788  21.841  -9.739
 1193    H    TYR 180           H        TYR 180 -10.214  19.417  -4.708
 1194    HA   TYR 180           HA       TYR 180 -12.322  20.582  -3.063
 1195   1HB   TYR 180          1HB       TYR 180 -11.873  18.347  -2.659
 1196   2HB   TYR 180          2HB       TYR 180 -10.125  18.550  -2.634
 1197    HD1  TYR 180           HD1      TYR 180  -9.166  18.195  -0.554
 1198    HD2  TYR 180           HD2      TYR 180 -13.064  20.033  -0.744
 1199    HE1  TYR 180           HE1      TYR 180  -9.247  18.272   1.928
 1200    HE2  TYR 180           HE2      TYR 180 -13.088  20.211   1.734
 1201    HH   TYR 180           HH       TYR 180 -10.497  18.779   3.766
 1202    H    LEU 181           H        LEU 181  -8.715  20.631  -2.970
 1203    HA   LEU 181           HA       LEU 181  -8.450  22.436  -0.815
 1204   1HB   LEU 181          1HB       LEU 181  -6.737  21.949  -3.287
 1205   2HB   LEU 181          2HB       LEU 181  -6.272  23.053  -2.027
 1206    HG   LEU 181           HG       LEU 181  -6.754  20.030  -1.737
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.262  20.170  -1.101
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.684  20.286  -2.812
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.271  21.755  -1.875
 1210   1HD2  LEU 181          1HD2      LEU 181  -7.426  20.871   0.353
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.773  20.327   0.587
 1212   3HD2  LEU 181          3HD2      LEU 181  -6.120  22.072   0.387
 1213    H    LYS 182           H        LYS 182  -8.841  23.133  -4.317
 1214    HA   LYS 182           HA       LYS 182  -8.633  26.003  -4.141
 1215   1HB   LYS 182          1HB       LYS 182  -9.970  24.126  -6.136
 1216   2HB   LYS 182          2HB       LYS 182 -10.014  25.884  -6.323
 1217   1HG   LYS 182          1HG       LYS 182  -7.591  26.033  -6.375
 1218   2HG   LYS 182          2HG       LYS 182  -7.424  24.302  -6.059
 1219   1HD   LYS 182          1HD       LYS 182  -8.682  23.846  -8.197
 1220   2HD   LYS 182          2HD       LYS 182  -8.651  25.578  -8.551
 1221   1HE   LYS 182          1HE       LYS 182  -6.202  23.796  -8.133
 1222   2HE   LYS 182          2HE       LYS 182  -6.863  24.245  -9.708
 1223   1HZ   LYS 182          1HZ       LYS 182  -5.793  26.196  -7.739
 1224   2HZ   LYS 182          2HZ       LYS 182  -5.010  25.676  -9.073
 1225   3HZ   LYS 182          3HZ       LYS 182  -6.362  26.566  -9.232
 1226    H    HIS 183           H        HIS 183 -11.459  23.769  -3.961
 1227    HA   HIS 183           HA       HIS 183 -13.476  25.777  -3.663
 1228   1HB   HIS 183          1HB       HIS 183 -14.169  23.547  -4.153
 1229   2HB   HIS 183          2HB       HIS 183 -13.262  22.862  -2.821
 1230    HD1  HIS 183           HD1      HIS 183 -16.596  24.682  -3.410
 1231    HD2  HIS 183           HD2      HIS 183 -14.306  22.901  -0.358
 1232    HE1  HIS 183           HE1      HIS 183 -18.106  24.543  -1.354
 1233    H    VAL 184           H        VAL 184 -11.404  24.076  -1.274
 1234    HA   VAL 184           HA       VAL 184 -12.633  25.147   1.079
 1235    HB   VAL 184           HB       VAL 184  -9.943  23.934   0.435
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.347  25.595   2.132
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.683  25.024   3.171
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.303  23.956   2.781
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.298  23.194   2.222
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.909  22.507   0.637
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.802  22.209   1.965
 1242    H    ALA 185           H        ALA 185  -9.845  26.259  -0.874
 1243    HA   ALA 185           HA       ALA 185  -9.143  28.405   0.826
 1244   1HB   ALA 185          1HB       ALA 185  -7.669  27.506  -0.944
 1245   2HB   ALA 185          2HB       ALA 185  -8.773  28.132  -2.194
 1246   3HB   ALA 185          3HB       ALA 185  -7.897  29.257  -1.132
 1247    H    GLU 186           H        GLU 186 -11.588  28.140  -1.729
 1248    HA   GLU 186           HA       GLU 186 -12.034  31.058  -1.836
 1249   1HB   GLU 186          1HB       GLU 186 -12.043  29.564  -3.857
 1250   2HB   GLU 186          2HB       GLU 186 -13.511  28.793  -3.250
 1251   1HG   GLU 186          1HG       GLU 186 -14.737  30.916  -3.453
 1252   2HG   GLU 186          2HG       GLU 186 -13.246  31.772  -3.867
 1253    H    CYS 187           H        CYS 187 -13.512  28.205  -0.327
 1254    HA   CYS 187           HA       CYS 187 -15.999  29.769   0.252
 1255   1HB   CYS 187          1HB       CYS 187 -15.934  27.509  -1.061
 1256   2HB   CYS 187          2HB       CYS 187 -15.717  26.758   0.523
 1257    HG   CYS 187           HG       CYS 187 -18.105  28.846  -0.515
 1258    H    HIS 188           H        HIS 188 -13.249  28.266   1.879
 1259    HA   HIS 188           HA       HIS 188 -14.607  28.737   4.519
 1260   1HB   HIS 188          1HB       HIS 188 -12.817  26.381   3.798
 1261   2HB   HIS 188          2HB       HIS 188 -13.517  26.703   5.394
 1262    HD1  HIS 188           HD1      HIS 188 -16.413  26.702   5.328
 1263    HD2  HIS 188           HD2      HIS 188 -14.175  24.927   2.256
 1264    HE1  HIS 188           HE1      HIS 188 -17.999  25.078   4.138
 1265    H    GLN 189           H        GLN 189 -12.174  29.812   2.571
 1266    HA   GLN 189           HA       GLN 189 -10.597  30.735   4.936
 1267   1HB   GLN 189          1HB       GLN 189  -9.325  29.758   2.352
 1268   2HB   GLN 189          2HB       GLN 189  -8.480  30.405   3.749
 1269   1HG   GLN 189          1HG       GLN 189  -9.296  28.500   5.132
 1270   2HG   GLN 189          2HG       GLN 189  -9.997  27.763   3.689
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.825  26.736   5.483
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.454  26.449   4.419
 1273    H    ASP 190           H        ASP 190 -12.658  31.778   2.805
 1274    HA   ASP 190           HA       ASP 190 -11.391  34.415   2.527
 1275   1HB   ASP 190          1HB       ASP 190 -10.653  33.217   0.460
 1276   2HB   ASP 190          2HB       ASP 190 -12.339  32.899   0.050
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  -6.581  31.567 -14.620
    2   2H5*    G   1          2H5*        G   1  -7.567  30.124 -14.329
    3    H4*    G   1           H4*        G   1  -6.729  30.124 -16.600
    4    H3*    G   1           H3*        G   1  -5.394  28.043 -14.849
    5    H2*    G   1           H2*        G   1  -4.458  27.175 -16.919
    6   2HO*    G   1          2HO*        G   1  -6.456  27.846 -18.205
    7    H1*    G   1           H1*        G   1  -3.593  29.604 -17.728
    8    H8     G   1           H8         G   1  -3.325  30.011 -14.006
    9    H1     G   1           H1         G   1   1.431  26.561 -16.600
   10   1H2     G   1          1H2         G   1   0.819  25.752 -18.524
   11   2H2     G   1          2H2         G   1  -0.655  26.289 -19.305
   12   1H5*    G   2          1H5*        G   2  -6.752  25.833 -18.095
   13   2H5*    G   2          2H5*        G   2  -7.557  24.351 -17.572
   14    H4*    G   2           H4*        G   2  -5.797  23.867 -19.185
   15    H3*    G   2           H3*        G   2  -5.145  22.929 -16.377
   16    H2*    G   2           H2*        G   2  -3.316  21.718 -17.427
   17   2HO*    G   2          2HO*        G   2  -4.663  21.375 -19.490
   18    H1*    G   2           H1*        G   2  -2.505  23.888 -18.849
   19    H8     G   2           H8         G   2  -3.841  25.417 -15.662
   20    H1     G   2           H1         G   2   1.908  22.618 -14.951
   21   1H2     G   2          1H2         G   2   2.267  21.239 -16.573
   22   2H2     G   2          2H2         G   2   1.199  21.141 -17.959
   23   1H5*    G   3          1H5*        G   3  -4.682  19.525 -18.683
   24   2H5*    G   3          2H5*        G   3  -5.496  18.129 -17.965
   25    H4*    G   3           H4*        G   3  -3.158  17.617 -18.455
   26    H3*    G   3           H3*        G   3  -3.787  17.827 -15.493
   27    H2*    G   3           H2*        G   3  -1.601  16.861 -15.155
   28   2HO*    G   3          2HO*        G   3  -1.836  15.461 -17.172
   29    H1*    G   3           H1*        G   3  -0.399  18.491 -17.002
   30    H8     G   3           H8         G   3  -3.034  20.641 -15.303
   31    H1     G   3           H1         G   3   2.396  19.925 -11.921
   32   1H2     G   3          1H2         G   3   3.497  18.219 -12.643
   33   2H2     G   3          2H2         G   3   3.024  17.355 -14.092
   34   1H5*    C   4          1H5*        C   4  -2.246  13.967 -15.736
   35   2H5*    C   4          2H5*        C   4  -3.208  12.837 -14.781
   36    H4*    C   4           H4*        C   4  -0.847  12.817 -14.092
   37    H3*    C   4           H3*        C   4  -2.759  13.927 -12.019
   38    H2*    C   4           H2*        C   4  -0.886  14.189 -10.562
   39   2HO*    C   4          2HO*        C   4  -0.014  12.004 -11.387
   40    H1*    C   4           H1*        C   4   0.949  14.949 -12.515
   41   1H4     C   4          1H4         C   4  -1.143  20.016  -9.248
   42   2H4     C   4          2H4         C   4  -2.626  20.048 -10.171
   43    H5     C   4           H5         C   4  -3.158  18.431 -11.865
   44    H6     C   4           H6         C   4  -2.362  16.425 -13.009
   45   1H5*    C   5          1H5*        C   5  -1.453  12.541  -9.043
   46   2H5*    C   5          2H5*        C   5  -2.503  11.374  -8.243
   47    H4*    C   5           H4*        C   5  -1.991  13.365  -6.898
   48    H3*    C   5           H3*        C   5  -4.440  12.111  -6.868
   49    H2*    C   5           H2*        C   5  -5.334  13.586  -8.572
   50   2HO*    C   5          2HO*        C   5  -6.611  13.773  -6.458
   51    H1*    C   5           H1*        C   5  -4.220  15.896  -7.040
   52   1H4     C   5          1H4         C   5  -6.178  19.042 -12.168
   53   2H4     C   5          2H4         C   5  -5.841  17.681 -13.220
   54    H5     C   5           H5         C   5  -5.006  15.606 -12.405
   55    H6     C   5           H6         C   5  -4.428  14.330 -10.406
   56   1H5*    A   6          1H5*        A   6  -2.327  15.332  -4.732
   57   2H5*    A   6          2H5*        A   6  -1.096  14.070  -4.601
   58    H4*    A   6           H4*        A   6  -0.376  16.046  -3.677
   59    H3*    A   6           H3*        A   6  -0.664  13.845  -1.718
   60    H2*    A   6           H2*        A   6  -0.145  15.297   0.109
   61   2HO*    A   6          2HO*        A   6   1.448  16.394  -1.546
   62    H1*    A   6           H1*        A   6  -1.561  17.512  -0.654
   63    H8     A   6           H8         A   6  -4.065  15.340  -2.032
   64   1H6     A   6          1H6         A   6  -5.975  14.033   3.716
   65   2H6     A   6          2H6         A   6  -6.291  13.789   2.017
   66    H2     A   6           H2         A   6  -2.175  16.288   4.032
   67   1H5*    U   7          1H5*        U   7   3.120  13.236   0.530
   68   2H5*    U   7          2H5*        U   7   2.086  14.553   0.004
   69    H4*    U   7           H4*        U   7   3.848  15.382   1.390
   70    H3*    U   7           H3*        U   7   3.194  16.642  -0.972
   71    H2*    U   7           H2*        U   7   4.926  15.518  -2.189
   72   2HO*    U   7          2HO*        U   7   5.719  18.073  -1.276
   73    H1*    U   7           H1*        U   7   6.779  16.116   0.151
   74    H3     U   7           H3         U   7  10.368  14.419  -1.928
   75    H5     U   7           H5         U   7   7.568  11.320  -2.080
   76    H6     U   7           H6         U   7   5.843  12.901  -1.358
   77   1H5*    A   8          1H5*        A   8   4.021  20.327  -0.977
   78   2H5*    A   8          2H5*        A   8   3.309  21.150   0.412
   79    H4*    A   8           H4*        A   8   2.531  22.268  -1.483
   80    H3*    A   8           H3*        A   8   0.725  21.273   0.305
   81    H2*    A   8           H2*        A   8   0.327  19.307  -1.058
   82   2HO*    A   8          2HO*        A   8  -1.752  20.242  -0.511
   83    H1*    A   8           H1*        A   8   0.064  21.282  -3.327
   84    H8     A   8           H8         A   8   2.208  18.089  -3.239
   85   1H6     A   8          1H6         A   8  -1.495  16.153  -7.815
   86   2H6     A   8          2H6         A   8   0.062  15.937  -7.051
   87    H2     A   8           H2         A   8  -3.329  19.773  -6.009
   88   1H5*    C   9          1H5*        C   9  -2.516  22.592  -0.535
   89   2H5*    C   9          2H5*        C   9  -2.868  24.081   0.352
   90    H4*    C   9           H4*        C   9  -4.389  22.402   1.047
   91    H3*    C   9           H3*        C   9  -2.381  23.046   3.179
   92    H2*    C   9           H2*        C   9  -3.586  21.491   4.595
   93   2HO*    C   9          2HO*        C   9  -5.702  22.189   3.368
   94    H1*    C   9           H1*        C   9  -3.847  19.527   2.746
   95   1H4     C   9          1H4         C   9   1.778  18.457   5.627
   96   2H4     C   9          2H4         C   9   2.569  19.027   4.173
   97    H5     C   9           H5         C   9   1.403  20.156   2.417
   98    H6     C   9           H6         C   9  -0.785  20.902   1.647
   99   1H5*    C  10          1H5*        C  10  -5.905  23.051   5.136
  100   2H5*    C  10          2H5*        C  10  -6.162  24.421   6.214
  101    H4*    C  10           H4*        C  10  -6.278  22.286   7.431
  102    H3*    C  10           H3*        C  10  -3.867  23.997   8.118
  103    H2*    C  10           H2*        C  10  -3.483  22.443   9.908
  104   2HO*    C  10          2HO*        C  10  -5.847  22.133  10.347
  105    H1*    C  10           H1*        C  10  -3.906  20.214   8.328
  106   1H4     C  10          1H4         C  10   2.340  21.058   7.891
  107   2H4     C  10          2H4         C  10   2.113  21.947   6.402
  108    H5     C  10           H5         C  10  -0.040  22.648   5.603
  109    H6     C  10           H6         C  10  -2.446  22.586   6.064
  110   1H5*    U  11          1H5*        U  11  -5.370  24.074  12.018
  111   2H5*    U  11          2H5*        U  11  -5.015  25.664  12.708
  112    H4*    U  11           H4*        U  11  -3.777  23.699  13.710
  113    H3*    U  11           H3*        U  11  -2.183  25.949  12.492
  114    H2*    U  11           H2*        U  11  -0.279  24.968  13.575
  115   2HO*    U  11          2HO*        U  11  -1.622  24.366  15.542
  116    H1*    U  11           H1*        U  11  -0.985  22.398  12.896
  117    H3     U  11           H3         U  11   2.690  23.452  10.366
  118    H5     U  11           H5         U  11  -0.471  25.349   8.380
  119    H6     U  11           H6         U  11  -1.943  24.734  10.246
  120   1H5*    C  12          1H5*        C  12  -0.584  26.742  16.784
  121   2H5*    C  12          2H5*        C  12   0.364  28.142  16.274
  122    H4*    C  12           H4*        C  12   0.989  25.195  16.163
  123    H3*    C  12           H3*        C  12   1.985  27.262  17.648
  124    H2*    C  12           H2*        C  12   2.619  28.565  15.739
  125   2HO*    C  12          2HO*        C  12   4.592  27.632  17.230
  126    H1*    C  12           H1*        C  12   3.909  26.062  14.597
  127   1H4     C  12          1H4         C  12   4.827  30.259   9.894
  128   2H4     C  12          2H4         C  12   3.135  30.695   9.875
  129    H5     C  12           H5         C  12   1.528  29.777  11.405
  130    H6     C  12           H6         C  12   1.218  28.235  13.286
  131   1H5*    U  13          1H5*        U  13   3.246  22.767  18.432
  132   2H5*    U  13          2H5*        U  13   4.005  22.742  20.028
  133    H4*    U  13           H4*        U  13   5.174  21.019  19.085
  134    H3*    U  13           H3*        U  13   6.832  23.269  19.126
  135    H2*    U  13           H2*        U  13   6.245  23.866  16.866
  136   2HO*    U  13          2HO*        U  13   8.637  22.322  16.898
  137    H1*    U  13           H1*        U  13   6.626  20.911  16.209
  138    H3     U  13           H3         U  13   6.378  21.929  11.794
  139    H5     U  13           H5         U  13   3.231  24.146  13.422
  140    H6     U  13           H6         U  13   3.902  23.369  15.652
  141   1H5*    U  14          1H5*        U  14   9.788  18.582  19.572
  142   2H5*    U  14          2H5*        U  14  11.218  19.478  19.061
  143    H4*    U  14           H4*        U  14   8.592  19.190  17.568
  144    H3*    U  14           H3*        U  14  11.073  17.720  17.483
  145    H2*    U  14           H2*        U  14  12.161  19.423  16.316
  146   2HO*    U  14          2HO*        U  14  10.824  17.760  14.444
  147    H1*    U  14           H1*        U  14   9.505  20.024  14.934
  148    H3     U  14           H3         U  14  11.782  22.795  12.107
  149    H5     U  14           H5         U  14  13.125  23.985  15.886
  150    H6     U  14           H6         U  14  11.828  22.144  16.871
  151   1H5*    G  15          1H5*        G  15   6.500  14.997  15.580
  152   2H5*    G  15          2H5*        G  15   6.961  16.560  14.887
  153    H4*    G  15           H4*        G  15   4.826  16.406  17.028
  154    H3*    G  15           H3*        G  15   4.516  15.859  14.069
  155    H2*    G  15           H2*        G  15   2.247  16.691  14.339
  156   2HO*    G  15          2HO*        G  15   2.057  15.834  16.622
  157    H1*    G  15           H1*        G  15   3.096  18.918  15.613
  158    H8     G  15           H8         G  15   6.039  18.398  13.381
  159    H1     G  15           H1         G  15   0.822  20.339  10.165
  160   1H2     G  15          1H2         G  15  -0.953  19.979  11.344
  161   2H2     G  15          2H2         G  15  -0.867  19.482  13.023
  162   1H5*    G  16          1H5*        G  16   0.928  14.350  15.536
  163   2H5*    G  16          2H5*        G  16   0.610  12.739  14.880
  164    H4*    G  16           H4*        G  16  -1.282  14.213  14.505
  165    H3*    G  16           H3*        G  16   0.193  13.510  11.954
  166    H2*    G  16           H2*        G  16  -1.699  14.543  10.829
  167   2HO*    G  16          2HO*        G  16  -3.280  13.760  12.522
  168    H1*    G  16           H1*        G  16  -1.666  16.750  12.399
  169    H8     G  16           H8         G  16   1.995  15.945  12.267
  170    H1     G  16           H1         G  16  -0.235  17.800   6.556
  171   1H2     G  16          1H2         G  16  -2.394  18.081   6.625
  172   2H2     G  16          2H2         G  16  -3.328  17.589   8.026
  173   1H5*    G  17          1H5*        G  17  -3.574  12.403  10.759
  174   2H5*    G  17          2H5*        G  17  -3.541  10.879   9.864
  175    H4*    G  17           H4*        G  17  -4.422  12.750   8.536
  176    H3*    G  17           H3*        G  17  -1.813  11.604   7.509
  177    H2*    G  17           H2*        G  17  -2.189  13.078   5.571
  178   2HO*    G  17          2HO*        G  17  -4.596  12.801   5.775
  179    H1*    G  17           H1*        G  17  -2.546  15.259   7.043
  180    H8     G  17           H8         G  17  -0.357  13.488   9.461
  181    H1     G  17           H1         G  17   2.814  15.880   4.412
  182   1H2     G  17          1H2         G  17   1.417  16.440   2.846
  183   2H2     G  17          2H2         G  17  -0.296  16.058   2.958
  184   1H5*    C  18          1H5*        C  18  -3.636  11.405   4.003
  185   2H5*    C  18          2H5*        C  18  -3.451   9.843   3.185
  186    H4*    C  18           H4*        C  18  -2.455  11.580   1.832
  187    H3*    C  18           H3*        C  18  -0.287   9.951   3.181
  188    H2*    C  18           H2*        C  18   1.271  11.211   1.685
  189   2HO*    C  18          2HO*        C  18   0.158  11.779  -0.187
  190    H1*    C  18           H1*        C  18   0.307  13.494   2.479
  191   1H4     C  18          1H4         C  18   4.374  11.913   7.107
  192   2H4     C  18          2H4         C  18   3.032  11.386   8.090
  193    H5     C  18           H5         C  18   0.768  11.324   7.303
  194    H6     C  18           H6         C  18  -0.655  11.661   5.356
  195   1H5*    C  19          1H5*        C  19   1.106   9.940  -0.519
  196   2H5*    C  19          2H5*        C  19   1.564   8.324  -1.086
  197    H4*    C  19           H4*        C  19   3.380   9.910  -1.438
  198    H3*    C  19           H3*        C  19   3.902   7.780   0.679
  199    H2*    C  19           H2*        C  19   6.181   8.573   0.630
  200   2HO*    C  19          2HO*        C  19   5.886   8.996  -1.814
  201    H1*    C  19           H1*        C  19   5.540  11.233   0.651
  202   1H4     C  19          1H4         C  19   6.256   9.329   6.714
  203   2H4     C  19          2H4         C  19   4.572   8.860   6.790
  204    H5     C  19           H5         C  19   3.100   8.923   4.902
  205    H6     C  19           H6         C  19   2.927   9.533   2.537
  206   1H5*    U  20          1H5*        U  20   7.141   7.336  -1.800
  207   2H5*    U  20          2H5*        U  20   7.455   5.627  -2.142
  208    H4*    U  20           H4*        U  20   9.397   6.681  -1.180
  209    H3*    U  20           H3*        U  20   8.113   4.751   0.783
  210    H2*    U  20           H2*        U  20  10.256   4.905   1.897
  211   2HO*    U  20          2HO*        U  20  11.518   5.132  -0.167
  212    H1*    U  20           H1*        U  20  10.256   7.632   1.705
  213    H3     U  20           H3         U  20   9.273   6.439   6.044
  214    H5     U  20           H5         U  20   5.580   6.359   4.082
  215    H6     U  20           H6         U  20   6.764   6.656   1.947
  216   1H5*    G  21          1H5*        G  21  11.902   3.212  -0.064
  217   2H5*    G  21          2H5*        G  21  11.879   1.448  -0.107
  218    H4*    G  21           H4*        G  21  13.559   2.264   1.431
  219    H3*    G  21           H3*        G  21  11.237   0.985   2.933
  220    H2*    G  21           H2*        G  21  12.797   0.989   4.782
  221   2HO*    G  21          2HO*        G  21  14.759   0.682   3.326
  222    H1*    G  21           H1*        G  21  13.396   3.608   4.381
  223    H8     G  21           H8         G  21   9.767   3.251   3.270
  224    H1     G  21           H1         G  21  10.545   3.181   9.660
  225   1H2     G  21          1H2         G  21  12.630   2.875  10.145
  226   2H2     G  21          2H2         G  21  13.879   2.881   8.917
  227   1H5*    G  22          1H5*        G  22  14.544  -1.182   3.938
  228   2H5*    G  22          2H5*        G  22  14.222  -2.916   3.924
  229    H4*    G  22           H4*        G  22  15.214  -2.250   6.017
  230    H3*    G  22           H3*        G  22  12.289  -2.968   6.350
  231    H2*    G  22           H2*        G  22  12.813  -3.106   8.683
  232   2HO*    G  22          2HO*        G  22  14.997  -3.979   8.479
  233    H1*    G  22           H1*        G  22  14.078  -0.691   8.625
  234    H8     G  22           H8         G  22  11.332  -0.297   6.045
  235    H1     G  22           H1         G  22   9.161  -0.275  12.112
  236   1H2     G  22          1H2         G  22  10.715  -0.916  13.461
  237   2H2     G  22          2H2         G  22  12.340  -1.278  12.909
  238   1H5*    U  23          1H5*        U  23  11.847  -7.647   8.410
  239   2H5*    U  23          2H5*        U  23  10.885  -6.157   8.335
  240    H4*    U  23           H4*        U  23  13.014  -6.747  10.428
  241    H3*    U  23           H3*        U  23   9.995  -6.927  10.385
  242    H2*    U  23           H2*        U  23   9.920  -6.249  12.657
  243   2HO*    U  23          2HO*        U  23  12.043  -7.392  13.160
  244    H1*    U  23           H1*        U  23  11.548  -4.126  12.307
  245    H3     U  23           H3         U  23   6.983  -3.033  12.170
  246    H5     U  23           H5         U  23   8.371  -2.977   8.226
  247    H6     U  23           H6         U  23  10.485  -3.965   9.007
  248   1H5*    U  24          1H5*        U  24  10.220  -8.787  13.454
  249   2H5*    U  24          2H5*        U  24   9.635 -10.448  13.579
  250    H4*    U  24           H4*        U  24   8.404  -9.105  15.133
  251    H3*    U  24           H3*        U  24   6.748  -9.695  12.677
  252    H2*    U  24           H2*        U  24   4.882  -8.795  13.817
  253   2HO*    U  24          2HO*        U  24   5.437  -9.678  15.968
  254    H1*    U  24           H1*        U  24   6.299  -6.629  14.773
  255    H3     U  24           H3         U  24   3.458  -5.218  11.405
  256    H5     U  24           H5         U  24   6.887  -6.572   9.411
  257    H6     U  24           H6         U  24   7.746  -7.411  11.551
  258   1H5*    A  25          1H5*        A  25   5.118 -13.740  11.727
  259   2H5*    A  25          2H5*        A  25   6.788 -14.168  11.376
  260    H4*    A  25           H4*        A  25   5.720 -13.765   9.293
  261    H3*    A  25           H3*        A  25   7.984 -12.195   9.948
  262    H2*    A  25           H2*        A  25   6.677 -10.251  10.423
  263   2HO*    A  25          2HO*        A  25   8.115  -9.575   8.787
  264    H1*    A  25           H1*        A  25   5.068 -11.095   7.993
  265    H8     A  25           H8         A  25   3.878  -9.961  11.545
  266   1H6     A  25          1H6         A  25   0.819  -5.538   8.381
  267   2H6     A  25          2H6         A  25   0.893  -6.406   9.902
  268    H2     A  25           H2         A  25   3.584  -7.609   5.582
  269   1H5*    G  26          1H5*        G  26   7.637 -15.602   5.091
  270   2H5*    G  26          2H5*        G  26   7.874 -13.906   4.756
  271    H4*    G  26           H4*        G  26   5.731 -14.155   6.718
  272    H3*    G  26           H3*        G  26   5.815 -16.457   5.039
  273    H2*    G  26           H2*        G  26   5.702 -14.952   3.208
  274   2HO*    G  26          2HO*        G  26   3.223 -16.276   3.677
  275    H1*    G  26           H1*        G  26   3.362 -13.785   4.756
  276    H8     G  26           H8         G  26   5.597 -13.387   1.639
  277    H1     G  26           H1         G  26   0.938  -9.039   2.150
  278   1H2     G  26          1H2         G  26   0.353  -8.903   4.228
  279   2H2     G  26          2H2         G  26   0.821 -10.104   5.418
  280   1H5*    U  27          1H5*        U  27   4.660 -16.770   8.310
  281   2H5*    U  27          2H5*        U  27   3.872 -18.320   8.658
  282    H4*    U  27           H4*        U  27   3.762 -17.285  10.724
  283    H3*    U  27           H3*        U  27   1.184 -16.472   9.323
  284    H2*    U  27           H2*        U  27   0.651 -15.081  11.185
  285   2HO*    U  27          2HO*        U  27   1.788 -16.770  12.682
  286    H1*    U  27           H1*        U  27   3.080 -13.932  11.463
  287    H3     U  27           H3         U  27   0.342 -10.949   9.242
  288    H5     U  27           H5         U  27   2.976 -12.571   6.452
  289    H6     U  27           H6         U  27   3.413 -14.417   8.010
  290   1H5*    A  28          1H5*        A  28  -0.367 -16.506  12.966
  291   2H5*    A  28          2H5*        A  28  -1.655 -17.706  13.048
  292    H4*    A  28           H4*        A  28  -2.533 -15.562  13.723
  293    H3*    A  28           H3*        A  28  -3.516 -16.374  10.959
  294    H2*    A  28           H2*        A  28  -4.947 -14.424  11.093
  295   2HO*    A  28          2HO*        A  28  -5.264 -14.737  13.514
  296    H1*    A  28           H1*        A  28  -2.976 -12.791  12.016
  297    H8     A  28           H8         A  28  -0.910 -14.752   9.664
  298   1H6     A  28          1H6         A  28  -3.300 -11.142   5.186
  299   2H6     A  28          2H6         A  28  -2.042 -12.310   5.558
  300    H2     A  28           H2         A  28  -6.126 -11.158   8.597
  301   1H5*    C  29          1H5*        C  29  -7.052 -15.578  12.245
  302   2H5*    C  29          2H5*        C  29  -8.267 -16.815  11.901
  303    H4*    C  29           H4*        C  29  -8.798 -14.777  10.704
  304    H3*    C  29           H3*        C  29  -7.811 -16.967   8.862
  305    H2*    C  29           H2*        C  29  -8.388 -15.452   7.036
  306   2HO*    C  29          2HO*        C  29 -10.334 -14.591   8.246
  307    H1*    C  29           H1*        C  29  -7.210 -13.312   8.109
  308   1H4     C  29          1H4         C  29  -2.545 -16.161   4.845
  309   2H4     C  29          2H4         C  29  -2.010 -16.949   6.310
  310    H5     C  29           H5         C  29  -3.248 -16.904   8.356
  311    H6     C  29           H6         C  29  -5.240 -16.005   9.446
  312   1H5*    C  30          1H5*        C  30 -11.475 -16.041   7.116
  313   2H5*    C  30          2H5*        C  30 -12.343 -17.491   6.589
  314    H4*    C  30           H4*        C  30 -11.868 -15.984   4.709
  315    H3*    C  30           H3*        C  30 -10.243 -18.539   4.595
  316    H2*    C  30           H2*        C  30  -9.647 -17.809   2.356
  317   2HO*    C  30          2HO*        C  30 -11.884 -16.738   2.087
  318    H1*    C  30           H1*        C  30  -9.107 -15.254   3.182
  319   1H4     C  30          1H4         C  30  -3.820 -18.845   3.416
  320   2H4     C  30          2H4         C  30  -4.183 -19.322   5.061
  321    H5     C  30           H5         C  30  -6.191 -18.670   6.208
  322    H6     C  30           H6         C  30  -8.306 -17.455   5.967
  323   1H5*    U  31          1H5*        U  31 -12.387 -18.176   0.875
  324   2H5*    U  31          2H5*        U  31 -13.325 -19.629   0.534
  325    H4*    U  31           H4*        U  31 -12.255 -18.834  -1.481
  326    H3*    U  31           H3*        U  31 -11.011 -21.399  -0.476
  327    H2*    U  31           H2*        U  31  -9.813 -21.457  -2.550
  328   2HO*    U  31          2HO*        U  31 -11.705 -20.543  -3.792
  329    H1*    U  31           H1*        U  31  -9.120 -18.809  -2.478
  330    H3     U  31           H3         U  31  -5.299 -21.183  -1.447
  331    H5     U  31           H5         U  31  -7.240 -20.555   2.215
  332    H6     U  31           H6         U  31  -9.221 -19.799   0.984
  333   1H5*    C  32          1H5*        C  32 -12.191 -22.731  -4.015
  334   2H5*    C  32          2H5*        C  32 -12.942 -24.331  -3.994
  335    H4*    C  32           H4*        C  32 -10.899 -24.386  -5.307
  336    H3*    C  32           H3*        C  32 -10.536 -25.803  -2.647
  337    H2*    C  32           H2*        C  32  -8.355 -26.430  -3.472
  338   2HO*    C  32          2HO*        C  32  -9.309 -26.633  -5.779
  339    H1*    C  32           H1*        C  32  -7.794 -23.952  -4.540
  340   1H4     C  32          1H4         C  32  -5.315 -24.377   1.327
  341   2H4     C  32          2H4         C  32  -6.855 -23.968   2.052
  342    H5     C  32           H5         C  32  -8.851 -23.595   0.775
  343    H6     C  32           H6         C  32  -9.793 -23.611  -1.488
  344   1H5*    U  33          1H5*        U  33  -8.712 -28.455  -4.715
  345   2H5*    U  33          2H5*        U  33  -9.432 -30.063  -4.622
  346    H4*    U  33           H4*        U  33  -7.106 -30.262  -3.995
  347    H3*    U  33           H3*        U  33  -8.935 -30.332  -1.576
  348    H2*    U  33           H2*        U  33  -7.130 -30.731  -0.251
  349   2HO*    U  33          2HO*        U  33  -5.188 -31.291  -2.292
  350    H1*    U  33           H1*        U  33  -5.311 -29.190  -1.777
  351    H3     U  33           H3         U  33  -5.230 -27.515   2.476
  352    H5     U  33           H5         U  33  -9.149 -26.748   1.231
  353    H6     U  33           H6         U  33  -8.637 -27.855  -0.901
  354   1H5*    U  34          1H5*        U  34  -9.147 -35.945  -0.858
  355   2H5*    U  34          2H5*        U  34  -8.392 -34.995   0.428
  356    H4*    U  34           H4*        U  34  -7.278 -37.146   0.129
  357    H3*    U  34           H3*        U  34  -5.848 -34.830   0.454
  358    H2*    U  34           H2*        U  34  -5.566 -34.453  -1.898
  359   2HO*    U  34          2HO*        U  34  -3.325 -35.930  -0.919
  360    H1*    U  34           H1*        U  34  -4.898 -37.412  -2.143
  361    H3     U  34           H3         U  34  -3.951 -36.941  -6.533
  362    H5     U  34           H5         U  34  -7.278 -34.446  -6.075
  363    H6     U  34           H6         U  34  -7.304 -35.008  -3.684
  364   1H5*    C  35          1H5*        C  35  -2.381 -35.081   1.143
  365   2H5*    C  35          2H5*        C  35  -2.026 -35.968   2.625
  366    H4*    C  35           H4*        C  35  -0.975 -33.778   2.608
  367    H3*    C  35           H3*        C  35  -2.173 -34.792   4.844
  368    H2*    C  35           H2*        C  35  -4.297 -33.782   4.382
  369   2HO*    C  35          2HO*        C  35  -2.788 -32.086   6.101
  370    H1*    C  35           H1*        C  35  -2.905 -31.162   3.733
  371   1H4     C  35          1H4         C  35  -9.089 -30.177   2.478
  372   2H4     C  35          2H4         C  35  -9.097 -31.485   1.307
  373    H5     C  35           H5         C  35  -7.232 -32.931   0.979
  374    H6     C  35           H6         C  35  -4.870 -33.277   1.487
  375   1H5*    G  36          1H5*        G  36   2.365 -31.604   4.771
  376   2H5*    G  36          2H5*        G  36   0.804 -31.636   3.932
  377    H4*    G  36           H4*        G  36   3.321 -33.072   3.003
  378    H3*    G  36           H3*        G  36   1.865 -30.598   1.997
  379    H2*    G  36           H2*        G  36   2.643 -31.168  -0.167
  380   2HO*    G  36          2HO*        G  36   4.871 -31.718   0.890
  381    H1*    G  36           H1*        G  36   2.631 -33.965   0.340
  382    H8     G  36           H8         G  36   1.296 -34.399  -1.884
  383    H1     G  36           H1         G  36  -3.244 -30.098  -0.340
  384   1H2     G  36          1H2         G  36  -2.772 -29.124   1.500
  385   2H2     G  36          2H2         G  36  -1.301 -29.453   2.388
  386   1H5*    G  37          1H5*        G  37   4.421 -29.628  -0.031
  387   2H5*    G  37          2H5*        G  37   4.910 -27.934  -0.088
  388    H4*    G  37           H4*        G  37   3.560 -28.854  -2.063
  389    H3*    G  37           H3*        G  37   2.509 -26.400  -0.608
  390    H2*    G  37           H2*        G  37   0.953 -26.305  -2.520
  391   2HO*    G  37          2HO*        G  37   2.682 -27.319  -4.025
  392    H1*    G  37           H1*        G  37   0.268 -28.895  -2.294
  393    H8     G  37           H8         G  37   1.088 -27.612   1.229
  394    H1     G  37           H1         G  37  -4.463 -25.391  -1.122
  395   1H2     G  37          1H2         G  37  -4.653 -25.941  -3.200
  396   2H2     G  37          2H2         G  37  -3.525 -27.029  -3.983
  397   1H5*    U  38          1H5*        U  38   1.970 -25.426  -4.448
  398   2H5*    U  38          2H5*        U  38   2.682 -23.909  -4.974
  399    H4*    U  38           H4*        U  38   0.351 -24.057  -5.622
  400    H3*    U  38           H3*        U  38   0.807 -21.994  -3.487
  401    H2*    U  38           H2*        U  38  -1.403 -21.191  -4.000
  402   2HO*    U  38          2HO*        U  38  -1.389 -21.584  -6.314
  403    H1*    U  38           H1*        U  38  -2.477 -23.688  -3.860
  404    H3     U  38           H3         U  38  -3.515 -21.840   0.212
  405    H5     U  38           H5         U  38   0.348 -23.358   0.708
  406    H6     U  38           H6         U  38   0.433 -23.790  -1.700
  407   1H5*    G  39          1H5*        G  39  -0.211 -19.705  -6.763
  408   2H5*    G  39          2H5*        G  39   0.673 -18.181  -6.780
  409    H4*    G  39           H4*        G  39  -1.689 -17.799  -6.848
  410    H3*    G  39           H3*        G  39  -0.634 -17.006  -4.128
  411    H2*    G  39           H2*        G  39  -2.873 -16.054  -3.832
  412   2HO*    G  39          2HO*        G  39  -3.082 -15.523  -6.234
  413    H1*    G  39           H1*        G  39  -4.070 -18.341  -4.606
  414    H8     G  39           H8         G  39  -0.724 -19.326  -3.016
  415    H1     G  39           H1         G  39  -5.271 -17.714   1.227
  416   1H2     G  39          1H2         G  39  -6.901 -16.725   0.211
  417   2H2     G  39          2H2         G  39  -6.997 -16.644  -1.534
  418   1H5*    G  40          1H5*        G  40  -2.657 -13.712  -5.586
  419   2H5*    G  40          2H5*        G  40  -1.866 -12.173  -5.207
  420    H4*    G  40           H4*        G  40  -4.213 -12.158  -4.553
  421    H3*    G  40           H3*        G  40  -2.183 -11.974  -2.301
  422    H2*    G  40           H2*        G  40  -4.114 -11.643  -0.841
  423   2HO*    G  40          2HO*        G  40  -5.274 -10.393  -2.669
  424    H1*    G  40           H1*        G  40  -5.591 -13.641  -1.888
  425    H8     G  40           H8         G  40  -2.095 -15.030  -2.111
  426    H1     G  40           H1         G  40  -4.315 -14.795   3.915
  427   1H2     G  40          1H2         G  40  -6.094 -13.580   4.012
  428   2H2     G  40          2H2         G  40  -6.775 -12.815   2.592
  429   1H5*    G  41          1H5*        G  41  -4.509  -9.416  -0.757
  430   2H5*    G  41          2H5*        G  41  -3.717  -7.892  -0.348
  431    H4*    G  41           H4*        G  41  -4.503  -8.878   1.699
  432    H3*    G  41           H3*        G  41  -1.510  -9.231   1.399
  433    H2*    G  41           H2*        G  41  -1.560 -10.031   3.709
  434   2HO*    G  41          2HO*        G  41  -3.324  -8.729   4.522
  435    H1*    G  41           H1*        G  41  -3.485 -11.814   3.172
  436    H8     G  41           H8         G  41  -1.774 -11.458  -0.186
  437    H1     G  41           H1         G  41   1.418 -15.223   3.914
  438   1H2     G  41          1H2         G  41   0.608 -15.061   5.893
  439   2H2     G  41          2H2         G  41  -0.689 -13.949   6.304
  440   1H5*    A  42          1H5*        A  42  -0.404  -5.391   5.055
  441   2H5*    A  42          2H5*        A  42  -0.218  -6.763   6.152
  442    H4*    A  42           H4*        A  42  -2.829  -5.773   4.936
  443    H3*    A  42           H3*        A  42  -1.717  -5.971   7.752
  444    H2*    A  42           H2*        A  42  -3.979  -6.303   8.546
  445   2HO*    A  42          2HO*        A  42  -4.907  -4.870   6.743
  446    H1*    A  42           H1*        A  42  -4.489  -8.283   6.822
  447    H8     A  42           H8         A  42  -0.964  -9.092   6.883
  448   1H6     A  42          1H6         A  42  -1.530 -10.967  12.790
  449   2H6     A  42          2H6         A  42  -0.551 -11.084  11.345
  450    H2     A  42           H2         A  42  -5.187  -8.703  11.728
  451   1H5*    A  43          1H5*        A  43  -4.433  -3.491   8.254
  452   2H5*    A  43          2H5*        A  43  -4.441  -1.914   9.003
  453    H4*    A  43           H4*        A  43  -5.767  -3.414  10.347
  454    H3*    A  43           H3*        A  43  -3.079  -2.886  11.676
  455    H2*    A  43           H2*        A  43  -3.788  -4.342  13.467
  456   2HO*    A  43          2HO*        A  43  -6.122  -3.490  13.196
  457    H1*    A  43           H1*        A  43  -4.855  -6.276  11.809
  458    H8     A  43           H8         A  43  -1.883  -5.390   9.834
  459   1H6     A  43          1H6         A  43   1.459  -8.925  13.676
  460   2H6     A  43          2H6         A  43   1.406  -8.196  12.083
  461    H2     A  43           H2         A  43  -2.396  -7.999  15.683
  462   1H5*    U  44          1H5*        U  44  -4.971  -2.456  14.915
  463   2H5*    U  44          2H5*        U  44  -4.592  -0.960  15.784
  464    H4*    U  44           H4*        U  44  -3.773  -2.832  17.074
  465    H3*    U  44           H3*        U  44  -1.534  -1.333  15.678
  466    H2*    U  44           H2*        U  44  -0.027  -2.684  16.972
  467   2HO*    U  44          2HO*        U  44  -1.585  -2.668  18.896
  468    H1*    U  44           H1*        U  44  -1.373  -5.015  16.506
  469    H3     U  44           H3         U  44   2.320  -5.329  13.798
  470    H5     U  44           H5         U  44  -0.323  -2.904  11.642
  471    H6     U  44           H6         U  44  -1.754  -2.790  13.627
  472   1H5*    A  45          1H5*        A  45  -0.315  -1.211  19.608
  473   2H5*    A  45          2H5*        A  45   0.421   0.340  20.026
  474    H4*    A  45           H4*        A  45   1.995  -1.491  20.340
  475    H3*    A  45           H3*        A  45   2.747   0.279  17.983
  476    H2*    A  45           H2*        A  45   4.845  -0.909  18.043
  477   2HO*    A  45          2HO*        A  45   4.724  -1.176  20.505
  478    H1*    A  45           H1*        A  45   3.638  -3.339  18.132
  479    H8     A  45           H8         A  45   1.298  -1.050  16.173
  480   1H6     A  45          1H6         A  45   4.849  -2.272  11.217
  481   2H6     A  45          2H6         A  45   3.312  -1.627  11.756
  482    H2     A  45           H2         A  45   6.907  -3.867  14.804
  483   1H5*    C  46          1H5*        C  46   5.959   0.326  20.457
  484   2H5*    C  46          2H5*        C  46   6.648   1.936  20.663
  485    H4*    C  46           H4*        C  46   8.333   0.357  19.925
  486    H3*    C  46           H3*        C  46   7.613   2.355  17.743
  487    H2*    C  46           H2*        C  46   9.626   1.551  16.694
  488   2HO*    C  46          2HO*        C  46  10.763   1.223  18.845
  489    H1*    C  46           H1*        C  46   8.985  -1.078  17.171
  490   1H4     C  46          1H4         C  46   6.683   0.525  11.429
  491   2H4     C  46          2H4         C  46   5.173   1.030  12.152
  492    H5     C  46           H5         C  46   4.802   1.090  14.525
  493    H6     C  46           H6         C  46   5.831   0.678  16.713
  494   1H5*    C  47          1H5*        C  47  11.604   2.963  18.581
  495   2H5*    C  47          2H5*        C  47  12.037   4.674  18.603
  496    H4*    C  47           H4*        C  47  13.436   3.433  17.044
  497    H3*    C  47           H3*        C  47  11.482   5.277  15.630
  498    H2*    C  47           H2*        C  47  12.872   4.855  13.689
  499   2HO*    C  47          2HO*        C  47  14.933   4.748  14.946
  500    H1*    C  47           H1*        C  47  12.948   2.152  14.182
  501   1H4     C  47          1H4         C  47   8.037   3.304  10.263
  502   2H4     C  47          2H4         C  47   6.990   3.628  11.624
  503    H5     C  47           H5         C  47   7.754   3.655  13.902
  504    H6     C  47           H6         C  47   9.719   3.391  15.346
  505   1H5*    A  48          1H5*        A  48  15.421   6.614  14.707
  506   2H5*    A  48          2H5*        A  48  15.520   8.375  14.665
  507    H4*    A  48           H4*        A  48  16.400   7.385  12.618
  508    H3*    A  48           H3*        A  48  13.786   8.855  12.169
  509    H2*    A  48           H2*        A  48  14.336   8.609   9.802
  510   2HO*    A  48          2HO*        A  48  16.757   8.748  10.229
  511    H1*    A  48           H1*        A  48  14.834   5.959  10.077
  512    H8     A  48           H8         A  48  12.178   6.649  12.689
  513   1H6     A  48          1H6         A  48   8.026   6.456   8.056
  514   2H6     A  48          2H6         A  48   8.237   6.509   9.794
  515    H2     A  48           H2         A  48  12.084   6.512   6.257
  516   1H5*    G  49          1H5*        G  49  16.596  10.590   9.629
  517   2H5*    G  49          2H5*        G  49  16.494  12.347   9.548
  518    H4*    G  49           H4*        G  49  16.467  11.341   7.329
  519    H3*    G  49           H3*        G  49  13.800  12.601   8.067
  520    H2*    G  49           H2*        G  49  13.249  12.221   5.711
  521   2HO*    G  49          2HO*        G  49  15.661  12.528   5.087
  522    H1*    G  49           H1*        G  49  14.067   9.652   5.779
  523    H8     G  49           H8         G  49  12.814  10.149   9.301
  524    H1     G  49           H1         G  49   8.079   9.878   4.964
  525   1H2     G  49          1H2         G  49   8.866  10.255   2.992
  526   2H2     G  49          2H2         G  49  10.589  10.322   2.678
  527   1H5*    G  50          1H5*        G  50  14.610  14.074   4.374
  528   2H5*    G  50          2H5*        G  50  14.488  15.824   4.254
  529    H4*    G  50           H4*        G  50  13.223  14.704   2.480
  530    H3*    G  50           H3*        G  50  11.485  16.167   4.498
  531    H2*    G  50           H2*        G  50   9.640  15.672   2.967
  532   2HO*    G  50          2HO*        G  50  11.242  15.834   1.034
  533    H1*    G  50           H1*        G  50  10.353  13.066   2.638
  534    H8     G  50           H8         G  50  11.286  13.447   6.224
  535    H1     G  50           H1         G  50   4.924  13.153   5.270
  536   1H2     G  50          1H2         G  50   4.482  13.417   3.188
  537   2H2     G  50          2H2         G  50   5.711  13.864   2.021
  538   1H5*    U  51          1H5*        U  51  10.171  17.443   0.905
  539   2H5*    U  51          2H5*        U  51  10.339  19.167   0.583
  540    H4*    U  51           H4*        U  51   8.100  18.403   0.001
  541    H3*    U  51           H3*        U  51   8.630  20.603   1.659
  542    H2*    U  51           H2*        U  51   7.977  19.652   3.607
  543   2HO*    U  51          2HO*        U  51   5.282  20.091   2.784
  544    H1*    U  51           H1*        U  51   5.799  18.030   2.293
  545    H3     U  51           H3         U  51   4.716  16.359   6.296
  546    H5     U  51           H5         U  51   8.855  16.892   6.659
  547    H6     U  51           H6         U  51   8.923  17.565   4.300
  548   1H5*    G  52          1H5*        G  52   7.525  22.671  -2.447
  549   2H5*    G  52          2H5*        G  52   5.894  22.898  -3.049
  550    H4*    G  52           H4*        G  52   7.196  20.184  -2.575
  551    H3*    G  52           H3*        G  52   6.556  21.855  -5.037
  552    H2*    G  52           H2*        G  52   6.412  19.792  -6.257
  553   2HO*    G  52          2HO*        G  52   8.237  18.815  -4.905
  554    H1*    G  52           H1*        G  52   4.939  18.554  -4.298
  555    H8     G  52           H8         G  52   3.704  22.139  -4.386
  556    H1     G  52           H1         G  52   1.175  18.337  -8.919
  557   1H2     G  52          1H2         G  52   2.436  16.615  -9.230
  558   2H2     G  52          2H2         G  52   3.825  16.280  -8.215
  559   1H5*    C  53          1H5*        C  53   9.424  19.212  -6.571
  560   2H5*    C  53          2H5*        C  53  10.517  20.023  -7.699
  561    H4*    C  53           H4*        C  53   9.409  18.130  -8.750
  562    H3*    C  53           H3*        C  53   8.406  20.771  -9.864
  563    H2*    C  53           H2*        C  53   7.359  19.387 -11.560
  564   2HO*    C  53          2HO*        C  53   9.219  17.761 -11.476
  565    H1*    C  53           H1*        C  53   6.347  17.628  -9.732
  566   1H4     C  53          1H4         C  53   1.812  22.032 -10.273
  567   2H4     C  53          2H4         C  53   2.565  22.993  -9.020
  568    H5     C  53           H5         C  53   4.757  22.541  -8.158
  569    H6     C  53           H6         C  53   6.588  20.914  -8.155
  570   1H5*    C  54          1H5*        C  54   9.706  18.647 -13.220
  571   2H5*    C  54          2H5*        C  54  10.581  19.682 -14.350
  572    H4*    C  54           H4*        C  54   8.732  18.546 -15.455
  573    H3*    C  54           H3*        C  54   8.245  21.528 -15.150
  574    H2*    C  54           H2*        C  54   6.409  21.163 -16.683
  575   2HO*    C  54          2HO*        C  54   7.673  19.405 -17.875
  576    H1*    C  54           H1*        C  54   5.521  18.950 -15.344
  577   1H4     C  54          1H4         C  54   2.425  23.845 -12.717
  578   2H4     C  54          2H4         C  54   3.712  24.060 -11.554
  579    H5     C  54           H5         C  54   5.798  22.882 -11.664
  580    H6     C  54           H6         C  54   7.042  21.152 -12.872
  581   1H5*    C  55          1H5*        C  55   7.855  20.888 -19.264
  582   2H5*    C  55          2H5*        C  55   8.707  22.138 -20.179
  583    H4*    C  55           H4*        C  55   6.374  22.000 -20.875
  584    H3*    C  55           H3*        C  55   7.041  24.530 -19.342
  585    H2*    C  55           H2*        C  55   4.873  25.312 -19.976
  586   2HO*    C  55          2HO*        C  55   5.024  24.352 -22.197
  587    H1*    C  55           H1*        C  55   3.620  22.885 -19.521
  588   1H4     C  55          1H4         C  55   2.888  26.563 -14.353
  589   2H4     C  55          2H4         C  55   4.447  26.062 -13.740
  590    H5     C  55           H5         C  55   5.943  24.632 -14.952
  591    H6     C  55           H6         C  55   6.253  23.393 -17.044
  592   1H    MET 104          1H        MET 104  10.368 -16.712   2.970
  593    HA   MET 104           HA       MET 104  11.019 -13.844   2.594
  594   1HB   MET 104          1HB       MET 104  12.943 -14.975   3.820
  595   2HB   MET 104          2HB       MET 104  13.163 -16.010   2.416
  596   1HG   MET 104          1HG       MET 104  14.453 -14.469   1.490
  597   2HG   MET 104          2HG       MET 104  13.127 -13.318   1.430
  598   1HE   MET 104          1HE       MET 104  13.175 -11.003   2.914
  599   2HE   MET 104          2HE       MET 104  12.392 -12.200   3.970
  600   3HE   MET 104          3HE       MET 104  13.640 -11.110   4.608
  601    H    TYR 105           H        TYR 105  10.737 -13.248   0.524
  602    HA   TYR 105           HA       TYR 105  10.295 -15.408  -1.510
  603   1HB   TYR 105          1HB       TYR 105   9.063 -12.674  -1.073
  604   2HB   TYR 105          2HB       TYR 105   8.979 -13.463  -2.641
  605    HD1  TYR 105           HD1      TYR 105   7.386 -15.076  -3.125
  606    HD2  TYR 105           HD2      TYR 105   8.188 -14.263   1.071
  607    HE1  TYR 105           HE1      TYR 105   5.570 -16.625  -2.441
  608    HE2  TYR 105           HE2      TYR 105   6.510 -15.943   1.705
  609    HH   TYR 105           HH       TYR 105   4.785 -17.255   0.994
  610    H    VAL 106           H        VAL 106  11.693 -15.609  -3.129
  611    HA   VAL 106           HA       VAL 106  13.774 -13.470  -3.415
  612    HB   VAL 106           HB       VAL 106  13.886 -16.443  -4.043
  613   1HG1  VAL 106          1HG1      VAL 106  15.567 -15.237  -5.370
  614   2HG1  VAL 106          2HG1      VAL 106  16.158 -14.413  -3.907
  615   3HG1  VAL 106          3HG1      VAL 106  16.346 -16.166  -4.100
  616   1HG2  VAL 106          1HG2      VAL 106  13.687 -16.089  -1.634
  617   2HG2  VAL 106          2HG2      VAL 106  15.306 -16.648  -2.082
  618   3HG2  VAL 106          3HG2      VAL 106  15.034 -14.917  -1.693
  619    H    CYS 107           H        CYS 107  14.343 -12.618  -5.351
  620    HA   CYS 107           HA       CYS 107  12.709 -13.144  -7.725
  621   1HB   CYS 107          1HB       CYS 107  13.522 -10.853  -7.145
  622   2HB   CYS 107          2HB       CYS 107  15.185 -11.421  -7.304
  623    H    HIS 108           H        HIS 108  13.192 -14.502  -9.339
  624    HA   HIS 108           HA       HIS 108  15.840 -15.884  -9.240
  625   1HB   HIS 108          1HB       HIS 108  13.152 -16.874 -10.301
  626   2HB   HIS 108          2HB       HIS 108  14.666 -17.791 -10.327
  627    HD2  HIS 108           HD2      HIS 108  11.692 -17.961  -8.439
  628    HE1  HIS 108           HE1      HIS 108  14.555 -18.183  -5.273
  629    HE2  HIS 108           HE2      HIS 108  12.113 -18.561  -5.908
  630    H    PHE 109           H        PHE 109  15.057 -13.294 -10.658
  631    HA   PHE 109           HA       PHE 109  15.173 -13.774 -13.506
  632   1HB   PHE 109          1HB       PHE 109  14.702 -11.551 -12.131
  633   2HB   PHE 109          2HB       PHE 109  16.445 -11.357 -12.161
  634    HD1  PHE 109           HD1      PHE 109  13.325 -11.232 -13.998
  635    HD2  PHE 109           HD2      PHE 109  17.611 -10.925 -14.283
  636    HE1  PHE 109           HE1      PHE 109  13.072 -10.316 -16.302
  637    HE2  PHE 109           HE2      PHE 109  17.370  -9.984 -16.606
  638    HZ   PHE 109           HZ       PHE 109  15.091  -9.680 -17.601
  639    H    GLU 110           H        GLU 110  17.052 -13.571 -14.897
  640    HA   GLU 110           HA       GLU 110  19.059 -15.372 -14.208
  641   1HB   GLU 110          1HB       GLU 110  18.437 -14.669 -16.514
  642   2HB   GLU 110          2HB       GLU 110  19.268 -13.130 -16.276
  643   1HG   GLU 110          1HG       GLU 110  21.416 -14.342 -15.954
  644   2HG   GLU 110          2HG       GLU 110  20.575 -15.885 -16.103
  645    H    ASN 111           H        ASN 111  20.513 -15.235 -12.597
  646    HA   ASN 111           HA       ASN 111  22.456 -14.592 -11.518
  647   1HB   ASN 111          1HB       ASN 111  23.115 -13.787 -13.909
  648   2HB   ASN 111          2HB       ASN 111  22.714 -12.163 -13.344
  649   1HD2  ASN 111          1HD2      ASN 111  24.793 -11.292 -13.363
  650   2HD2  ASN 111          2HD2      ASN 111  26.077 -11.915 -12.335
  651    H    CYS 112           H        CYS 112  19.598 -13.286 -11.125
  652    HA   CYS 112           HA       CYS 112  20.264 -10.730  -9.834
  653   1HB   CYS 112          1HB       CYS 112  18.178 -10.993 -11.067
  654   2HB   CYS 112          2HB       CYS 112  17.628 -12.272  -9.956
  655    H    GLY 113           H        GLY 113  18.233 -13.407  -8.515
  656   1HA   GLY 113          1HA       GLY 113  18.325 -14.578  -6.526
  657   2HA   GLY 113          2HA       GLY 113  20.029 -14.103  -6.401
  658    H    LYS 114           H        LYS 114  17.843 -11.388  -6.627
  659    HA   LYS 114           HA       LYS 114  18.485 -10.496  -3.933
  660   1HB   LYS 114          1HB       LYS 114  17.902  -9.155  -6.091
  661   2HB   LYS 114          2HB       LYS 114  16.217  -9.371  -5.600
  662   1HG   LYS 114          1HG       LYS 114  16.623  -8.135  -3.537
  663   2HG   LYS 114          2HG       LYS 114  18.388  -8.207  -3.774
  664   1HD   LYS 114          1HD       LYS 114  18.208  -6.830  -5.809
  665   2HD   LYS 114          2HD       LYS 114  16.457  -6.840  -5.646
  666   1HE   LYS 114          1HE       LYS 114  17.246  -4.729  -5.009
  667   2HE   LYS 114          2HE       LYS 114  16.559  -5.544  -3.593
  668   1HZ   LYS 114          1HZ       LYS 114  18.683  -4.447  -3.074
  669   2HZ   LYS 114          2HZ       LYS 114  18.836  -6.056  -2.869
  670   3HZ   LYS 114          3HZ       LYS 114  19.471  -5.333  -4.192
  671    H    ALA 115           H        ALA 115  17.214 -10.411  -2.076
  672    HA   ALA 115           HA       ALA 115  14.779 -12.158  -2.125
  673   1HB   ALA 115          1HB       ALA 115  16.726 -13.237  -1.097
  674   2HB   ALA 115          2HB       ALA 115  16.888 -11.882   0.060
  675   3HB   ALA 115          3HB       ALA 115  15.447 -12.935   0.085
  676    H    PHE 116           H        PHE 116  12.957 -11.502  -1.110
  677    HA   PHE 116           HA       PHE 116  13.031  -8.848   0.277
  678   1HB   PHE 116          1HB       PHE 116  10.779  -9.952  -1.448
  679   2HB   PHE 116          2HB       PHE 116  10.929  -8.358  -0.758
  680    HD1  PHE 116           HD1      PHE 116  12.253 -10.677  -3.327
  681    HD2  PHE 116           HD2      PHE 116  12.309  -6.631  -1.835
  682    HE1  PHE 116           HE1      PHE 116  13.716 -10.033  -5.193
  683    HE2  PHE 116           HE2      PHE 116  13.789  -5.978  -3.743
  684    HZ   PHE 116           HZ       PHE 116  14.513  -7.733  -5.384
  685    H    LYS 117           H        LYS 117  11.560  -8.479   1.944
  686    HA   LYS 117           HA       LYS 117  10.897 -10.687   3.616
  687   1HB   LYS 117          1HB       LYS 117  11.263  -8.380   4.411
  688   2HB   LYS 117          2HB       LYS 117   9.832  -7.856   3.545
  689   1HG   LYS 117          1HG       LYS 117   8.466  -9.321   5.040
  690   2HG   LYS 117          2HG       LYS 117   9.936  -9.764   5.927
  691   1HD   LYS 117          1HD       LYS 117   8.611  -8.078   7.118
  692   2HD   LYS 117          2HD       LYS 117  10.159  -7.389   6.570
  693   1HE   LYS 117          1HE       LYS 117   8.721  -6.713   4.469
  694   2HE   LYS 117          2HE       LYS 117   7.338  -7.024   5.545
  695   1HZ   LYS 117          1HZ       LYS 117   8.113  -4.657   5.565
  696   2HZ   LYS 117          2HZ       LYS 117   8.280  -5.330   7.052
  697   3HZ   LYS 117          3HZ       LYS 117   9.600  -5.144   6.078
  698    H    LYS 118           H        LYS 118   8.990  -8.878   1.165
  699    HA   LYS 118           HA       LYS 118   6.803 -10.915   1.489
  700   1HB   LYS 118          1HB       LYS 118   6.485  -7.904   1.130
  701   2HB   LYS 118          2HB       LYS 118   5.165  -9.049   1.205
  702   1HG   LYS 118          1HG       LYS 118   7.180  -8.585   3.462
  703   2HG   LYS 118          2HG       LYS 118   5.631  -7.764   3.344
  704   1HD   LYS 118          1HD       LYS 118   4.379  -9.666   3.567
  705   2HD   LYS 118          2HD       LYS 118   5.703 -10.783   3.211
  706   1HE   LYS 118          1HE       LYS 118   5.626  -9.197   5.734
  707   2HE   LYS 118          2HE       LYS 118   4.725 -10.734   5.482
  708   1HZ   LYS 118          1HZ       LYS 118   6.581 -11.934   5.408
  709   2HZ   LYS 118          2HZ       LYS 118   7.585 -10.764   4.967
  710   3HZ   LYS 118          3HZ       LYS 118   7.048 -10.843   6.525
  711    H    HIS 119           H        HIS 119   5.586 -11.456  -0.335
  712    HA   HIS 119           HA       HIS 119   7.039 -11.484  -2.792
  713   1HB   HIS 119          1HB       HIS 119   4.986 -12.453  -3.772
  714   2HB   HIS 119          2HB       HIS 119   5.524 -13.228  -2.317
  715    HD1  HIS 119           HD1      HIS 119   2.652 -10.594  -3.021
  716    HD2  HIS 119           HD2      HIS 119   3.709 -14.139  -0.980
  717    HE1  HIS 119           HE1      HIS 119   0.491 -11.466  -1.856
  718    HE2  HIS 119           HE2      HIS 119   1.166 -13.583  -0.634
  719    H    ASN 120           H        ASN 120   4.602  -9.214  -1.565
  720    HA   ASN 120           HA       ASN 120   3.959  -7.986  -4.080
  721   1HB   ASN 120          1HB       ASN 120   3.719  -7.201  -1.161
  722   2HB   ASN 120          2HB       ASN 120   3.571  -5.935  -2.384
  723   1HD2  ASN 120          1HD2      ASN 120   1.676  -8.267  -0.722
  724   2HD2  ASN 120          2HD2      ASN 120   0.400  -8.346  -1.938
  725    H    GLN 121           H        GLN 121   6.698  -7.558  -1.813
  726    HA   GLN 121           HA       GLN 121   7.800  -5.228  -3.229
  727   1HB   GLN 121          1HB       GLN 121   9.407  -7.080  -1.505
  728   2HB   GLN 121          2HB       GLN 121   9.597  -5.344  -1.822
  729   1HG   GLN 121          1HG       GLN 121   7.761  -4.814  -0.344
  730   2HG   GLN 121          2HG       GLN 121   7.465  -6.549  -0.077
  731   1HE2  GLN 121          1HE2      GLN 121   9.246  -3.855   1.155
  732   2HE2  GLN 121          2HE2      GLN 121  10.301  -4.811   2.174
  733    H    LEU 122           H        LEU 122   8.266  -8.804  -3.219
  734    HA   LEU 122           HA       LEU 122  10.419  -8.932  -5.047
  735   1HB   LEU 122          1HB       LEU 122   9.657 -10.878  -3.815
  736   2HB   LEU 122          2HB       LEU 122   8.070 -10.806  -4.547
  737    HG   LEU 122           HG       LEU 122   8.892 -11.498  -6.694
  738   1HD1  LEU 122          1HD1      LEU 122  11.589 -11.724  -5.337
  739   2HD1  LEU 122          2HD1      LEU 122  11.148 -12.145  -7.016
  740   3HD1  LEU 122          3HD1      LEU 122  11.174 -10.459  -6.528
  741   1HD2  LEU 122          1HD2      LEU 122   8.328 -13.274  -5.012
  742   2HD2  LEU 122          2HD2      LEU 122   9.601 -13.778  -6.141
  743   3HD2  LEU 122          3HD2      LEU 122  10.028 -13.316  -4.493
  744    H    LYS 123           H        LYS 123   6.858  -9.048  -5.731
  745    HA   LYS 123           HA       LYS 123   6.959  -8.894  -8.536
  746   1HB   LYS 123          1HB       LYS 123   4.977  -7.687  -6.557
  747   2HB   LYS 123          2HB       LYS 123   4.733  -7.656  -8.305
  748   1HG   LYS 123          1HG       LYS 123   4.742 -10.097  -8.419
  749   2HG   LYS 123          2HG       LYS 123   5.092 -10.214  -6.688
  750   1HD   LYS 123          1HD       LYS 123   2.949  -8.983  -6.209
  751   2HD   LYS 123          2HD       LYS 123   2.588  -9.008  -7.950
  752   1HE   LYS 123          1HE       LYS 123   2.698 -11.504  -7.910
  753   2HE   LYS 123          2HE       LYS 123   3.042 -11.454  -6.179
  754   1HZ   LYS 123          1HZ       LYS 123   0.736 -11.852  -6.485
  755   2HZ   LYS 123          2HZ       LYS 123   0.855 -10.334  -5.893
  756   3HZ   LYS 123          3HZ       LYS 123   0.533 -10.563  -7.486
  757    H    VAL 124           H        VAL 124   7.036  -6.190  -6.152
  758    HA   VAL 124           HA       VAL 124   7.128  -4.031  -8.001
  759    HB   VAL 124           HB       VAL 124   8.167  -4.425  -5.194
  760   1HG1  VAL 124          1HG1      VAL 124   9.777  -2.800  -6.019
  761   2HG1  VAL 124          2HG1      VAL 124   8.475  -1.854  -6.776
  762   3HG1  VAL 124          3HG1      VAL 124   8.580  -1.993  -5.009
  763   1HG2  VAL 124          1HG2      VAL 124   6.298  -3.205  -4.606
  764   2HG2  VAL 124          2HG2      VAL 124   6.241  -2.411  -6.224
  765   3HG2  VAL 124          3HG2      VAL 124   5.702  -4.091  -5.994
  766    H    HIS 125           H        HIS 125   9.800  -6.044  -6.657
  767    HA   HIS 125           HA       HIS 125  11.899  -4.546  -7.859
  768   1HB   HIS 125          1HB       HIS 125  12.326  -6.007  -6.014
  769   2HB   HIS 125          2HB       HIS 125  11.707  -7.417  -6.872
  770    HD1  HIS 125           HD1      HIS 125  14.737  -5.029  -7.026
  771    HD2  HIS 125           HD2      HIS 125  13.306  -8.745  -8.406
  772    HE1  HIS 125           HE1      HIS 125  16.720  -6.197  -8.109
  773    H    GLN 126           H        GLN 126  10.166  -7.526  -8.952
  774    HA   GLN 126           HA       GLN 126  11.776  -7.955 -11.269
  775   1HB   GLN 126          1HB       GLN 126   8.949  -8.841 -10.547
  776   2HB   GLN 126          2HB       GLN 126   9.774  -9.297 -12.073
  777   1HG   GLN 126          1HG       GLN 126  11.755 -10.050 -10.726
  778   2HG   GLN 126          2HG       GLN 126  10.884  -9.743  -9.232
  779   1HE2  GLN 126          1HE2      GLN 126  12.092 -12.106  -9.763
  780   2HE2  GLN 126          2HE2      GLN 126  10.849 -13.365  -9.994
  781    H    PHE 127           H        PHE 127   8.936  -5.892 -10.731
  782    HA   PHE 127           HA       PHE 127   8.268  -5.280 -13.406
  783   1HB   PHE 127          1HB       PHE 127   6.838  -4.006 -12.423
  784   2HB   PHE 127          2HB       PHE 127   7.508  -4.430 -10.902
  785    HD1  PHE 127           HD1      PHE 127   8.405  -1.761 -13.563
  786    HD2  PHE 127           HD2      PHE 127   7.400  -2.718  -9.500
  787    HE1  PHE 127           HE1      PHE 127   8.837   0.553 -12.918
  788    HE2  PHE 127           HE2      PHE 127   7.887  -0.503  -8.763
  789    HZ   PHE 127           HZ       PHE 127   8.714   1.231 -10.487
  790    H    SER 128           H        SER 128  11.069  -4.296 -11.478
  791    HA   SER 128           HA       SER 128  11.929  -2.112 -13.193
  792   1HB   SER 128          1HB       SER 128  12.660  -2.546 -10.810
  793   2HB   SER 128          2HB       SER 128  13.671  -3.879 -11.421
  794    HG   SER 128           HG       SER 128  14.819  -1.877 -11.262
  795    H    HIS 129           H        HIS 129  12.820  -5.632 -12.994
  796    HA   HIS 129           HA       HIS 129  14.726  -5.576 -15.155
  797   1HB   HIS 129          1HB       HIS 129  12.982  -7.848 -14.117
  798   2HB   HIS 129          2HB       HIS 129  14.280  -8.003 -15.275
  799    HD1  HIS 129           HD1      HIS 129  16.852  -7.529 -14.271
  800    HD2  HIS 129           HD2      HIS 129  13.644  -8.632 -11.823
  801    HE1  HIS 129           HE1      HIS 129  17.850  -8.658 -12.194
  802    H    THR 130           H        THR 130  11.195  -6.101 -15.035
  803    HA   THR 130           HA       THR 130  10.991  -6.736 -17.892
  804    HB   THR 130           HB       THR 130   8.548  -6.612 -17.476
  805    HG1  THR 130           HG1      THR 130   9.375  -5.629 -15.001
  806   1HG2  THR 130          1HG2      THR 130   9.734  -8.079 -15.052
  807   2HG2  THR 130          2HG2      THR 130   8.288  -8.457 -15.983
  808   3HG2  THR 130          3HG2      THR 130   9.900  -8.712 -16.702
  809    H    GLN 131           H        GLN 131  11.107  -3.857 -15.984
  810    HA   GLN 131           HA       GLN 131  10.769  -1.638 -16.383
  811   1HB   GLN 131          1HB       GLN 131  12.293  -2.442 -18.457
  812   2HB   GLN 131          2HB       GLN 131  10.861  -1.982 -19.378
  813   1HG   GLN 131          1HG       GLN 131  11.769   0.119 -19.247
  814   2HG   GLN 131          2HG       GLN 131  11.040   0.170 -17.641
  815   1HE2  GLN 131          1HE2      GLN 131  12.862  -1.348 -16.013
  816   2HE2  GLN 131          2HE2      GLN 131  14.410  -0.551 -16.135
  817    H    GLN 132           H        GLN 132   8.403  -3.402 -16.238
  818    HA   GLN 132           HA       GLN 132   6.509  -1.393 -17.399
  819   1HB   GLN 132          1HB       GLN 132   4.837  -3.097 -17.816
  820   2HB   GLN 132          2HB       GLN 132   6.273  -3.315 -18.803
  821   1HG   GLN 132          1HG       GLN 132   5.493  -5.472 -18.238
  822   2HG   GLN 132          2HG       GLN 132   6.964  -5.182 -17.331
  823   1HE2  GLN 132          1HE2      GLN 132   6.867  -5.623 -15.178
  824   2HE2  GLN 132          2HE2      GLN 132   5.377  -5.745 -14.226
  825    H    LEU 133           H        LEU 133   4.512  -1.179 -16.138
  826    HA   LEU 133           HA       LEU 133   5.250  -1.361 -13.295
  827   1HB   LEU 133          1HB       LEU 133   3.309   0.330 -14.873
  828   2HB   LEU 133          2HB       LEU 133   3.234   0.319 -13.103
  829    HG   LEU 133           HG       LEU 133   5.890   0.814 -14.595
  830   1HD1  LEU 133          1HD1      LEU 133   4.248   2.537 -15.295
  831   2HD1  LEU 133          2HD1      LEU 133   3.902   2.893 -13.588
  832   3HD1  LEU 133          3HD1      LEU 133   5.517   3.206 -14.257
  833   1HD2  LEU 133          1HD2      LEU 133   6.621   1.789 -12.557
  834   2HD2  LEU 133          2HD2      LEU 133   5.023   1.604 -11.824
  835   3HD2  LEU 133          3HD2      LEU 133   6.006   0.171 -12.196
  836    HA   PRO 134           HA       PRO 134   2.457  -4.685 -12.697
  837   1HB   PRO 134          1HB       PRO 134   2.576  -4.642  -9.866
  838   2HB   PRO 134          2HB       PRO 134   3.693  -5.502 -10.967
  839   1HG   PRO 134          1HG       PRO 134   4.173  -3.115  -9.332
  840   2HG   PRO 134          2HG       PRO 134   5.332  -4.124 -10.209
  841   1HD   PRO 134          1HD       PRO 134   4.334  -1.519 -10.918
  842   2HD   PRO 134          2HD       PRO 134   5.431  -2.579 -11.807
  843    H    TYR 135           H        TYR 135   1.904  -1.740 -10.744
  844    HA   TYR 135           HA       TYR 135  -0.818  -2.674 -10.042
  845   1HB   TYR 135          1HB       TYR 135   0.769  -0.261  -9.033
  846   2HB   TYR 135          2HB       TYR 135  -0.736  -0.854  -8.375
  847    HD1  TYR 135           HD1      TYR 135  -0.879  -3.086  -7.299
  848    HD2  TYR 135           HD2      TYR 135   2.890  -1.283  -8.376
  849    HE1  TYR 135           HE1      TYR 135   0.365  -4.798  -5.924
  850    HE2  TYR 135           HE2      TYR 135   4.107  -2.892  -6.909
  851    HH   TYR 135           HH       TYR 135   3.920  -4.853  -5.669
  852    H    GLU 136           H        GLU 136  -2.102  -2.298 -11.846
  853    HA   GLU 136           HA       GLU 136  -2.006   0.431 -13.049
  854   1HB   GLU 136          1HB       GLU 136  -3.167  -0.525 -14.942
  855   2HB   GLU 136          2HB       GLU 136  -1.693  -1.430 -14.589
  856   1HG   GLU 136          1HG       GLU 136  -3.110  -3.199 -13.494
  857   2HG   GLU 136          2HG       GLU 136  -4.547  -2.317 -14.035
  858    H    CYS 137           H        CYS 137  -3.813   1.729 -13.157
  859    HA   CYS 137           HA       CYS 137  -5.905   1.289 -11.191
  860   1HB   CYS 137          1HB       CYS 137  -5.093   3.520 -11.585
  861   2HB   CYS 137          2HB       CYS 137  -5.426   3.413 -13.301
  862    HA   PRO 138           HA       PRO 138  -8.355  -0.952 -14.162
  863   1HB   PRO 138          1HB       PRO 138 -10.062  -2.196 -12.468
  864   2HB   PRO 138          2HB       PRO 138  -8.297  -2.466 -12.339
  865   1HG   PRO 138          1HG       PRO 138  -9.997  -0.507 -10.736
  866   2HG   PRO 138          2HG       PRO 138  -8.845  -1.727 -10.110
  867   1HD   PRO 138          1HD       PRO 138  -8.168   0.924 -10.542
  868   2HD   PRO 138          2HD       PRO 138  -7.004  -0.429 -10.687
  869    H    HIS 139           H        HIS 139  -9.320   1.952 -12.843
  870    HA   HIS 139           HA       HIS 139 -12.213   1.786 -13.025
  871   1HB   HIS 139          1HB       HIS 139 -10.213   4.062 -12.817
  872   2HB   HIS 139          2HB       HIS 139 -11.912   4.383 -13.125
  873    HD2  HIS 139           HD2      HIS 139  -9.642   2.992 -10.334
  874    HE1  HIS 139           HE1      HIS 139 -13.525   3.506  -8.645
  875    HE2  HIS 139           HE2      HIS 139 -11.096   2.926  -8.137
  876    H    GLU 140           H        GLU 140 -13.608   2.712 -14.589
  877    HA   GLU 140           HA       GLU 140 -12.832   2.250 -17.320
  878   1HB   GLU 140          1HB       GLU 140 -15.057   3.158 -17.867
  879   2HB   GLU 140          2HB       GLU 140 -15.120   1.942 -16.600
  880   1HG   GLU 140          1HG       GLU 140 -15.345   3.776 -14.891
  881   2HG   GLU 140          2HG       GLU 140 -15.402   4.950 -16.209
  882    H    GLY 141           H        GLY 141 -12.092   3.591 -18.895
  883   1HA   GLY 141          1HA       GLY 141 -11.571   5.593 -19.994
  884   2HA   GLY 141          2HA       GLY 141 -12.332   6.504 -18.678
  885    H    CYS 142           H        CYS 142 -10.193   4.342 -17.240
  886    HA   CYS 142           HA       CYS 142  -7.960   6.334 -17.256
  887   1HB   CYS 142          1HB       CYS 142  -9.422   5.959 -15.134
  888   2HB   CYS 142          2HB       CYS 142  -8.603   4.412 -14.996
  889    H    ASP 143           H        ASP 143  -5.810   5.505 -17.135
  890    HA   ASP 143           HA       ASP 143  -5.395   2.589 -17.473
  891   1HB   ASP 143          1HB       ASP 143  -5.861   3.679 -19.765
  892   2HB   ASP 143          2HB       ASP 143  -4.348   4.553 -19.560
  893    H    LYS 144           H        LYS 144  -4.624   5.062 -15.660
  894    HA   LYS 144           HA       LYS 144  -1.755   5.388 -15.884
  895   1HB   LYS 144          1HB       LYS 144  -3.574   5.710 -13.440
  896   2HB   LYS 144          2HB       LYS 144  -1.905   6.255 -13.585
  897   1HG   LYS 144          1HG       LYS 144  -2.983   7.508 -15.765
  898   2HG   LYS 144          2HG       LYS 144  -4.396   7.456 -14.689
  899   1HD   LYS 144          1HD       LYS 144  -3.097   8.605 -12.916
  900   2HD   LYS 144          2HD       LYS 144  -1.672   8.595 -13.963
  901   1HE   LYS 144          1HE       LYS 144  -2.561  10.754 -14.231
  902   2HE   LYS 144          2HE       LYS 144  -3.026   9.873 -15.693
  903   1HZ   LYS 144          1HZ       LYS 144  -4.933  11.054 -14.912
  904   2HZ   LYS 144          2HZ       LYS 144  -5.224   9.493 -14.501
  905   3HZ   LYS 144          3HZ       LYS 144  -4.715  10.588 -13.367
  906    H    ARG 145           H        ARG 145  -0.072   4.433 -14.680
  907    HA   ARG 145           HA       ARG 145  -0.751   1.996 -13.083
  908   1HB   ARG 145          1HB       ARG 145   1.546   2.016 -15.093
  909   2HB   ARG 145          2HB       ARG 145   0.890   0.674 -14.099
  910   1HG   ARG 145          1HG       ARG 145  -1.283   0.934 -15.337
  911   2HG   ARG 145          2HG       ARG 145  -0.453   2.005 -16.466
  912   1HD   ARG 145          1HD       ARG 145   0.949   0.226 -17.269
  913   2HD   ARG 145          2HD       ARG 145   0.532  -0.811 -15.897
  914    HE   ARG 145           HE       ARG 145  -1.420  -1.480 -16.944
  915   1HH1  ARG 145          1HH1      ARG 145  -0.419   1.397 -18.710
  916   2HH1  ARG 145          2HH1      ARG 145  -1.936   1.442 -19.583
  917   1HH2  ARG 145          1HH2      ARG 145  -3.164  -1.378 -18.031
  918   2HH2  ARG 145          2HH2      ARG 145  -3.495  -0.045 -19.159
  919    H    PHE 146           H        PHE 146   0.769   1.416 -11.528
  920    HA   PHE 146           HA       PHE 146   2.628   3.630 -10.771
  921   1HB   PHE 146          1HB       PHE 146   0.667   2.159  -8.944
  922   2HB   PHE 146          2HB       PHE 146   1.742   3.470  -8.491
  923    HD1  PHE 146           HD1      PHE 146   1.347   5.783  -9.264
  924    HD2  PHE 146           HD2      PHE 146  -1.373   2.588 -10.282
  925    HE1  PHE 146           HE1      PHE 146  -0.281   7.434 -10.178
  926    HE2  PHE 146           HE2      PHE 146  -3.018   4.211 -11.057
  927    HZ   PHE 146           HZ       PHE 146  -2.423   6.649 -11.145
  928    H    SER 147           H        SER 147   4.182   3.066  -9.114
  929    HA   SER 147           HA       SER 147   5.366   0.464  -9.764
  930   1HB   SER 147          1HB       SER 147   7.257   1.434  -8.300
  931   2HB   SER 147          2HB       SER 147   6.830   2.365  -9.755
  932    HG   SER 147           HG       SER 147   7.041   3.677  -7.873
  933    H    LEU 148           H        LEU 148   3.432   1.788  -7.178
  934    HA   LEU 148           HA       LEU 148   3.878  -0.701  -5.613
  935   1HB   LEU 148          1HB       LEU 148   4.208   2.151  -4.658
  936   2HB   LEU 148          2HB       LEU 148   3.663   0.926  -3.526
  937    HG   LEU 148           HG       LEU 148   6.251   0.697  -5.117
  938   1HD1  LEU 148          1HD1      LEU 148   7.367   1.225  -2.999
  939   2HD1  LEU 148          2HD1      LEU 148   6.356   2.576  -3.543
  940   3HD1  LEU 148          3HD1      LEU 148   5.797   1.523  -2.223
  941   1HD2  LEU 148          1HD2      LEU 148   6.787  -1.130  -3.566
  942   2HD2  LEU 148          2HD2      LEU 148   5.288  -0.860  -2.665
  943   3HD2  LEU 148          3HD2      LEU 148   5.219  -1.465  -4.332
  944    HA   PRO 149           HA       PRO 149  -0.493  -0.813  -5.329
  945   1HB   PRO 149          1HB       PRO 149  -0.866  -2.007  -2.833
  946   2HB   PRO 149          2HB       PRO 149  -0.365  -2.855  -4.309
  947   1HG   PRO 149          1HG       PRO 149   1.354  -1.928  -2.015
  948   2HG   PRO 149          2HG       PRO 149   1.446  -3.450  -2.981
  949   1HD   PRO 149          1HD       PRO 149   3.146  -1.356  -3.459
  950   2HD   PRO 149          2HD       PRO 149   2.555  -2.409  -4.695
  951    H    SER 150           H        SER 150   1.224   0.545  -2.502
  952    HA   SER 150           HA       SER 150  -1.000   1.935  -1.334
  953   1HB   SER 150          1HB       SER 150   0.833   3.381  -0.330
  954   2HB   SER 150          2HB       SER 150   0.990   1.642  -0.031
  955    HG   SER 150           HG       SER 150   2.928   2.878  -0.802
  956    H    ARG 151           H        ARG 151   1.310   2.766  -3.930
  957    HA   ARG 151           HA       ARG 151   0.484   5.545  -4.139
  958   1HB   ARG 151          1HB       ARG 151   2.676   4.356  -4.903
  959   2HB   ARG 151          2HB       ARG 151   1.799   3.966  -6.379
  960   1HG   ARG 151          1HG       ARG 151   1.429   6.335  -6.850
  961   2HG   ARG 151          2HG       ARG 151   2.034   6.803  -5.255
  962   1HD   ARG 151          1HD       ARG 151   3.704   5.459  -7.417
  963   2HD   ARG 151          2HD       ARG 151   3.692   7.196  -7.054
  964    HE   ARG 151           HE       ARG 151   4.259   5.808  -4.627
  965   1HH1  ARG 151          1HH1      ARG 151   5.935   6.450  -7.650
  966   2HH1  ARG 151          2HH1      ARG 151   7.494   6.260  -6.895
  967   1HH2  ARG 151          1HH2      ARG 151   6.120   5.532  -3.798
  968   2HH2  ARG 151          2HH2      ARG 151   7.619   5.685  -4.729
  969    H    LEU 152           H        LEU 152  -0.396   2.500  -5.822
  970    HA   LEU 152           HA       LEU 152  -2.245   3.658  -7.724
  971   1HB   LEU 152          1HB       LEU 152  -1.457   1.398  -8.013
  972   2HB   LEU 152          2HB       LEU 152  -1.988   0.943  -6.388
  973    HG   LEU 152           HG       LEU 152  -4.319   1.044  -7.024
  974   1HD1  LEU 152          1HD1      LEU 152  -5.064   1.436  -9.281
  975   2HD1  LEU 152          2HD1      LEU 152  -4.202   2.877  -8.764
  976   3HD1  LEU 152          3HD1      LEU 152  -3.404   1.721  -9.849
  977   1HD2  LEU 152          1HD2      LEU 152  -2.803  -0.499  -9.151
  978   2HD2  LEU 152          2HD2      LEU 152  -2.927  -1.042  -7.468
  979   3HD2  LEU 152          3HD2      LEU 152  -4.390  -0.873  -8.465
  980    H    LYS 153           H        LYS 153  -2.640   2.280  -4.397
  981    HA   LYS 153           HA       LYS 153  -5.443   2.659  -4.155
  982   1HB   LYS 153          1HB       LYS 153  -3.988   1.364  -2.590
  983   2HB   LYS 153          2HB       LYS 153  -3.339   2.877  -1.946
  984   1HG   LYS 153          1HG       LYS 153  -5.592   3.520  -1.154
  985   2HG   LYS 153          2HG       LYS 153  -6.276   2.058  -1.891
  986   1HD   LYS 153          1HD       LYS 153  -4.904   0.648  -0.367
  987   2HD   LYS 153          2HD       LYS 153  -4.157   2.100   0.305
  988   1HE   LYS 153          1HE       LYS 153  -5.823   1.388   1.858
  989   2HE   LYS 153          2HE       LYS 153  -6.391   2.879   1.103
  990   1HZ   LYS 153          1HZ       LYS 153  -7.271   0.138   0.343
  991   2HZ   LYS 153          2HZ       LYS 153  -8.142   1.188   1.233
  992   3HZ   LYS 153          3HZ       LYS 153  -7.829   1.519  -0.331
  993    H    ARG 154           H        ARG 154  -2.738   4.941  -3.526
  994    HA   ARG 154           HA       ARG 154  -4.395   7.082  -2.521
  995   1HB   ARG 154          1HB       ARG 154  -1.762   6.723  -2.484
  996   2HB   ARG 154          2HB       ARG 154  -1.817   7.599  -4.019
  997   1HG   ARG 154          1HG       ARG 154  -3.198   9.394  -2.740
  998   2HG   ARG 154          2HG       ARG 154  -2.815   8.486  -1.269
  999   1HD   ARG 154          1HD       ARG 154  -1.148  10.173  -1.372
 1000   2HD   ARG 154          2HD       ARG 154  -0.354   8.699  -1.957
 1001    HE   ARG 154           HE       ARG 154  -1.602  10.626  -3.874
 1002   1HH1  ARG 154          1HH1      ARG 154   1.438   9.121  -2.939
 1003   2HH1  ARG 154          2HH1      ARG 154   2.319  10.205  -3.996
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.515  11.780  -5.085
 1005   2HH2  ARG 154          2HH2      ARG 154   1.237  11.901  -4.897
 1006    H    HIS 155           H        HIS 155  -3.215   6.221  -5.808
 1007    HA   HIS 155           HA       HIS 155  -4.319   8.471  -7.197
 1008   1HB   HIS 155          1HB       HIS 155  -2.750   7.060  -8.329
 1009   2HB   HIS 155          2HB       HIS 155  -3.726   5.611  -8.079
 1010    HD1  HIS 155           HD1      HIS 155  -3.908   8.914 -10.094
 1011    HD2  HIS 155           HD2      HIS 155  -5.710   5.114  -9.763
 1012    HE1  HIS 155           HE1      HIS 155  -5.707   8.844 -11.865
 1013    H    GLU 156           H        GLU 156  -5.749   5.358  -6.152
 1014    HA   GLU 156           HA       GLU 156  -8.188   5.481  -7.525
 1015   1HB   GLU 156          1HB       GLU 156  -7.163   3.685  -5.865
 1016   2HB   GLU 156          2HB       GLU 156  -8.108   4.554  -4.642
 1017   1HG   GLU 156          1HG       GLU 156 -10.149   4.220  -6.056
 1018   2HG   GLU 156          2HG       GLU 156  -9.158   3.336  -7.222
 1019    H    LYS 157           H        LYS 157  -7.104   7.343  -4.705
 1020    HA   LYS 157           HA       LYS 157  -9.641   8.250  -3.738
 1021   1HB   LYS 157          1HB       LYS 157  -7.306   8.454  -2.674
 1022   2HB   LYS 157          2HB       LYS 157  -7.066   9.886  -3.694
 1023   1HG   LYS 157          1HG       LYS 157  -8.893  11.052  -2.613
 1024   2HG   LYS 157          2HG       LYS 157  -9.474   9.559  -1.884
 1025   1HD   LYS 157          1HD       LYS 157  -8.520  10.342  -0.052
 1026   2HD   LYS 157          2HD       LYS 157  -7.067   9.587  -0.670
 1027   1HE   LYS 157          1HE       LYS 157  -7.733  12.498  -1.281
 1028   2HE   LYS 157          2HE       LYS 157  -7.114  12.041   0.297
 1029   1HZ   LYS 157          1HZ       LYS 157  -5.284  12.692  -1.031
 1030   2HZ   LYS 157          2HZ       LYS 157  -5.152  11.078  -0.826
 1031   3HZ   LYS 157          3HZ       LYS 157  -5.635  11.703  -2.267
 1032    H    VAL 158           H        VAL 158  -7.706   9.170  -6.572
 1033    HA   VAL 158           HA       VAL 158  -8.914  11.706  -7.132
 1034    HB   VAL 158           HB       VAL 158  -7.864   9.626  -9.122
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.158  12.645  -9.399
 1036   2HG1  VAL 158          2HG1      VAL 158  -7.493  11.539 -10.610
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.217  11.453 -10.210
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.092  10.473  -7.500
 1039   2HG2  VAL 158          2HG2      VAL 158  -5.835  11.074  -9.165
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.629  12.117  -7.949
 1041    H    HIS 159           H        HIS 159  -9.870   8.352  -7.974
 1042    HA   HIS 159           HA       HIS 159 -12.221   9.212  -9.486
 1043   1HB   HIS 159          1HB       HIS 159 -11.277   6.497  -8.455
 1044   2HB   HIS 159          2HB       HIS 159 -12.743   6.734  -9.424
 1045    HD1  HIS 159           HD1      HIS 159 -12.011   8.365 -11.821
 1046    HD2  HIS 159           HD2      HIS 159  -9.220   5.862  -9.901
 1047    HE1  HIS 159           HE1      HIS 159 -10.080   8.037 -13.460
 1048    H    ALA 160           H        ALA 160 -11.498   8.223  -6.143
 1049    HA   ALA 160           HA       ALA 160 -14.242   7.831  -5.326
 1050   1HB   ALA 160          1HB       ALA 160 -11.836   8.588  -3.609
 1051   2HB   ALA 160          2HB       ALA 160 -13.337   7.824  -3.067
 1052   3HB   ALA 160          3HB       ALA 160 -12.225   6.927  -4.121
 1053    H    GLY 161           H        GLY 161 -12.123  10.674  -5.603
 1054   1HA   GLY 161          1HA       GLY 161 -12.981  12.893  -5.840
 1055   2HA   GLY 161          2HA       GLY 161 -14.454  12.415  -4.997
 1056    H    TYR 162           H        TYR 162 -13.338  14.750  -4.261
 1057    HA   TYR 162           HA       TYR 162 -12.012  14.127  -1.643
 1058   1HB   TYR 162          1HB       TYR 162 -11.564  16.549  -3.437
 1059   2HB   TYR 162          2HB       TYR 162 -10.811  16.281  -1.855
 1060    HD1  TYR 162           HD1      TYR 162  -8.773  14.910  -1.729
 1061    HD2  TYR 162           HD2      TYR 162 -11.139  14.962  -5.331
 1062    HE1  TYR 162           HE1      TYR 162  -7.023  13.591  -2.939
 1063    HE2  TYR 162           HE2      TYR 162  -9.594  13.390  -6.383
 1064    HH   TYR 162           HH       TYR 162  -6.431  12.535  -4.935
 1065    HA   PRO 163           HA       PRO 163 -15.990  16.109  -0.878
 1066   1HB   PRO 163          1HB       PRO 163 -16.683  14.796   1.420
 1067   2HB   PRO 163          2HB       PRO 163 -16.692  13.987  -0.175
 1068   1HG   PRO 163          1HG       PRO 163 -14.513  13.894   1.929
 1069   2HG   PRO 163          2HG       PRO 163 -15.260  12.527   1.041
 1070   1HD   PRO 163          1HD       PRO 163 -12.900  13.688   0.267
 1071   2HD   PRO 163          2HD       PRO 163 -14.072  13.021  -0.916
 1072    H    CYS 164           H        CYS 164 -16.659  17.835   0.349
 1073    HA   CYS 164           HA       CYS 164 -14.684  19.224   1.929
 1074   1HB   CYS 164          1HB       CYS 164 -16.649  20.155   0.472
 1075   2HB   CYS 164          2HB       CYS 164 -17.639  19.893   1.928
 1076    H    LYS 165           H        LYS 165 -14.483  19.511   4.071
 1077    HA   LYS 165           HA       LYS 165 -16.548  18.432   5.907
 1078   1HB   LYS 165          1HB       LYS 165 -14.851  17.277   7.287
 1079   2HB   LYS 165          2HB       LYS 165 -14.954  16.596   5.669
 1080   1HG   LYS 165          1HG       LYS 165 -12.888  17.864   5.009
 1081   2HG   LYS 165          2HG       LYS 165 -12.798  18.530   6.642
 1082   1HD   LYS 165          1HD       LYS 165 -11.244  16.715   6.483
 1083   2HD   LYS 165          2HD       LYS 165 -12.560  16.217   7.553
 1084   1HE   LYS 165          1HE       LYS 165 -13.599  14.941   5.688
 1085   2HE   LYS 165          2HE       LYS 165 -12.325  15.491   4.592
 1086   1HZ   LYS 165          1HZ       LYS 165 -10.712  14.303   5.988
 1087   2HZ   LYS 165          2HZ       LYS 165 -11.893  13.798   6.999
 1088   3HZ   LYS 165          3HZ       LYS 165 -11.856  13.269   5.457
 1089    H    LYS 166           H        LYS 166 -15.062  21.049   4.871
 1090    HA   LYS 166           HA       LYS 166 -13.862  22.206   7.260
 1091   1HB   LYS 166          1HB       LYS 166 -15.082  23.465   4.787
 1092   2HB   LYS 166          2HB       LYS 166 -14.204  24.367   6.012
 1093   1HG   LYS 166          1HG       LYS 166 -13.086  22.236   4.148
 1094   2HG   LYS 166          2HG       LYS 166 -12.790  23.972   4.100
 1095   1HD   LYS 166          1HD       LYS 166 -11.812  22.036   6.228
 1096   2HD   LYS 166          2HD       LYS 166 -10.858  22.821   4.965
 1097   1HE   LYS 166          1HE       LYS 166 -11.349  25.046   5.937
 1098   2HE   LYS 166          2HE       LYS 166 -12.329  24.291   7.202
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.333  23.137   7.982
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.419  23.829   6.816
 1101   3HZ   LYS 166          3HZ       LYS 166 -10.083  24.750   7.992
 1102    H    ASP 167           H        ASP 167 -17.162  21.730   6.168
 1103    HA   ASP 167           HA       ASP 167 -18.137  22.899   8.703
 1104   1HB   ASP 167          1HB       ASP 167 -18.149  24.761   6.949
 1105   2HB   ASP 167          2HB       ASP 167 -19.329  23.812   6.048
 1106    H    ASP 168           H        ASP 168 -20.073  21.979   9.412
 1107    HA   ASP 168           HA       ASP 168 -20.637  19.353   8.463
 1108   1HB   ASP 168          1HB       ASP 168 -20.970  20.186  10.802
 1109   2HB   ASP 168          2HB       ASP 168 -22.341  21.148  10.249
 1110    H    SER 169           H        SER 169 -22.055  22.493   7.621
 1111    HA   SER 169           HA       SER 169 -24.363  21.195   6.249
 1112   1HB   SER 169          1HB       SER 169 -23.684  24.140   6.690
 1113   2HB   SER 169          2HB       SER 169 -25.171  23.520   5.954
 1114    HG   SER 169           HG       SER 169 -25.416  23.987   8.201
 1115    H    CYS 170           H        CYS 170 -21.417  21.136   5.322
 1116    HA   CYS 170           HA       CYS 170 -21.906  22.200   2.570
 1117   1HB   CYS 170          1HB       CYS 170 -20.018  23.243   3.955
 1118   2HB   CYS 170          2HB       CYS 170 -19.221  21.683   3.875
 1119    H    SER 171           H        SER 171 -21.830  20.722   0.924
 1120    HA   SER 171           HA       SER 171 -20.969  17.920   1.585
 1121   1HB   SER 171          1HB       SER 171 -23.490  18.769   0.091
 1122   2HB   SER 171          2HB       SER 171 -22.979  17.103   0.418
 1123    HG   SER 171           HG       SER 171 -24.542  17.845   1.922
 1124    H    PHE 172           H        PHE 172 -19.911  20.327  -0.164
 1125    HA   PHE 172           HA       PHE 172 -19.987  19.517  -2.907
 1126   1HB   PHE 172          1HB       PHE 172 -19.213  21.714  -2.408
 1127   2HB   PHE 172          2HB       PHE 172 -18.060  21.134  -1.218
 1128    HD1  PHE 172           HD1      PHE 172 -15.938  20.063  -1.849
 1129    HD2  PHE 172           HD2      PHE 172 -18.618  21.599  -4.842
 1130    HE1  PHE 172           HE1      PHE 172 -14.168  19.802  -3.559
 1131    HE2  PHE 172           HE2      PHE 172 -16.772  21.539  -6.517
 1132    HZ   PHE 172           HZ       PHE 172 -14.530  20.674  -5.866
 1133    H    VAL 173           H        VAL 173 -18.750  18.113  -4.116
 1134    HA   VAL 173           HA       VAL 173 -16.440  16.779  -2.774
 1135    HB   VAL 173           HB       VAL 173 -18.432  15.412  -4.620
 1136   1HG1  VAL 173          1HG1      VAL 173 -16.090  14.498  -4.862
 1137   2HG1  VAL 173          2HG1      VAL 173 -15.993  14.318  -3.099
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.136  13.344  -4.039
 1139   1HG2  VAL 173          1HG2      VAL 173 -17.995  15.270  -1.607
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.493  15.617  -2.482
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.832  13.980  -2.517
 1142    H    GLY 174           H        GLY 174 -14.604  17.159  -3.829
 1143   1HA   GLY 174          1HA       GLY 174 -14.740  18.289  -6.567
 1144   2HA   GLY 174          2HA       GLY 174 -13.304  18.179  -5.532
 1145    H    LYS 175           H        LYS 175 -14.104  17.331  -8.445
 1146    HA   LYS 175           HA       LYS 175 -13.725  14.502  -8.598
 1147   1HB   LYS 175          1HB       LYS 175 -14.540  16.111 -10.409
 1148   2HB   LYS 175          2HB       LYS 175 -12.849  16.541 -10.694
 1149   1HG   LYS 175          1HG       LYS 175 -12.336  14.204 -11.301
 1150   2HG   LYS 175          2HG       LYS 175 -14.000  13.723 -10.901
 1151   1HD   LYS 175          1HD       LYS 175 -14.850  15.218 -12.693
 1152   2HD   LYS 175          2HD       LYS 175 -13.183  15.701 -13.080
 1153   1HE   LYS 175          1HE       LYS 175 -12.622  13.336 -13.597
 1154   2HE   LYS 175          2HE       LYS 175 -14.281  12.854 -13.217
 1155   1HZ   LYS 175          1HZ       LYS 175 -15.041  14.266 -15.057
 1156   2HZ   LYS 175          2HZ       LYS 175 -13.507  14.710 -15.410
 1157   3HZ   LYS 175          3HZ       LYS 175 -13.976  13.159 -15.606
 1158    H    THR 176           H        THR 176 -11.469  17.065  -7.892
 1159    HA   THR 176           HA       THR 176  -9.306  15.081  -7.627
 1160    HB   THR 176           HB       THR 176  -7.789  17.052  -8.703
 1161    HG1  THR 176           HG1      THR 176  -9.039  18.331  -9.744
 1162   1HG2  THR 176          1HG2      THR 176  -7.575  14.690  -9.229
 1163   2HG2  THR 176          2HG2      THR 176  -9.048  14.756 -10.228
 1164   3HG2  THR 176          3HG2      THR 176  -7.615  15.657 -10.718
 1165    H    TRP 177           H        TRP 177  -7.449  15.933  -6.430
 1166    HA   TRP 177           HA       TRP 177  -8.257  17.154  -4.058
 1167   1HB   TRP 177          1HB       TRP 177  -6.258  15.805  -4.223
 1168   2HB   TRP 177          2HB       TRP 177  -5.533  16.916  -5.356
 1169    HD1  TRP 177           HD1      TRP 177  -3.581  17.851  -4.311
 1170    HE1  TRP 177           HE1      TRP 177  -2.913  19.014  -2.114
 1171    HE3  TRP 177           HE3      TRP 177  -7.833  16.948  -1.679
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.787  18.707   0.616
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.800  17.177   0.789
 1174    HH2  TRP 177           HH2      TRP 177  -5.764  17.991   1.951
 1175    H    THR 178           H        THR 178  -6.689  18.702  -6.912
 1176    HA   THR 178           HA       THR 178  -6.315  21.292  -5.826
 1177    HB   THR 178           HB       THR 178  -6.742  22.053  -8.258
 1178    HG1  THR 178           HG1      THR 178  -6.359  19.498  -9.149
 1179   1HG2  THR 178          1HG2      THR 178  -4.636  21.204  -9.123
 1180   2HG2  THR 178          2HG2      THR 178  -4.488  21.786  -7.457
 1181   3HG2  THR 178          3HG2      THR 178  -4.532  20.048  -7.783
 1182    H    LEU 179           H        LEU 179  -9.189  19.950  -7.545
 1183    HA   LEU 179           HA       LEU 179 -10.706  22.331  -7.529
 1184   1HB   LEU 179          1HB       LEU 179 -11.689  19.442  -7.421
 1185   2HB   LEU 179          2HB       LEU 179 -12.678  20.844  -7.820
 1186    HG   LEU 179           HG       LEU 179 -10.322  19.797  -9.426
 1187   1HD1  LEU 179          1HD1      LEU 179 -13.307  19.896 -10.029
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.032  19.268 -11.103
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.368  18.456  -9.572
 1190   1HD2  LEU 179          1HD2      LEU 179 -11.039  21.456 -11.159
 1191   2HD2  LEU 179          2HD2      LEU 179 -12.148  22.181  -9.975
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.386  22.226  -9.715
 1193    H    TYR 180           H        TYR 180 -10.364  19.825  -5.003
 1194    HA   TYR 180           HA       TYR 180 -12.455  20.891  -3.290
 1195   1HB   TYR 180          1HB       TYR 180 -11.889  18.676  -2.851
 1196   2HB   TYR 180          2HB       TYR 180 -10.155  18.961  -2.948
 1197    HD1  TYR 180           HD1      TYR 180  -8.912  19.152  -0.980
 1198    HD2  TYR 180           HD2      TYR 180 -13.138  19.995  -0.861
 1199    HE1  TYR 180           HE1      TYR 180  -8.779  19.435   1.484
 1200    HE2  TYR 180           HE2      TYR 180 -12.966  20.403   1.591
 1201    HH   TYR 180           HH       TYR 180  -9.925  19.919   3.411
 1202    H    LEU 181           H        LEU 181  -8.859  21.125  -3.269
 1203    HA   LEU 181           HA       LEU 181  -8.657  22.944  -1.128
 1204   1HB   LEU 181          1HB       LEU 181  -6.952  22.518  -3.613
 1205   2HB   LEU 181          2HB       LEU 181  -6.529  23.674  -2.384
 1206    HG   LEU 181           HG       LEU 181  -6.849  20.641  -2.026
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.365  20.915  -1.416
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.800  21.014  -3.126
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.458  22.501  -2.184
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.879  21.001   0.278
 1211   2HD2  LEU 181          2HD2      LEU 181  -6.239  22.745   0.061
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.536  21.536   0.068
 1213    H    LYS 182           H        LYS 182  -9.163  23.613  -4.613
 1214    HA   LYS 182           HA       LYS 182  -9.099  26.486  -4.462
 1215   1HB   LYS 182          1HB       LYS 182  -8.941  25.186  -6.543
 1216   2HB   LYS 182          2HB       LYS 182 -10.598  24.637  -6.390
 1217   1HG   LYS 182          1HG       LYS 182  -9.943  27.606  -6.552
 1218   2HG   LYS 182          2HG       LYS 182  -9.938  26.592  -7.994
 1219   1HD   LYS 182          1HD       LYS 182 -12.315  25.881  -7.409
 1220   2HD   LYS 182          2HD       LYS 182 -12.347  27.193  -6.227
 1221   1HE   LYS 182          1HE       LYS 182 -11.691  27.541  -9.186
 1222   2HE   LYS 182          2HE       LYS 182 -13.315  27.715  -8.515
 1223   1HZ   LYS 182          1HZ       LYS 182 -12.606  29.577  -7.217
 1224   2HZ   LYS 182          2HZ       LYS 182 -11.022  29.377  -7.625
 1225   3HZ   LYS 182          3HZ       LYS 182 -12.119  29.845  -8.741
 1226    H    HIS 183           H        HIS 183 -11.789  24.108  -4.162
 1227    HA   HIS 183           HA       HIS 183 -13.897  26.008  -3.812
 1228   1HB   HIS 183          1HB       HIS 183 -14.499  23.757  -4.274
 1229   2HB   HIS 183          2HB       HIS 183 -13.518  23.090  -2.992
 1230    HD1  HIS 183           HD1      HIS 183 -16.927  24.811  -3.425
 1231    HD2  HIS 183           HD2      HIS 183 -14.461  23.078  -0.487
 1232    HE1  HIS 183           HE1      HIS 183 -18.348  24.603  -1.316
 1233    H    VAL 184           H        VAL 184 -11.688  24.404  -1.468
 1234    HA   VAL 184           HA       VAL 184 -12.888  25.440   0.909
 1235    HB   VAL 184           HB       VAL 184 -10.146  24.371   0.212
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.511  24.415   2.576
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.636  26.051   1.922
 1238   3HG1  VAL 184          3HG1      VAL 184 -10.943  25.407   2.955
 1239   1HG2  VAL 184          1HG2      VAL 184 -11.875  22.751   0.411
 1240   2HG2  VAL 184          2HG2      VAL 184 -10.943  22.656   1.895
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.536  23.495   1.880
 1242    H    ALA 185           H        ALA 185 -10.202  26.666  -1.116
 1243    HA   ALA 185           HA       ALA 185  -9.545  28.843   0.557
 1244   1HB   ALA 185          1HB       ALA 185  -9.267  28.587  -2.473
 1245   2HB   ALA 185          2HB       ALA 185  -8.403  29.747  -1.439
 1246   3HB   ALA 185          3HB       ALA 185  -8.095  28.009  -1.266
 1247    H    GLU 186           H        GLU 186 -12.079  28.460  -1.889
 1248    HA   GLU 186           HA       GLU 186 -12.665  31.346  -1.989
 1249   1HB   GLU 186          1HB       GLU 186 -12.716  29.770  -3.965
 1250   2HB   GLU 186          2HB       GLU 186 -14.164  29.028  -3.283
 1251   1HG   GLU 186          1HG       GLU 186 -15.360  31.183  -3.467
 1252   2HG   GLU 186          2HG       GLU 186 -13.887  31.972  -4.049
 1253    H    CYS 187           H        CYS 187 -14.019  28.406  -0.476
 1254    HA   CYS 187           HA       CYS 187 -16.495  29.913   0.267
 1255   1HB   CYS 187          1HB       CYS 187 -15.933  26.911   0.196
 1256   2HB   CYS 187          2HB       CYS 187 -17.483  27.663   0.595
 1257    HG   CYS 187           HG       CYS 187 -15.714  27.785  -2.184
 1258    H    HIS 188           H        HIS 188 -13.626  28.523   1.750
 1259    HA   HIS 188           HA       HIS 188 -14.879  28.907   4.455
 1260   1HB   HIS 188          1HB       HIS 188 -13.030  26.633   3.634
 1261   2HB   HIS 188          2HB       HIS 188 -13.685  26.905   5.254
 1262    HD1  HIS 188           HD1      HIS 188 -16.528  26.705   5.375
 1263    HD2  HIS 188           HD2      HIS 188 -14.438  25.177   2.066
 1264    HE1  HIS 188           HE1      HIS 188 -18.095  25.022   4.251
 1265    H    GLN 189           H        GLN 189 -12.708  30.242   2.473
 1266    HA   GLN 189           HA       GLN 189 -11.016  31.147   4.736
 1267   1HB   GLN 189          1HB       GLN 189  -9.816  30.206   2.102
 1268   2HB   GLN 189          2HB       GLN 189  -8.933  30.926   3.435
 1269   1HG   GLN 189          1HG       GLN 189  -9.572  28.997   4.886
 1270   2HG   GLN 189          2HG       GLN 189 -10.302  28.208   3.486
 1271   1HE2  GLN 189          1HE2      GLN 189  -8.059  27.251   5.152
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.706  27.038   4.049
 1273    H    ASP 190           H        ASP 190  -9.550  33.041   3.917
 1274    HA   ASP 190           HA       ASP 190 -11.268  35.082   2.845
 1275   1HB   ASP 190          1HB       ASP 190  -9.451  35.586   4.410
 1276   2HB   ASP 190          2HB       ASP 190  -8.246  34.992   3.265
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -7.654  30.108 -13.971
    2   2H5*    G   1          2H5*        G   1  -8.432  28.538 -13.708
    3    H4*    G   1           H4*        G   1  -7.614  28.723 -15.991
    4    H3*    G   1           H3*        G   1  -6.066  26.751 -14.294
    5    H2*    G   1           H2*        G   1  -5.023  26.061 -16.377
    6   2HO*    G   1          2HO*        G   1  -7.108  26.548 -17.636
    7    H1*    G   1           H1*        G   1  -4.460  28.597 -17.140
    8    H8     G   1           H8         G   1  -4.192  28.930 -13.410
    9    H1     G   1           H1         G   1   0.872  26.017 -16.106
   10   1H2     G   1          1H2         G   1   0.354  25.277 -18.072
   11   2H2     G   1          2H2         G   1  -1.174  25.672 -18.833
   12   1H5*    G   2          1H5*        G   2  -7.204  24.535 -17.572
   13   2H5*    G   2          2H5*        G   2  -7.829  22.947 -17.124
   14    H4*    G   2           H4*        G   2  -6.028  22.756 -18.749
   15    H3*    G   2           H3*        G   2  -5.268  21.747 -15.994
   16    H2*    G   2           H2*        G   2  -3.301  20.834 -17.097
   17   2HO*    G   2          2HO*        G   2  -4.611  20.433 -19.177
   18    H1*    G   2           H1*        G   2  -2.769  23.149 -18.425
   19    H8     G   2           H8         G   2  -4.227  24.364 -15.159
   20    H1     G   2           H1         G   2   1.811  22.210 -14.619
   21   1H2     G   2          1H2         G   2   2.301  20.952 -16.302
   22   2H2     G   2          2H2         G   2   1.230  20.780 -17.679
   23   1H5*    G   3          1H5*        G   3  -4.406  18.524 -18.513
   24   2H5*    G   3          2H5*        G   3  -5.062  17.012 -17.874
   25    H4*    G   3           H4*        G   3  -2.665  16.790 -18.345
   26    H3*    G   3           H3*        G   3  -3.427  16.770 -15.398
   27    H2*    G   3           H2*        G   3  -1.133  16.135 -14.996
   28   2HO*    G   3          2HO*        G   3  -1.182  14.776 -17.089
   29    H1*    G   3           H1*        G   3  -0.070  17.884 -16.841
   30    H8     G   3           H8         G   3  -2.859  19.764 -15.075
   31    H1     G   3           H1         G   3   2.629  19.413 -11.727
   32   1H2     G   3          1H2         G   3   3.854  17.812 -12.485
   33   2H2     G   3          2H2         G   3   3.441  16.939 -13.947
   34   1H5*    C   4          1H5*        C   4  -1.277  13.212 -15.606
   35   2H5*    C   4          2H5*        C   4  -2.116  11.921 -14.727
   36    H4*    C   4           H4*        C   4   0.077  12.221 -13.776
   37    H3*    C   4           H3*        C   4  -2.091  13.348 -11.969
   38    H2*    C   4           H2*        C   4  -0.350  13.603 -10.352
   39   2HO*    C   4          2HO*        C   4   0.628  11.437 -11.039
   40    H1*    C   4           H1*        C   4   1.573  14.396 -12.215
   41   1H4     C   4          1H4         C   4  -0.765  19.371  -8.970
   42   2H4     C   4          2H4         C   4  -2.201  19.395  -9.965
   43    H5     C   4           H5         C   4  -2.589  17.840 -11.748
   44    H6     C   4           H6         C   4  -1.734  15.832 -12.856
   45   1H5*    C   5          1H5*        C   5  -0.999  12.096  -8.963
   46   2H5*    C   5          2H5*        C   5  -2.065  10.917  -8.220
   47    H4*    C   5           H4*        C   5  -1.567  12.894  -6.822
   48    H3*    C   5           H3*        C   5  -3.999  11.553  -6.888
   49    H2*    C   5           H2*        C   5  -5.019  13.105  -8.447
   50   2HO*    C   5          2HO*        C   5  -5.444  13.898  -5.760
   51    H1*    C   5           H1*        C   5  -3.853  15.364  -6.880
   52   1H4     C   5          1H4         C   5  -5.646  18.768 -11.897
   53   2H4     C   5          2H4         C   5  -5.370  17.447 -12.999
   54    H5     C   5           H5         C   5  -4.644  15.277 -12.285
   55    H6     C   5           H6         C   5  -4.093  13.905 -10.330
   56   1H5*    A   6          1H5*        A   6  -2.145  14.828  -4.508
   57   2H5*    A   6          2H5*        A   6  -0.791  13.702  -4.428
   58    H4*    A   6           H4*        A   6  -0.174  15.592  -3.353
   59    H3*    A   6           H3*        A   6  -0.685  13.391  -1.410
   60    H2*    A   6           H2*        A   6  -0.164  14.882   0.409
   61   2HO*    A   6          2HO*        A   6   1.526  15.866  -1.220
   62    H1*    A   6           H1*        A   6  -1.424  17.139  -0.499
   63    H8     A   6           H8         A   6  -4.037  15.032  -1.798
   64   1H6     A   6          1H6         A   6  -6.040  14.064   3.998
   65   2H6     A   6          2H6         A   6  -6.357  13.765   2.306
   66    H2     A   6           H2         A   6  -2.137  16.154   4.259
   67   1H5*    U   7          1H5*        U   7   3.045  12.926   1.168
   68   2H5*    U   7          2H5*        U   7   2.054  14.210   0.501
   69    H4*    U   7           H4*        U   7   3.810  15.109   1.861
   70    H3*    U   7           H3*        U   7   3.241  16.232  -0.593
   71    H2*    U   7           H2*        U   7   4.963  14.960  -1.696
   72   2HO*    U   7          2HO*        U   7   5.816  17.562  -0.972
   73    H1*    U   7           H1*        U   7   6.773  15.715   0.630
   74    H3     U   7           H3         U   7  10.395  13.828  -1.169
   75    H5     U   7           H5         U   7   7.593  10.725  -1.051
   76    H6     U   7           H6         U   7   5.847  12.385  -0.604
   77   1H5*    A   8          1H5*        A   8   4.211  19.902  -0.731
   78   2H5*    A   8          2H5*        A   8   3.465  20.801   0.596
   79    H4*    A   8           H4*        A   8   2.763  21.838  -1.386
   80    H3*    A   8           H3*        A   8   0.896  20.954   0.403
   81    H2*    A   8           H2*        A   8   0.500  18.918  -0.872
   82   2HO*    A   8          2HO*        A   8  -1.572  19.880  -0.419
   83    H1*    A   8           H1*        A   8   0.341  20.801  -3.228
   84    H8     A   8           H8         A   8   2.448  17.599  -2.999
   85   1H6     A   8          1H6         A   8  -1.157  15.595  -7.625
   86   2H6     A   8          2H6         A   8   0.368  15.373  -6.801
   87    H2     A   8           H2         A   8  -3.015  19.260  -5.931
   88   1H5*    C   9          1H5*        C   9  -2.330  22.321  -0.528
   89   2H5*    C   9          2H5*        C   9  -2.634  23.860   0.286
   90    H4*    C   9           H4*        C   9  -4.213  22.295   1.074
   91    H3*    C   9           H3*        C   9  -2.151  22.893   3.168
   92    H2*    C   9           H2*        C   9  -3.427  21.450   4.641
   93   2HO*    C   9          2HO*        C   9  -5.517  22.205   3.395
   94    H1*    C   9           H1*        C   9  -3.767  19.440   2.852
   95   1H4     C   9          1H4         C   9   1.880  18.407   5.746
   96   2H4     C   9          2H4         C   9   2.665  18.888   4.255
   97    H5     C   9           H5         C   9   1.497  19.976   2.476
   98    H6     C   9           H6         C   9  -0.688  20.674   1.666
   99   1H5*    C  10          1H5*        C  10  -5.588  23.078   5.202
  100   2H5*    C  10          2H5*        C  10  -5.787  24.508   6.216
  101    H4*    C  10           H4*        C  10  -5.932  22.435   7.538
  102    H3*    C  10           H3*        C  10  -3.458  24.112   8.093
  103    H2*    C  10           H2*        C  10  -3.100  22.636   9.961
  104   2HO*    C  10          2HO*        C  10  -5.459  22.377  10.432
  105    H1*    C  10           H1*        C  10  -3.529  20.360   8.458
  106   1H4     C  10          1H4         C  10   2.686  21.169   7.808
  107   2H4     C  10          2H4         C  10   2.413  21.955   6.269
  108    H5     C  10           H5         C  10   0.238  22.607   5.491
  109    H6     C  10           H6         C  10  -2.151  22.591   6.035
  110   1H5*    U  11          1H5*        U  11  -4.799  24.424  11.961
  111   2H5*    U  11          2H5*        U  11  -4.433  26.040  12.574
  112    H4*    U  11           H4*        U  11  -3.153  24.126  13.613
  113    H3*    U  11           H3*        U  11  -1.603  26.325  12.256
  114    H2*    U  11           H2*        U  11   0.332  25.395  13.331
  115   2HO*    U  11          2HO*        U  11  -0.994  24.859  15.346
  116    H1*    U  11           H1*        U  11  -0.385  22.803  12.773
  117    H3     U  11           H3         U  11   3.210  23.750  10.094
  118    H5     U  11           H5         U  11  -0.022  25.516   8.102
  119    H6     U  11           H6         U  11  -1.431  25.003  10.047
  120   1H5*    C  12          1H5*        C  12  -0.001  27.109  16.500
  121   2H5*    C  12          2H5*        C  12   0.973  28.516  16.072
  122    H4*    C  12           H4*        C  12   1.576  25.570  15.862
  123    H3*    C  12           H3*        C  12   2.543  27.572  17.454
  124    H2*    C  12           H2*        C  12   3.265  28.930  15.621
  125   2HO*    C  12          2HO*        C  12   5.172  27.912  17.140
  126    H1*    C  12           H1*        C  12   4.546  26.446  14.430
  127   1H4     C  12          1H4         C  12   5.719  30.813   9.942
  128   2H4     C  12          2H4         C  12   4.043  31.296   9.892
  129    H5     C  12           H5         C  12   2.362  30.352  11.321
  130    H6     C  12           H6         C  12   1.950  28.734  13.118
  131   1H5*    U  13          1H5*        U  13   3.707  23.036  18.160
  132   2H5*    U  13          2H5*        U  13   4.441  22.944  19.764
  133    H4*    U  13           H4*        U  13   5.609  21.243  18.777
  134    H3*    U  13           H3*        U  13   7.285  23.485  18.911
  135    H2*    U  13           H2*        U  13   6.751  24.136  16.658
  136   2HO*    U  13          2HO*        U  13   9.121  22.557  16.701
  137    H1*    U  13           H1*        U  13   7.091  21.188  15.942
  138    H3     U  13           H3         U  13   6.939  22.279  11.543
  139    H5     U  13           H5         U  13   3.835  24.564  13.157
  140    H6     U  13           H6         U  13   4.448  23.734  15.384
  141   1H5*    U  14          1H5*        U  14  10.203  18.776  19.333
  142   2H5*    U  14          2H5*        U  14  11.649  19.675  18.880
  143    H4*    U  14           H4*        U  14   9.062  19.425  17.309
  144    H3*    U  14           H3*        U  14  11.554  17.961  17.267
  145    H2*    U  14           H2*        U  14  12.662  19.678  16.149
  146   2HO*    U  14          2HO*        U  14  11.364  18.047  14.223
  147    H1*    U  14           H1*        U  14  10.036  20.303  14.721
  148    H3     U  14           H3         U  14  12.372  23.118  11.990
  149    H5     U  14           H5         U  14  13.639  24.240  15.817
  150    H6     U  14           H6         U  14  12.319  22.386  16.743
  151   1H5*    G  15          1H5*        G  15   6.828  15.389  15.540
  152   2H5*    G  15          2H5*        G  15   7.318  16.912  14.783
  153    H4*    G  15           H4*        G  15   5.371  16.927  17.102
  154    H3*    G  15           H3*        G  15   4.805  16.265  14.203
  155    H2*    G  15           H2*        G  15   2.619  17.257  14.562
  156   2HO*    G  15          2HO*        G  15   2.541  16.535  16.908
  157    H1*    G  15           H1*        G  15   3.671  19.495  15.642
  158    H8     G  15           H8         G  15   6.483  18.716  13.343
  159    H1     G  15           H1         G  15   1.217  20.626  10.193
  160   1H2     G  15          1H2         G  15  -0.521  20.392  11.452
  161   2H2     G  15          2H2         G  15  -0.389  20.010  13.158
  162   1H5*    G  16          1H5*        G  16   1.201  15.085  15.939
  163   2H5*    G  16          2H5*        G  16   0.765  13.449  15.428
  164    H4*    G  16           H4*        G  16  -1.063  14.997  15.020
  165    H3*    G  16           H3*        G  16   0.259  14.008  12.478
  166    H2*    G  16           H2*        G  16  -1.612  15.056  11.337
  167   2HO*    G  16          2HO*        G  16  -3.162  14.501  13.151
  168    H1*    G  16           H1*        G  16  -1.406  17.377  12.717
  169    H8     G  16           H8         G  16   2.204  16.414  12.552
  170    H1     G  16           H1         G  16  -0.119  17.913   6.769
  171   1H2     G  16          1H2         G  16  -2.269  18.202   6.852
  172   2H2     G  16          2H2         G  16  -3.181  17.850   8.307
  173   1H5*    G  17          1H5*        G  17  -3.582  13.038  11.462
  174   2H5*    G  17          2H5*        G  17  -3.651  11.438  10.712
  175    H4*    G  17           H4*        G  17  -4.447  13.214   9.211
  176    H3*    G  17           H3*        G  17  -1.891  11.868   8.299
  177    H2*    G  17           H2*        G  17  -2.198  13.162   6.239
  178   2HO*    G  17          2HO*        G  17  -4.622  13.028   6.418
  179    H1*    G  17           H1*        G  17  -2.483  15.479   7.485
  180    H8     G  17           H8         G  17  -0.332  13.826  10.033
  181    H1     G  17           H1         G  17   2.850  15.751   4.794
  182   1H2     G  17          1H2         G  17   1.453  16.223   3.200
  183   2H2     G  17          2H2         G  17  -0.264  15.891   3.350
  184   1H5*    C  18          1H5*        C  18  -3.757  11.441   4.863
  185   2H5*    C  18          2H5*        C  18  -3.607   9.822   4.165
  186    H4*    C  18           H4*        C  18  -2.606  11.465   2.711
  187    H3*    C  18           H3*        C  18  -0.482   9.793   4.054
  188    H2*    C  18           H2*        C  18   1.118  10.915   2.515
  189   2HO*    C  18          2HO*        C  18   0.089  11.384   0.606
  190    H1*    C  18           H1*        C  18   0.258  13.296   3.169
  191   1H4     C  18          1H4         C  18   4.354  11.862   7.804
  192   2H4     C  18          2H4         C  18   3.010  11.470   8.848
  193    H5     C  18           H5         C  18   0.726  11.462   8.107
  194    H6     C  18           H6         C  18  -0.716  11.692   6.159
  195   1H5*    C  19          1H5*        C  19   0.662   9.573   0.254
  196   2H5*    C  19          2H5*        C  19   1.107   7.952  -0.272
  197    H4*    C  19           H4*        C  19   2.903   9.536  -0.707
  198    H3*    C  19           H3*        C  19   3.577   7.580   1.520
  199    H2*    C  19           H2*        C  19   5.855   8.380   1.205
  200   2HO*    C  19          2HO*        C  19   5.361   8.734  -1.222
  201    H1*    C  19           H1*        C  19   5.125  10.990   1.266
  202   1H4     C  19          1H4         C  19   6.131   9.213   7.322
  203   2H4     C  19          2H4         C  19   4.457   8.735   7.483
  204    H5     C  19           H5         C  19   2.908   8.724   5.654
  205    H6     C  19           H6         C  19   2.630   9.264   3.282
  206   1H5*    U  20          1H5*        U  20   6.650   7.154  -1.148
  207   2H5*    U  20          2H5*        U  20   6.985   5.458  -1.508
  208    H4*    U  20           H4*        U  20   9.009   6.612  -0.798
  209    H3*    U  20           H3*        U  20   7.981   4.632   1.265
  210    H2*    U  20           H2*        U  20  10.187   4.875   2.242
  211   2HO*    U  20          2HO*        U  20  11.255   5.194   0.057
  212    H1*    U  20           H1*        U  20  10.065   7.589   2.118
  213    H3     U  20           H3         U  20   9.264   6.263   6.460
  214    H5     U  20           H5         U  20   5.499   6.277   4.642
  215    H6     U  20           H6         U  20   6.605   6.594   2.471
  216   1H5*    G  21          1H5*        G  21  11.799   3.297   0.219
  217   2H5*    G  21          2H5*        G  21  11.846   1.535   0.124
  218    H4*    G  21           H4*        G  21  13.559   2.370   1.619
  219    H3*    G  21           H3*        G  21  11.335   0.949   3.134
  220    H2*    G  21           H2*        G  21  12.934   0.943   4.950
  221   2HO*    G  21          2HO*        G  21  14.867   0.751   3.442
  222    H1*    G  21           H1*        G  21  13.445   3.594   4.635
  223    H8     G  21           H8         G  21   9.802   3.143   3.605
  224    H1     G  21           H1         G  21  10.745   2.981   9.969
  225   1H2     G  21          1H2         G  21  12.844   2.689  10.395
  226   2H2     G  21          2H2         G  21  14.062   2.741   9.139
  227   1H5*    G  22          1H5*        G  22  14.689  -1.156   4.021
  228   2H5*    G  22          2H5*        G  22  14.407  -2.894   3.945
  229    H4*    G  22           H4*        G  22  15.385  -2.308   6.059
  230    H3*    G  22           H3*        G  22  12.463  -3.025   6.390
  231    H2*    G  22           H2*        G  22  13.010  -3.251   8.713
  232   2HO*    G  22          2HO*        G  22  15.185  -4.123   8.457
  233    H1*    G  22           H1*        G  22  14.287  -0.836   8.722
  234    H8     G  22           H8         G  22  11.491  -0.400   6.197
  235    H1     G  22           H1         G  22   9.441  -0.463  12.305
  236   1H2     G  22          1H2         G  22  11.015  -1.142  13.613
  237   2H2     G  22          2H2         G  22  12.627  -1.500  13.023
  238   1H5*    U  23          1H5*        U  23  11.997  -7.745   8.331
  239   2H5*    U  23          2H5*        U  23  11.040  -6.251   8.285
  240    H4*    U  23           H4*        U  23  13.178  -6.880  10.358
  241    H3*    U  23           H3*        U  23  10.156  -7.038  10.335
  242    H2*    U  23           H2*        U  23  10.111  -6.409  12.621
  243   2HO*    U  23          2HO*        U  23  12.225  -7.578  13.084
  244    H1*    U  23           H1*        U  23  11.756  -4.288  12.291
  245    H3     U  23           H3         U  23   7.193  -3.167  12.244
  246    H5     U  23           H5         U  23   8.520  -3.054   8.281
  247    H6     U  23           H6         U  23  10.642  -4.062   9.012
  248   1H5*    U  24          1H5*        U  24  10.375  -8.945  13.350
  249   2H5*    U  24          2H5*        U  24   9.768 -10.602  13.449
  250    H4*    U  24           H4*        U  24   8.562  -9.265  15.028
  251    H3*    U  24           H3*        U  24   6.888  -9.794  12.570
  252    H2*    U  24           H2*        U  24   5.039  -8.902  13.734
  253   2HO*    U  24          2HO*        U  24   5.599  -9.831  15.866
  254    H1*    U  24           H1*        U  24   6.483  -6.769  14.725
  255    H3     U  24           H3         U  24   3.624  -5.274  11.409
  256    H5     U  24           H5         U  24   7.037  -6.591   9.366
  257    H6     U  24           H6         U  24   7.904  -7.485  11.481
  258   1H5*    A  25          1H5*        A  25   5.221 -13.786  11.537
  259   2H5*    A  25          2H5*        A  25   6.887 -14.224  11.177
  260    H4*    A  25           H4*        A  25   5.822 -13.767   9.108
  261    H3*    A  25           H3*        A  25   8.099 -12.232   9.782
  262    H2*    A  25           H2*        A  25   6.800 -10.283  10.301
  263   2HO*    A  25          2HO*        A  25   8.252  -9.599   8.674
  264    H1*    A  25           H1*        A  25   5.191 -11.060   7.848
  265    H8     A  25           H8         A  25   4.010 -10.002  11.431
  266   1H6     A  25          1H6         A  25   0.955  -5.509   8.364
  267   2H6     A  25          2H6         A  25   1.029  -6.411   9.864
  268    H2     A  25           H2         A  25   3.695  -7.543   5.509
  269   1H5*    G  26          1H5*        G  26   7.643 -15.571   4.904
  270   2H5*    G  26          2H5*        G  26   7.889 -13.873   4.577
  271    H4*    G  26           H4*        G  26   5.797 -14.128   6.597
  272    H3*    G  26           H3*        G  26   5.810 -16.410   4.925
  273    H2*    G  26           H2*        G  26   5.705 -14.882   3.091
  274   2HO*    G  26          2HO*        G  26   3.203 -16.169   3.557
  275    H1*    G  26           H1*        G  26   3.384 -13.707   4.666
  276    H8     G  26           H8         G  26   5.574 -13.342   1.523
  277    H1     G  26           H1         G  26   0.970  -8.939   2.094
  278   1H2     G  26          1H2         G  26   0.418  -8.788   4.185
  279   2H2     G  26          2H2         G  26   0.891  -9.994   5.368
  280   1H5*    U  27          1H5*        U  27   4.670 -16.743   8.177
  281   2H5*    U  27          2H5*        U  27   3.854 -18.280   8.518
  282    H4*    U  27           H4*        U  27   3.783 -17.262  10.594
  283    H3*    U  27           H3*        U  27   1.204 -16.396   9.217
  284    H2*    U  27           H2*        U  27   0.702 -15.025  11.101
  285   2HO*    U  27          2HO*        U  27   1.827 -16.742  12.567
  286    H1*    U  27           H1*        U  27   3.147 -13.906  11.364
  287    H3     U  27           H3         U  27   0.412 -10.882   9.186
  288    H5     U  27           H5         U  27   3.022 -12.498   6.368
  289    H6     U  27           H6         U  27   3.454 -14.360   7.908
  290   1H5*    A  28          1H5*        A  28  -0.329 -16.487  12.873
  291   2H5*    A  28          2H5*        A  28  -1.618 -17.688  12.941
  292    H4*    A  28           H4*        A  28  -2.496 -15.560  13.663
  293    H3*    A  28           H3*        A  28  -3.480 -16.321  10.883
  294    H2*    A  28           H2*        A  28  -4.917 -14.382  11.055
  295   2HO*    A  28          2HO*        A  28  -5.232 -14.741  13.468
  296    H1*    A  28           H1*        A  28  -2.953 -12.756  12.005
  297    H8     A  28           H8         A  28  -0.879 -14.670   9.621
  298   1H6     A  28          1H6         A  28  -3.282 -10.992   5.207
  299   2H6     A  28          2H6         A  28  -2.025 -12.165   5.558
  300    H2     A  28           H2         A  28  -6.107 -11.074   8.617
  301   1H5*    C  29          1H5*        C  29  -7.025 -15.565  12.162
  302   2H5*    C  29          2H5*        C  29  -8.230 -16.804  11.786
  303    H4*    C  29           H4*        C  29  -8.763 -14.748  10.618
  304    H3*    C  29           H3*        C  29  -7.741 -16.898   8.743
  305    H2*    C  29           H2*        C  29  -8.330 -15.350   6.944
  306   2HO*    C  29          2HO*        C  29 -10.287 -14.526   8.156
  307    H1*    C  29           H1*        C  29  -7.167 -13.228   8.067
  308   1H4     C  29          1H4         C  29  -2.511 -16.037   4.747
  309   2H4     C  29          2H4         C  29  -1.973 -16.847   6.200
  310    H5     C  29           H5         C  29  -3.200 -16.823   8.252
  311    H6     C  29           H6         C  29  -5.186 -15.933   9.362
  312   1H5*    C  30          1H5*        C  30 -11.399 -15.986   6.981
  313   2H5*    C  30          2H5*        C  30 -12.252 -17.436   6.430
  314    H4*    C  30           H4*        C  30 -11.790 -15.896   4.578
  315    H3*    C  30           H3*        C  30 -10.136 -18.433   4.423
  316    H2*    C  30           H2*        C  30  -9.574 -17.663   2.184
  317   2HO*    C  30          2HO*        C  30 -11.819 -16.607   1.954
  318    H1*    C  30           H1*        C  30  -9.040 -15.121   3.053
  319   1H4     C  30          1H4         C  30  -3.737 -18.695   3.206
  320   2H4     C  30          2H4         C  30  -4.072 -19.165   4.858
  321    H5     C  30           H5         C  30  -6.071 -18.526   6.029
  322    H6     C  30           H6         C  30  -8.195 -17.323   5.815
  323   1H5*    U  31          1H5*        U  31 -12.289 -18.044   0.714
  324   2H5*    U  31          2H5*        U  31 -13.217 -19.499   0.357
  325    H4*    U  31           H4*        U  31 -12.159 -18.670  -1.651
  326    H3*    U  31           H3*        U  31 -10.883 -21.237  -0.684
  327    H2*    U  31           H2*        U  31  -9.702 -21.256  -2.771
  328   2HO*    U  31          2HO*        U  31 -11.609 -20.345  -3.988
  329    H1*    U  31           H1*        U  31  -9.035 -18.602  -2.664
  330    H3     U  31           H3         U  31  -5.189 -20.974  -1.701
  331    H5     U  31           H5         U  31  -7.103 -20.411   1.986
  332    H6     U  31           H6         U  31  -9.098 -19.644   0.783
  333   1H5*    C  32          1H5*        C  32 -12.083 -22.535  -4.230
  334   2H5*    C  32          2H5*        C  32 -12.815 -24.143  -4.223
  335    H4*    C  32           H4*        C  32 -10.783 -24.158  -5.555
  336    H3*    C  32           H3*        C  32 -10.378 -25.610  -2.921
  337    H2*    C  32           H2*        C  32  -8.201 -26.200  -3.774
  338   2HO*    C  32          2HO*        C  32  -9.174 -26.386  -6.073
  339    H1*    C  32           H1*        C  32  -7.678 -23.700  -4.816
  340   1H4     C  32          1H4         C  32  -5.127 -24.190   1.015
  341   2H4     C  32          2H4         C  32  -6.665 -23.822   1.764
  342    H5     C  32           H5         C  32  -8.681 -23.455   0.515
  343    H6     C  32           H6         C  32  -9.645 -23.436  -1.737
  344   1H5*    U  33          1H5*        U  33  -8.548 -28.219  -5.040
  345   2H5*    U  33          2H5*        U  33  -9.259 -29.833  -4.957
  346    H4*    U  33           H4*        U  33  -6.928 -30.029  -4.352
  347    H3*    U  33           H3*        U  33  -8.733 -30.127  -1.916
  348    H2*    U  33           H2*        U  33  -6.916 -30.542  -0.617
  349   2HO*    U  33          2HO*        U  33  -4.994 -31.073  -2.683
  350    H1*    U  33           H1*        U  33  -5.116 -28.978  -2.140
  351    H3     U  33           H3         U  33  -4.981 -27.324   2.115
  352    H5     U  33           H5         U  33  -8.937 -26.619   0.956
  353    H6     U  33           H6         U  33  -8.448 -27.693  -1.197
  354   1H5*    U  34          1H5*        U  34  -8.900 -35.718  -1.139
  355   2H5*    U  34          2H5*        U  34  -8.051 -34.737   0.060
  356    H4*    U  34           H4*        U  34  -6.969 -36.896  -0.255
  357    H3*    U  34           H3*        U  34  -5.506 -34.583  -0.102
  358    H2*    U  34           H2*        U  34  -5.464 -34.275  -2.490
  359   2HO*    U  34          2HO*        U  34  -3.279 -34.105  -1.908
  360    H1*    U  34           H1*        U  34  -4.743 -37.222  -2.676
  361    H3     U  34           H3         U  34  -4.126 -36.931  -7.140
  362    H5     U  34           H5         U  34  -7.433 -34.440  -6.544
  363    H6     U  34           H6         U  34  -7.287 -34.909  -4.136
  364   1H5*    C  35          1H5*        C  35  -2.061 -34.799   0.564
  365   2H5*    C  35          2H5*        C  35  -1.662 -35.722   2.014
  366    H4*    C  35           H4*        C  35  -0.651 -33.511   2.049
  367    H3*    C  35           H3*        C  35  -1.806 -34.607   4.273
  368    H2*    C  35           H2*        C  35  -3.948 -33.618   3.867
  369   2HO*    C  35          2HO*        C  35  -2.443 -31.946   5.613
  370    H1*    C  35           H1*        C  35  -2.601 -30.961   3.269
  371   1H4     C  35          1H4         C  35  -8.822 -30.027   2.168
  372   2H4     C  35          2H4         C  35  -8.843 -31.316   0.977
  373    H5     C  35           H5         C  35  -6.970 -32.735   0.584
  374    H6     C  35           H6         C  35  -4.594 -33.060   1.027
  375   1H5*    G  36          1H5*        G  36   2.683 -31.346   4.253
  376   2H5*    G  36          2H5*        G  36   1.117 -31.383   3.422
  377    H4*    G  36           H4*        G  36   3.646 -32.766   2.448
  378    H3*    G  36           H3*        G  36   2.155 -30.290   1.503
  379    H2*    G  36           H2*        G  36   2.902 -30.814  -0.683
  380   2HO*    G  36          2HO*        G  36   5.154 -31.353   0.338
  381    H1*    G  36           H1*        G  36   2.942 -33.621  -0.225
  382    H8     G  36           H8         G  36   1.562 -34.070  -2.414
  383    H1     G  36           H1         G  36  -3.007 -29.847  -0.753
  384   1H2     G  36          1H2         G  36  -2.511 -28.872   1.080
  385   2H2     G  36          2H2         G  36  -1.011 -29.175   1.930
  386   1H5*    G  37          1H5*        G  37   4.675 -29.259  -0.536
  387   2H5*    G  37          2H5*        G  37   5.153 -27.562  -0.564
  388    H4*    G  37           H4*        G  37   3.792 -28.442  -2.546
  389    H3*    G  37           H3*        G  37   2.725 -26.040  -1.016
  390    H2*    G  37           H2*        G  37   1.155 -25.909  -2.914
  391   2HO*    G  37          2HO*        G  37   2.884 -26.865  -4.457
  392    H1*    G  37           H1*        G  37   0.501 -28.514  -2.752
  393    H8     G  37           H8         G  37   1.335 -27.295   0.793
  394    H1     G  37           H1         G  37  -4.283 -25.137  -1.457
  395   1H2     G  37          1H2         G  37  -4.481 -25.644  -3.544
  396   2H2     G  37          2H2         G  37  -3.340 -26.694  -4.361
  397   1H5*    U  38          1H5*        U  38   2.165 -24.969  -4.827
  398   2H5*    U  38          2H5*        U  38   2.854 -23.427  -5.312
  399    H4*    U  38           H4*        U  38   0.525 -23.590  -5.959
  400    H3*    U  38           H3*        U  38   0.952 -21.585  -3.767
  401    H2*    U  38           H2*        U  38  -1.267 -20.799  -4.258
  402   2HO*    U  38          2HO*        U  38  -1.259 -21.117  -6.577
  403    H1*    U  38           H1*        U  38  -2.305 -23.315  -4.189
  404    H3     U  38           H3         U  38  -3.367 -21.587  -0.068
  405    H5     U  38           H5         U  38   0.523 -23.050   0.385
  406    H6     U  38           H6         U  38   0.608 -23.425  -2.033
  407   1H5*    G  39          1H5*        G  39  -0.079 -19.219  -6.987
  408   2H5*    G  39          2H5*        G  39   0.786 -17.685  -6.955
  409    H4*    G  39           H4*        G  39  -1.578 -17.328  -7.033
  410    H3*    G  39           H3*        G  39  -0.568 -16.606  -4.279
  411    H2*    G  39           H2*        G  39  -2.825 -15.696  -3.978
  412   2HO*    G  39          2HO*        G  39  -3.016 -15.108  -6.372
  413    H1*    G  39           H1*        G  39  -3.972 -17.981  -4.825
  414    H8     G  39           H8         G  39  -0.612 -18.941  -3.241
  415    H1     G  39           H1         G  39  -5.218 -17.555   1.018
  416   1H2     G  39          1H2         G  39  -6.862 -16.570   0.021
  417   2H2     G  39          2H2         G  39  -6.952 -16.444  -1.722
  418   1H5*    G  40          1H5*        G  40  -2.646 -13.339  -5.631
  419   2H5*    G  40          2H5*        G  40  -1.892 -11.799  -5.201
  420    H4*    G  40           H4*        G  40  -4.251 -11.847  -4.574
  421    H3*    G  40           H3*        G  40  -2.246 -11.694  -2.299
  422    H2*    G  40           H2*        G  40  -4.186 -11.417  -0.845
  423   2HO*    G  40          2HO*        G  40  -5.360 -10.136  -2.633
  424    H1*    G  40           H1*        G  40  -5.621 -13.415  -1.946
  425    H8     G  40           H8         G  40  -2.111 -14.751  -2.193
  426    H1     G  40           H1         G  40  -4.320 -14.649   3.838
  427   1H2     G  40          1H2         G  40  -6.110 -13.454   3.961
  428   2H2     G  40          2H2         G  40  -6.808 -12.679   2.552
  429   1H5*    G  41          1H5*        G  41  -4.550  -9.181  -0.689
  430   2H5*    G  41          2H5*        G  41  -3.746  -7.667  -0.261
  431    H4*    G  41           H4*        G  41  -4.502  -8.694   1.777
  432    H3*    G  41           H3*        G  41  -1.515  -9.071   1.421
  433    H2*    G  41           H2*        G  41  -1.544  -9.878   3.729
  434   2HO*    G  41          2HO*        G  41  -3.291  -8.571   4.567
  435    H1*    G  41           H1*        G  41  -3.484 -11.647   3.188
  436    H8     G  41           H8         G  41  -1.773 -11.238  -0.171
  437    H1     G  41           H1         G  41   1.397 -15.098   3.857
  438   1H2     G  41          1H2         G  41   0.609 -14.945   5.844
  439   2H2     G  41          2H2         G  41  -0.680 -13.833   6.275
  440   1H5*    A  42          1H5*        A  42  -0.274  -5.292   5.090
  441   2H5*    A  42          2H5*        A  42  -0.112  -6.683   6.170
  442    H4*    A  42           H4*        A  42  -2.704  -5.608   4.983
  443    H3*    A  42           H3*        A  42  -1.585  -5.875   7.789
  444    H2*    A  42           H2*        A  42  -3.845  -6.179   8.592
  445   2HO*    A  42          2HO*        A  42  -4.753  -4.694   6.823
  446    H1*    A  42           H1*        A  42  -4.411  -8.116   6.838
  447    H8     A  42           H8         A  42  -0.898  -8.992   6.854
  448   1H6     A  42          1H6         A  42  -1.455 -10.955  12.735
  449   2H6     A  42          2H6         A  42  -0.484 -11.054  11.284
  450    H2     A  42           H2         A  42  -5.083  -8.619  11.733
  451   1H5*    A  43          1H5*        A  43  -4.251  -3.360   8.372
  452   2H5*    A  43          2H5*        A  43  -4.225  -1.800   9.156
  453    H4*    A  43           H4*        A  43  -5.566  -3.305  10.482
  454    H3*    A  43           H3*        A  43  -2.858  -2.860  11.800
  455    H2*    A  43           H2*        A  43  -3.574  -4.347  13.557
  456   2HO*    A  43          2HO*        A  43  -5.896  -3.451  13.335
  457    H1*    A  43           H1*        A  43  -4.685  -6.224  11.864
  458    H8     A  43           H8         A  43  -1.727  -5.334   9.876
  459   1H6     A  43          1H6         A  43   1.607  -9.017  13.585
  460   2H6     A  43          2H6         A  43   1.548  -8.243  12.011
  461    H2     A  43           H2         A  43  -2.205  -8.075  15.666
  462   1H5*    U  44          1H5*        U  44  -4.730  -2.485  15.066
  463   2H5*    U  44          2H5*        U  44  -4.317  -1.021  15.974
  464    H4*    U  44           H4*        U  44  -3.533  -2.948  17.205
  465    H3*    U  44           H3*        U  44  -1.270  -1.442  15.858
  466    H2*    U  44           H2*        U  44   0.217  -2.863  17.093
  467   2HO*    U  44          2HO*        U  44  -1.345  -2.885  19.023
  468    H1*    U  44           H1*        U  44  -1.167  -5.154  16.557
  469    H3     U  44           H3         U  44   2.514  -5.419  13.824
  470    H5     U  44           H5         U  44  -0.127  -2.923  11.750
  471    H6     U  44           H6         U  44  -1.535  -2.842  13.750
  472   1H5*    A  45          1H5*        A  45  -0.031  -1.487  19.780
  473   2H5*    A  45          2H5*        A  45   0.734   0.035  20.253
  474    H4*    A  45           H4*        A  45   2.272  -1.834  20.498
  475    H3*    A  45           H3*        A  45   3.056   0.006  18.206
  476    H2*    A  45           H2*        A  45   5.129  -1.227  18.208
  477   2HO*    A  45          2HO*        A  45   5.014  -1.584  20.662
  478    H1*    A  45           H1*        A  45   3.877  -3.635  18.214
  479    H8     A  45           H8         A  45   1.568  -1.232  16.354
  480   1H6     A  45          1H6         A  45   5.053  -2.365  11.331
  481   2H6     A  45          2H6         A  45   3.533  -1.709  11.905
  482    H2     A  45           H2         A  45   7.112  -4.113  14.847
  483   1H5*    C  46          1H5*        C  46   6.292  -0.105  20.673
  484   2H5*    C  46          2H5*        C  46   6.999   1.489  20.937
  485    H4*    C  46           H4*        C  46   8.667  -0.077  20.134
  486    H3*    C  46           H3*        C  46   7.947   2.013  18.041
  487    H2*    C  46           H2*        C  46   9.944   1.238  16.937
  488   2HO*    C  46          2HO*        C  46  11.114   0.823  19.043
  489    H1*    C  46           H1*        C  46   9.294  -1.404  17.318
  490   1H4     C  46          1H4         C  46   6.939   0.368  11.653
  491   2H4     C  46          2H4         C  46   5.433   0.845  12.407
  492    H5     C  46           H5         C  46   5.093   0.853  14.784
  493    H6     C  46           H6         C  46   6.148   0.384  16.948
  494   1H5*    C  47          1H5*        C  47  11.970   2.580  18.853
  495   2H5*    C  47          2H5*        C  47  12.401   4.291  18.905
  496    H4*    C  47           H4*        C  47  13.769   3.087  17.291
  497    H3*    C  47           H3*        C  47  11.785   4.957  15.958
  498    H2*    C  47           H2*        C  47  13.152   4.582  13.982
  499   2HO*    C  47          2HO*        C  47  15.222   4.428  15.257
  500    H1*    C  47           H1*        C  47  13.225   1.869  14.407
  501   1H4     C  47          1H4         C  47   8.248   3.139  10.612
  502   2H4     C  47          2H4         C  47   7.230   3.451  12.000
  503    H5     C  47           H5         C  47   8.041   3.436  14.261
  504    H6     C  47           H6         C  47  10.029   3.118  15.661
  505   1H5*    A  48          1H5*        A  48  15.667   6.286  14.928
  506   2H5*    A  48          2H5*        A  48  15.793   8.044  14.903
  507    H4*    A  48           H4*        A  48  16.590   7.065  12.820
  508    H3*    A  48           H3*        A  48  13.987   8.580  12.462
  509    H2*    A  48           H2*        A  48  14.463   8.347  10.077
  510   2HO*    A  48          2HO*        A  48  16.916   8.415  10.479
  511    H1*    A  48           H1*        A  48  14.917   5.689  10.312
  512    H8     A  48           H8         A  48  12.371   6.370  13.022
  513   1H6     A  48          1H6         A  48   8.055   6.293   8.540
  514   2H6     A  48          2H6         A  48   8.330   6.302  10.270
  515    H2     A  48           H2         A  48  12.044   6.400   6.597
  516   1H5*    G  49          1H5*        G  49  16.640  10.205   9.803
  517   2H5*    G  49          2H5*        G  49  16.606  11.961   9.713
  518    H4*    G  49           H4*        G  49  16.405  10.946   7.511
  519    H3*    G  49           H3*        G  49  13.838  12.316   8.391
  520    H2*    G  49           H2*        G  49  13.153  11.957   6.063
  521   2HO*    G  49          2HO*        G  49  15.549  12.154   5.322
  522    H1*    G  49           H1*        G  49  13.873   9.357   6.095
  523    H8     G  49           H8         G  49  12.802   9.884   9.668
  524    H1     G  49           H1         G  49   7.868   9.734   5.543
  525   1H2     G  49          1H2         G  49   8.573  10.093   3.536
  526   2H2     G  49          2H2         G  49  10.282  10.145   3.149
  527   1H5*    G  50          1H5*        G  50  14.574  13.738   4.672
  528   2H5*    G  50          2H5*        G  50  14.499  15.489   4.535
  529    H4*    G  50           H4*        G  50  13.130  14.379   2.830
  530    H3*    G  50           H3*        G  50  11.514  15.925   4.890
  531    H2*    G  50           H2*        G  50   9.604  15.458   3.415
  532   2HO*    G  50          2HO*        G  50  11.166  15.533   1.442
  533    H1*    G  50           H1*        G  50  10.239  12.827   3.113
  534    H8     G  50           H8         G  50  11.277  13.298   6.673
  535    H1     G  50           H1         G  50   4.894  12.996   5.879
  536   1H2     G  50          1H2         G  50   4.408  13.171   3.798
  537   2H2     G  50          2H2         G  50   5.609  13.581   2.591
  538   1H5*    U  51          1H5*        U  51  10.212  17.163   1.239
  539   2H5*    U  51          2H5*        U  51  10.397  18.879   0.883
  540    H4*    U  51           H4*        U  51   8.150  18.116   0.319
  541    H3*    U  51           H3*        U  51   8.707  20.350   1.933
  542    H2*    U  51           H2*        U  51   8.014  19.471   3.901
  543   2HO*    U  51          2HO*        U  51   5.323  19.852   3.039
  544    H1*    U  51           H1*        U  51   5.855  17.804   2.617
  545    H3     U  51           H3         U  51   4.762  16.270   6.665
  546    H5     U  51           H5         U  51   8.900  16.812   7.023
  547    H6     U  51           H6         U  51   8.973  17.414   4.645
  548   1H5*    G  52          1H5*        G  52   7.647  22.442  -2.140
  549   2H5*    G  52          2H5*        G  52   6.031  22.569  -2.810
  550    H4*    G  52           H4*        G  52   7.498  19.960  -2.260
  551    H3*    G  52           H3*        G  52   6.707  21.509  -4.756
  552    H2*    G  52           H2*        G  52   6.726  19.413  -5.927
  553   2HO*    G  52          2HO*        G  52   7.661  18.142  -3.518
  554    H1*    G  52           H1*        G  52   5.301  18.141  -3.967
  555    H8     G  52           H8         G  52   3.974  21.706  -4.121
  556    H1     G  52           H1         G  52   1.581  17.761  -8.602
  557   1H2     G  52          1H2         G  52   2.904  16.081  -8.889
  558   2H2     G  52          2H2         G  52   4.291  15.799  -7.855
  559   1H5*    C  53          1H5*        C  53   9.648  19.057  -6.353
  560   2H5*    C  53          2H5*        C  53  10.711  19.952  -7.450
  561    H4*    C  53           H4*        C  53   9.736  18.047  -8.582
  562    H3*    C  53           H3*        C  53   8.514  20.639  -9.596
  563    H2*    C  53           H2*        C  53   7.589  19.246 -11.345
  564   2HO*    C  53          2HO*        C  53   9.567  17.773 -11.338
  565    H1*    C  53           H1*        C  53   6.725  17.344  -9.586
  566   1H4     C  53          1H4         C  53   1.910  21.467 -10.055
  567   2H4     C  53          2H4         C  53   2.585  22.436  -8.765
  568    H5     C  53           H5         C  53   4.786  22.093  -7.877
  569    H6     C  53           H6         C  53   6.705  20.572  -7.878
  570   1H5*    C  54          1H5*        C  54   9.922  18.823 -13.044
  571   2H5*    C  54          2H5*        C  54  10.704  19.977 -14.126
  572    H4*    C  54           H4*        C  54   8.938  18.760 -15.268
  573    H3*    C  54           H3*        C  54   8.196  21.678 -14.831
  574    H2*    C  54           H2*        C  54   6.405  21.209 -16.386
  575   2HO*    C  54          2HO*        C  54   7.816  19.606 -17.638
  576    H1*    C  54           H1*        C  54   5.716  18.883 -15.124
  577   1H4     C  54          1H4         C  54   2.254  23.464 -12.378
  578   2H4     C  54          2H4         C  54   3.521  23.748 -11.207
  579    H5     C  54           H5         C  54   5.682  22.712 -11.323
  580    H6     C  54           H6         C  54   7.046  21.095 -12.559
  581   1H5*    C  55          1H5*        C  55   7.833  21.160 -18.940
  582   2H5*    C  55          2H5*        C  55   8.583  22.493 -19.824
  583    H4*    C  55           H4*        C  55   6.268  22.199 -20.525
  584    H3*    C  55           H3*        C  55   6.704  24.729 -18.897
  585    H2*    C  55           H2*        C  55   4.486  25.329 -19.517
  586   2HO*    C  55          2HO*        C  55   4.760  24.451 -21.765
  587    H1*    C  55           H1*        C  55   3.453  22.784 -19.155
  588   1H4     C  55          1H4         C  55   2.386  26.254 -13.899
  589   2H4     C  55          2H4         C  55   3.990  25.902 -13.300
  590    H5     C  55           H5         C  55   5.610  24.632 -14.537
  591    H6     C  55           H6         C  55   6.024  23.452 -16.645
  592   1H    MET 104          1H        MET 104  10.475 -16.673   2.863
  593    HA   MET 104           HA       MET 104  11.089 -13.799   2.472
  594   1HB   MET 104          1HB       MET 104  13.048 -14.886   3.664
  595   2HB   MET 104          2HB       MET 104  13.248 -15.947   2.276
  596   1HG   MET 104          1HG       MET 104  14.505 -14.424   1.284
  597   2HG   MET 104          2HG       MET 104  13.184 -13.269   1.247
  598   1HE   MET 104          1HE       MET 104  13.260 -10.947   2.716
  599   2HE   MET 104          2HE       MET 104  12.509 -12.145   3.793
  600   3HE   MET 104          3HE       MET 104  13.764 -11.047   4.400
  601    H    TYR 105           H        TYR 105  10.809 -13.201   0.394
  602    HA   TYR 105           HA       TYR 105  10.314 -15.373  -1.615
  603   1HB   TYR 105          1HB       TYR 105   9.106 -12.631  -1.170
  604   2HB   TYR 105          2HB       TYR 105   8.996 -13.417  -2.735
  605    HD1  TYR 105           HD1      TYR 105   8.243 -14.228   0.984
  606    HD2  TYR 105           HD2      TYR 105   7.374 -14.998  -3.208
  607    HE1  TYR 105           HE1      TYR 105   6.550 -15.882   1.622
  608    HE2  TYR 105           HE2      TYR 105   5.528 -16.506  -2.511
  609    HH   TYR 105           HH       TYR 105   4.780 -17.145   0.930
  610    H    VAL 106           H        VAL 106  11.694 -15.591  -3.246
  611    HA   VAL 106           HA       VAL 106  13.776 -13.463  -3.578
  612    HB   VAL 106           HB       VAL 106  13.853 -16.438  -4.200
  613   1HG1  VAL 106          1HG1      VAL 106  15.510 -15.252  -5.577
  614   2HG1  VAL 106          2HG1      VAL 106  16.144 -14.425  -4.135
  615   3HG1  VAL 106          3HG1      VAL 106  16.313 -16.181  -4.322
  616   1HG2  VAL 106          1HG2      VAL 106  15.316 -16.641  -2.271
  617   2HG2  VAL 106          2HG2      VAL 106  15.072 -14.905  -1.891
  618   3HG2  VAL 106          3HG2      VAL 106  13.712 -16.061  -1.790
  619    H    CYS 107           H        CYS 107  14.313 -12.615  -5.528
  620    HA   CYS 107           HA       CYS 107  12.619 -13.127  -7.859
  621   1HB   CYS 107          1HB       CYS 107  13.466 -10.847  -7.309
  622   2HB   CYS 107          2HB       CYS 107  15.122 -11.428  -7.507
  623    H    HIS 108           H        HIS 108  13.027 -14.540  -9.441
  624    HA   HIS 108           HA       HIS 108  15.667 -15.933  -9.419
  625   1HB   HIS 108          1HB       HIS 108  12.942 -16.892 -10.409
  626   2HB   HIS 108          2HB       HIS 108  14.440 -17.829 -10.470
  627    HD2  HIS 108           HD2      HIS 108  11.520 -17.965  -8.503
  628    HE1  HIS 108           HE1      HIS 108  14.467 -18.209  -5.418
  629    HE2  HIS 108           HE2      HIS 108  12.004 -18.565  -5.986
  630    H    PHE 109           H        PHE 109  14.871 -13.338 -10.836
  631    HA   PHE 109           HA       PHE 109  14.913 -13.841 -13.683
  632   1HB   PHE 109          1HB       PHE 109  14.492 -11.602 -12.309
  633   2HB   PHE 109          2HB       PHE 109  16.233 -11.418 -12.396
  634    HD1  PHE 109           HD1      PHE 109  13.057 -11.288 -14.127
  635    HD2  PHE 109           HD2      PHE 109  17.333 -11.018 -14.557
  636    HE1  PHE 109           HE1      PHE 109  12.733 -10.402 -16.434
  637    HE2  PHE 109           HE2      PHE 109  17.019 -10.094 -16.883
  638    HZ   PHE 109           HZ       PHE 109  14.711  -9.790 -17.804
  639    H    GLU 110           H        GLU 110  16.750 -13.668 -15.122
  640    HA   GLU 110           HA       GLU 110  18.767 -15.472 -14.470
  641   1HB   GLU 110          1HB       GLU 110  18.801 -13.262 -16.582
  642   2HB   GLU 110          2HB       GLU 110  19.954 -14.603 -16.504
  643   1HG   GLU 110          1HG       GLU 110  18.060 -16.221 -16.701
  644   2HG   GLU 110          2HG       GLU 110  16.941 -14.868 -16.883
  645    H    ASN 111           H        ASN 111  20.261 -15.330 -12.901
  646    HA   ASN 111           HA       ASN 111  22.237 -14.688 -11.875
  647   1HB   ASN 111          1HB       ASN 111  22.431 -12.354 -13.869
  648   2HB   ASN 111          2HB       ASN 111  23.690 -13.004 -12.859
  649   1HD2  ASN 111          1HD2      ASN 111  24.424 -15.273 -13.259
  650   2HD2  ASN 111          2HD2      ASN 111  24.319 -15.855 -14.913
  651    H    CYS 112           H        CYS 112  19.402 -13.366 -11.415
  652    HA   CYS 112           HA       CYS 112  20.115 -10.791 -10.184
  653   1HB   CYS 112          1HB       CYS 112  17.991 -11.071 -11.348
  654   2HB   CYS 112          2HB       CYS 112  17.470 -12.322 -10.193
  655    H    GLY 113           H        GLY 113  18.129 -13.457  -8.769
  656   1HA   GLY 113          1HA       GLY 113  18.291 -14.610  -6.771
  657   2HA   GLY 113          2HA       GLY 113  19.994 -14.120  -6.705
  658    H    LYS 114           H        LYS 114  17.817 -11.409  -6.889
  659    HA   LYS 114           HA       LYS 114  18.514 -10.511  -4.210
  660   1HB   LYS 114          1HB       LYS 114  17.912  -9.179  -6.364
  661   2HB   LYS 114          2HB       LYS 114  16.232  -9.376  -5.856
  662   1HG   LYS 114          1HG       LYS 114  16.671  -8.119  -3.811
  663   2HG   LYS 114          2HG       LYS 114  18.433  -8.212  -4.068
  664   1HD   LYS 114          1HD       LYS 114  18.241  -6.857  -6.120
  665   2HD   LYS 114          2HD       LYS 114  16.492  -6.845  -5.934
  666   1HE   LYS 114          1HE       LYS 114  17.304  -4.737  -5.330
  667   2HE   LYS 114          2HE       LYS 114  16.644  -5.530  -3.889
  668   1HZ   LYS 114          1HZ       LYS 114  19.543  -5.341  -4.557
  669   2HZ   LYS 114          2HZ       LYS 114  18.784  -4.445  -3.426
  670   3HZ   LYS 114          3HZ       LYS 114  18.936  -6.053  -3.214
  671    H    ALA 115           H        ALA 115  17.265 -10.396  -2.334
  672    HA   ALA 115           HA       ALA 115  14.829 -12.147  -2.331
  673   1HB   ALA 115          1HB       ALA 115  16.974 -11.855  -0.182
  674   2HB   ALA 115          2HB       ALA 115  15.532 -12.898  -0.117
  675   3HB   ALA 115          3HB       ALA 115  16.785 -13.219  -1.321
  676    H    PHE 116           H        PHE 116  13.021 -11.482  -1.302
  677    HA   PHE 116           HA       PHE 116  13.109  -8.817   0.065
  678   1HB   PHE 116          1HB       PHE 116  10.861  -9.926  -1.663
  679   2HB   PHE 116          2HB       PHE 116  10.983  -8.326  -0.973
  680    HD1  PHE 116           HD1      PHE 116  12.297 -10.647  -3.522
  681    HD2  PHE 116           HD2      PHE 116  12.462  -6.613  -2.006
  682    HE1  PHE 116           HE1      PHE 116  13.745 -10.015  -5.408
  683    HE2  PHE 116           HE2      PHE 116  13.903  -5.971  -3.943
  684    HZ   PHE 116           HZ       PHE 116  14.546  -7.718  -5.620
  685    H    LYS 117           H        LYS 117  11.658  -8.443   1.752
  686    HA   LYS 117           HA       LYS 117  10.995 -10.629   3.436
  687   1HB   LYS 117          1HB       LYS 117  11.320  -8.287   4.180
  688   2HB   LYS 117          2HB       LYS 117   9.849  -7.824   3.329
  689   1HG   LYS 117          1HG       LYS 117   8.555  -9.281   4.866
  690   2HG   LYS 117          2HG       LYS 117  10.047  -9.760   5.694
  691   1HD   LYS 117          1HD       LYS 117   8.740  -8.115   6.967
  692   2HD   LYS 117          2HD       LYS 117  10.298  -7.432   6.441
  693   1HE   LYS 117          1HE       LYS 117   8.886  -6.622   4.388
  694   2HE   LYS 117          2HE       LYS 117   7.484  -6.982   5.429
  695   1HZ   LYS 117          1HZ       LYS 117   8.271  -4.628   5.594
  696   2HZ   LYS 117          2HZ       LYS 117   8.433  -5.385   7.040
  697   3HZ   LYS 117          3HZ       LYS 117   9.752  -5.149   6.079
  698    H    LYS 118           H        LYS 118   9.078  -8.908   0.948
  699    HA   LYS 118           HA       LYS 118   6.859 -10.891   1.355
  700   1HB   LYS 118          1HB       LYS 118   6.631  -7.878   0.913
  701   2HB   LYS 118          2HB       LYS 118   5.264  -8.981   1.015
  702   1HG   LYS 118          1HG       LYS 118   7.282  -8.537   3.273
  703   2HG   LYS 118          2HG       LYS 118   5.754  -7.688   3.138
  704   1HD   LYS 118          1HD       LYS 118   4.458  -9.547   3.427
  705   2HD   LYS 118          2HD       LYS 118   5.740 -10.705   3.052
  706   1HE   LYS 118          1HE       LYS 118   5.744  -9.115   5.582
  707   2HE   LYS 118          2HE       LYS 118   4.812 -10.632   5.346
  708   1HZ   LYS 118          1HZ       LYS 118   7.135 -10.804   6.354
  709   2HZ   LYS 118          2HZ       LYS 118   6.635 -11.875   5.234
  710   3HZ   LYS 118          3HZ       LYS 118   7.666 -10.727   4.795
  711    H    HIS 119           H        HIS 119   5.582 -11.435  -0.441
  712    HA   HIS 119           HA       HIS 119   6.972 -11.522  -2.943
  713   1HB   HIS 119          1HB       HIS 119   4.908 -12.501  -3.845
  714   2HB   HIS 119          2HB       HIS 119   5.438 -13.241  -2.364
  715    HD1  HIS 119           HD1      HIS 119   2.624 -10.568  -3.153
  716    HD2  HIS 119           HD2      HIS 119   3.591 -14.094  -1.029
  717    HE1  HIS 119           HE1      HIS 119   0.455 -11.321  -1.918
  718    HE2  HIS 119           HE2      HIS 119   1.078 -13.437  -0.665
  719    H    ASN 120           H        ASN 120   4.611  -9.218  -1.639
  720    HA   ASN 120           HA       ASN 120   3.930  -7.953  -4.139
  721   1HB   ASN 120          1HB       ASN 120   3.730  -7.238  -1.204
  722   2HB   ASN 120          2HB       ASN 120   3.661  -5.920  -2.369
  723   1HD2  ASN 120          1HD2      ASN 120   1.669  -8.213  -0.804
  724   2HD2  ASN 120          2HD2      ASN 120   0.368  -8.165  -1.993
  725    H    GLN 121           H        GLN 121   6.638  -7.543  -1.829
  726    HA   GLN 121           HA       GLN 121   7.749  -5.209  -3.209
  727   1HB   GLN 121          1HB       GLN 121   9.164  -7.103  -1.323
  728   2HB   GLN 121          2HB       GLN 121   9.609  -5.443  -1.774
  729   1HG   GLN 121          1HG       GLN 121   6.993  -5.790  -0.334
  730   2HG   GLN 121          2HG       GLN 121   8.480  -6.097   0.554
  731   1HE2  GLN 121          1HE2      GLN 121   9.629  -4.378   1.352
  732   2HE2  GLN 121          2HE2      GLN 121   9.292  -2.705   0.958
  733    H    LEU 122           H        LEU 122   8.227  -8.776  -3.238
  734    HA   LEU 122           HA       LEU 122  10.437  -8.859  -5.024
  735   1HB   LEU 122          1HB       LEU 122   9.740 -10.838  -3.834
  736   2HB   LEU 122          2HB       LEU 122   8.122 -10.747  -4.497
  737    HG   LEU 122           HG       LEU 122   8.852 -11.401  -6.698
  738   1HD1  LEU 122          1HD1      LEU 122  11.088 -12.068  -7.122
  739   2HD1  LEU 122          2HD1      LEU 122  11.160 -10.401  -6.576
  740   3HD1  LEU 122          3HD1      LEU 122  11.589 -11.709  -5.446
  741   1HD2  LEU 122          1HD2      LEU 122  10.029 -13.290  -4.589
  742   2HD2  LEU 122          2HD2      LEU 122   8.309 -13.198  -5.041
  743   3HD2  LEU 122          3HD2      LEU 122   9.526 -13.699  -6.230
  744    H    LYS 123           H        LYS 123   6.887  -9.031  -5.734
  745    HA   LYS 123           HA       LYS 123   7.081  -8.942  -8.549
  746   1HB   LYS 123          1HB       LYS 123   4.931  -8.043  -6.587
  747   2HB   LYS 123          2HB       LYS 123   4.739  -7.795  -8.332
  748   1HG   LYS 123          1HG       LYS 123   5.131 -10.174  -8.769
  749   2HG   LYS 123          2HG       LYS 123   5.330 -10.499  -7.043
  750   1HD   LYS 123          1HD       LYS 123   3.005  -9.974  -6.600
  751   2HD   LYS 123          2HD       LYS 123   2.778  -9.344  -8.251
  752   1HE   LYS 123          1HE       LYS 123   3.302 -11.567  -9.192
  753   2HE   LYS 123          2HE       LYS 123   3.522 -12.230  -7.568
  754   1HZ   LYS 123          1HZ       LYS 123   1.211 -11.969  -7.123
  755   2HZ   LYS 123          2HZ       LYS 123   0.955 -11.029  -8.456
  756   3HZ   LYS 123          3HZ       LYS 123   1.288 -12.620  -8.599
  757    H    VAL 124           H        VAL 124   7.068  -6.256  -6.174
  758    HA   VAL 124           HA       VAL 124   7.028  -4.078  -8.025
  759    HB   VAL 124           HB       VAL 124   8.073  -4.473  -5.228
  760   1HG1  VAL 124          1HG1      VAL 124   9.708  -2.857  -6.028
  761   2HG1  VAL 124          2HG1      VAL 124   8.421  -1.894  -6.796
  762   3HG1  VAL 124          3HG1      VAL 124   8.511  -2.039  -5.029
  763   1HG2  VAL 124          1HG2      VAL 124   6.209  -3.221  -4.659
  764   2HG2  VAL 124          2HG2      VAL 124   6.165  -2.437  -6.284
  765   3HG2  VAL 124          3HG2      VAL 124   5.621  -4.120  -6.032
  766    H    HIS 125           H        HIS 125   9.774  -6.019  -6.709
  767    HA   HIS 125           HA       HIS 125  11.814  -4.507  -8.003
  768   1HB   HIS 125          1HB       HIS 125  12.352  -5.918  -6.160
  769   2HB   HIS 125          2HB       HIS 125  11.690  -7.353  -6.937
  770    HD1  HIS 125           HD1      HIS 125  14.731  -5.010  -7.269
  771    HD2  HIS 125           HD2      HIS 125  13.198  -8.725  -8.543
  772    HE1  HIS 125           HE1      HIS 125  16.659  -6.227  -8.394
  773    H    GLN 126           H        GLN 126  10.086  -7.528  -8.983
  774    HA   GLN 126           HA       GLN 126  11.610  -7.985 -11.350
  775   1HB   GLN 126          1HB       GLN 126   8.808  -8.863 -10.525
  776   2HB   GLN 126          2HB       GLN 126   9.584  -9.341 -12.067
  777   1HG   GLN 126          1HG       GLN 126  11.604 -10.074 -10.770
  778   2HG   GLN 126          2HG       GLN 126  10.772  -9.757  -9.257
  779   1HE2  GLN 126          1HE2      GLN 126  11.971 -12.136  -9.854
  780   2HE2  GLN 126          2HE2      GLN 126  10.714 -13.389 -10.034
  781    H    PHE 127           H        PHE 127   8.782  -5.922 -10.752
  782    HA   PHE 127           HA       PHE 127   8.018  -5.364 -13.411
  783   1HB   PHE 127          1HB       PHE 127   6.621  -4.071 -12.410
  784   2HB   PHE 127          2HB       PHE 127   7.335  -4.469 -10.904
  785    HD1  PHE 127           HD1      PHE 127   8.150  -1.841 -13.629
  786    HD2  PHE 127           HD2      PHE 127   7.252  -2.738  -9.526
  787    HE1  PHE 127           HE1      PHE 127   8.614   0.480 -13.026
  788    HE2  PHE 127           HE2      PHE 127   7.773  -0.517  -8.832
  789    HZ   PHE 127           HZ       PHE 127   8.568   1.188 -10.602
  790    H    SER 128           H        SER 128  10.883  -4.332 -11.609
  791    HA   SER 128           HA       SER 128  11.671  -2.179 -13.396
  792   1HB   SER 128          1HB       SER 128  12.493  -2.564 -11.038
  793   2HB   SER 128          2HB       SER 128  13.480  -3.910 -11.658
  794    HG   SER 128           HG       SER 128  14.627  -1.899 -11.576
  795    H    HIS 129           H        HIS 129  12.581  -5.691 -13.163
  796    HA   HIS 129           HA       HIS 129  14.405  -5.673 -15.395
  797   1HB   HIS 129          1HB       HIS 129  12.705  -7.929 -14.251
  798   2HB   HIS 129          2HB       HIS 129  13.959  -8.099 -15.456
  799    HD1  HIS 129           HD1      HIS 129  16.567  -7.619 -14.566
  800    HD2  HIS 129           HD2      HIS 129  13.454  -8.673 -11.976
  801    HE1  HIS 129           HE1      HIS 129  17.643  -8.723 -12.513
  802    H    THR 130           H        THR 130  10.882  -6.204 -15.134
  803    HA   THR 130           HA       THR 130  10.573  -6.883 -17.971
  804    HB   THR 130           HB       THR 130   8.148  -6.748 -17.468
  805    HG1  THR 130           HG1      THR 130   9.057  -5.727 -15.044
  806   1HG2  THR 130          1HG2      THR 130   9.419  -8.180 -15.065
  807   2HG2  THR 130          2HG2      THR 130   7.947  -8.577 -15.945
  808   3HG2  THR 130          3HG2      THR 130   9.534  -8.837 -16.711
  809    H    GLN 131           H        GLN 131  10.775  -3.975 -16.119
  810    HA   GLN 131           HA       GLN 131  10.414  -1.764 -16.534
  811   1HB   GLN 131          1HB       GLN 131  11.870  -2.595 -18.646
  812   2HB   GLN 131          2HB       GLN 131  10.405  -2.152 -19.526
  813   1HG   GLN 131          1HG       GLN 131  11.309  -0.047 -19.456
  814   2HG   GLN 131          2HG       GLN 131  10.643   0.024 -17.822
  815   1HE2  GLN 131          1HE2      GLN 131  12.536  -1.474 -16.250
  816   2HE2  GLN 131          2HE2      GLN 131  14.073  -0.671 -16.445
  817    H    GLN 132           H        GLN 132   8.053  -3.514 -16.274
  818    HA   GLN 132           HA       GLN 132   6.125  -1.523 -17.406
  819   1HB   GLN 132          1HB       GLN 132   4.440  -3.220 -17.755
  820   2HB   GLN 132          2HB       GLN 132   5.852  -3.476 -18.770
  821   1HG   GLN 132          1HG       GLN 132   5.053  -5.610 -18.131
  822   2HG   GLN 132          2HG       GLN 132   6.559  -5.319 -17.283
  823   1HE2  GLN 132          1HE2      GLN 132   6.532  -5.749 -15.132
  824   2HE2  GLN 132          2HE2      GLN 132   5.076  -5.817 -14.123
  825    H    LEU 133           H        LEU 133   4.168  -1.295 -16.089
  826    HA   LEU 133           HA       LEU 133   4.987  -1.444 -13.262
  827   1HB   LEU 133          1HB       LEU 133   3.027   0.244 -14.812
  828   2HB   LEU 133          2HB       LEU 133   2.998   0.263 -13.039
  829    HG   LEU 133           HG       LEU 133   5.616   0.706 -14.622
  830   1HD1  LEU 133          1HD1      LEU 133   3.678   2.826 -13.599
  831   2HD1  LEU 133          2HD1      LEU 133   5.278   3.108 -14.321
  832   3HD1  LEU 133          3HD1      LEU 133   3.971   2.434 -15.310
  833   1HD2  LEU 133          1HD2      LEU 133   5.797   0.107 -12.217
  834   2HD2  LEU 133          2HD2      LEU 133   6.415   1.713 -12.629
  835   3HD2  LEU 133          3HD2      LEU 133   4.838   1.560 -11.847
  836    HA   PRO 134           HA       PRO 134   2.160  -4.720 -12.577
  837   1HB   PRO 134          1HB       PRO 134   2.393  -4.732  -9.764
  838   2HB   PRO 134          2HB       PRO 134   3.478  -5.557 -10.920
  839   1HG   PRO 134          1HG       PRO 134   3.987  -3.184  -9.266
  840   2HG   PRO 134          2HG       PRO 134   5.131  -4.197 -10.159
  841   1HD   PRO 134          1HD       PRO 134   4.153  -1.590 -10.866
  842   2HD   PRO 134          2HD       PRO 134   5.201  -2.676 -11.782
  843    H    TYR 135           H        TYR 135   1.738  -1.804 -10.529
  844    HA   TYR 135           HA       TYR 135  -0.951  -2.705  -9.710
  845   1HB   TYR 135          1HB       TYR 135   0.659  -0.240  -8.877
  846   2HB   TYR 135          2HB       TYR 135  -0.829  -0.789  -8.148
  847    HD1  TYR 135           HD1      TYR 135  -0.967  -2.915  -6.912
  848    HD2  TYR 135           HD2      TYR 135   2.797  -1.309  -8.289
  849    HE1  TYR 135           HE1      TYR 135   0.280  -4.607  -5.531
  850    HE2  TYR 135           HE2      TYR 135   4.026  -2.934  -6.853
  851    HH   TYR 135           HH       TYR 135   2.301  -5.487  -4.995
  852    H    GLU 136           H        GLU 136  -2.320  -2.436 -11.449
  853    HA   GLU 136           HA       GLU 136  -2.326   0.214 -12.823
  854   1HB   GLU 136          1HB       GLU 136  -3.773  -0.916 -14.487
  855   2HB   GLU 136          2HB       GLU 136  -2.192  -1.659 -14.300
  856   1HG   GLU 136          1HG       GLU 136  -3.194  -3.502 -12.962
  857   2HG   GLU 136          2HG       GLU 136  -4.787  -2.760 -13.142
  858    H    CYS 137           H        CYS 137  -4.143   1.524 -12.852
  859    HA   CYS 137           HA       CYS 137  -6.091   1.190 -10.709
  860   1HB   CYS 137          1HB       CYS 137  -5.326   3.399 -11.291
  861   2HB   CYS 137          2HB       CYS 137  -5.782   3.192 -12.964
  862    HA   PRO 138           HA       PRO 138  -8.646  -1.302 -13.383
  863   1HB   PRO 138          1HB       PRO 138 -10.301  -2.389 -11.521
  864   2HB   PRO 138          2HB       PRO 138  -8.537  -2.683 -11.473
  865   1HG   PRO 138          1HG       PRO 138 -10.114  -0.593  -9.915
  866   2HG   PRO 138          2HG       PRO 138  -8.948  -1.791  -9.273
  867   1HD   PRO 138          1HD       PRO 138  -8.245   0.804  -9.900
  868   2HD   PRO 138          2HD       PRO 138  -7.116  -0.580 -10.057
  869    H    HIS 139           H        HIS 139  -9.546   1.689 -12.236
  870    HA   HIS 139           HA       HIS 139 -12.409   1.621 -12.238
  871   1HB   HIS 139          1HB       HIS 139 -10.990   3.456 -11.295
  872   2HB   HIS 139          2HB       HIS 139 -10.573   3.950 -12.939
  873    HD2  HIS 139           HD2      HIS 139 -12.239   5.583 -14.125
  874    HE1  HIS 139           HE1      HIS 139 -15.594   5.211 -11.516
  875    HE2  HIS 139           HE2      HIS 139 -14.668   6.431 -13.552
  876    H    GLU 140           H        GLU 140 -13.947   2.079 -13.810
  877    HA   GLU 140           HA       GLU 140 -13.348   1.256 -16.503
  878   1HB   GLU 140          1HB       GLU 140 -15.797   2.630 -15.296
  879   2HB   GLU 140          2HB       GLU 140 -15.706   2.008 -16.951
  880   1HG   GLU 140          1HG       GLU 140 -15.230  -0.269 -16.061
  881   2HG   GLU 140          2HG       GLU 140 -15.398   0.345 -14.415
  882    H    GLY 141           H        GLY 141 -12.231   2.427 -17.958
  883   1HA   GLY 141          1HA       GLY 141 -12.189   4.268 -19.517
  884   2HA   GLY 141          2HA       GLY 141 -12.941   5.309 -18.296
  885    H    CYS 142           H        CYS 142 -10.621   3.565 -16.654
  886    HA   CYS 142           HA       CYS 142  -8.582   5.729 -16.998
  887   1HB   CYS 142          1HB       CYS 142  -9.756   5.262 -14.731
  888   2HB   CYS 142          2HB       CYS 142  -8.790   3.791 -14.668
  889    H    ASP 143           H        ASP 143  -6.304   5.099 -16.888
  890    HA   ASP 143           HA       ASP 143  -5.669   2.260 -17.508
  891   1HB   ASP 143          1HB       ASP 143  -6.268   3.490 -19.660
  892   2HB   ASP 143          2HB       ASP 143  -4.887   4.544 -19.371
  893    H    LYS 144           H        LYS 144  -5.030   4.709 -15.530
  894    HA   LYS 144           HA       LYS 144  -2.174   5.156 -15.766
  895   1HB   LYS 144          1HB       LYS 144  -3.920   5.310 -13.280
  896   2HB   LYS 144          2HB       LYS 144  -2.344   6.060 -13.506
  897   1HG   LYS 144          1HG       LYS 144  -4.876   6.832 -15.002
  898   2HG   LYS 144          2HG       LYS 144  -4.233   7.632 -13.571
  899   1HD   LYS 144          1HD       LYS 144  -2.177   8.224 -14.883
  900   2HD   LYS 144          2HD       LYS 144  -2.976   7.543 -16.333
  901   1HE   LYS 144          1HE       LYS 144  -4.961   9.085 -15.779
  902   2HE   LYS 144          2HE       LYS 144  -3.938   9.835 -14.556
  903   1HZ   LYS 144          1HZ       LYS 144  -2.358  10.340 -16.433
  904   2HZ   LYS 144          2HZ       LYS 144  -3.513   9.861 -17.487
  905   3HZ   LYS 144          3HZ       LYS 144  -3.785  11.144 -16.497
  906    H    ARG 145           H        ARG 145  -0.443   4.196 -14.664
  907    HA   ARG 145           HA       ARG 145  -1.024   1.778 -12.992
  908   1HB   ARG 145          1HB       ARG 145   1.307   1.788 -14.907
  909   2HB   ARG 145          2HB       ARG 145   0.486   0.441 -14.070
  910   1HG   ARG 145          1HG       ARG 145  -1.426   0.640 -15.623
  911   2HG   ARG 145          2HG       ARG 145  -0.624   1.993 -16.441
  912   1HD   ARG 145          1HD       ARG 145  -0.214   0.061 -17.776
  913   2HD   ARG 145          2HD       ARG 145   1.300   0.514 -17.008
  914    HE   ARG 145           HE       ARG 145   1.251  -1.459 -15.692
  915   1HH1  ARG 145          1HH1      ARG 145  -1.797  -1.309 -17.491
  916   2HH1  ARG 145          2HH1      ARG 145  -2.265  -2.870 -16.805
  917   1HH2  ARG 145          1HH2      ARG 145   0.543  -3.400 -15.041
  918   2HH2  ARG 145          2HH2      ARG 145  -1.084  -3.935 -15.521
  919    H    PHE 146           H        PHE 146   0.526   1.293 -11.435
  920    HA   PHE 146           HA       PHE 146   2.408   3.537 -10.813
  921   1HB   PHE 146          1HB       PHE 146   0.527   2.125  -8.854
  922   2HB   PHE 146          2HB       PHE 146   1.594   3.458  -8.491
  923    HD1  PHE 146           HD1      PHE 146  -1.580   2.499 -10.107
  924    HD2  PHE 146           HD2      PHE 146   1.214   5.729  -9.459
  925    HE1  PHE 146           HE1      PHE 146  -3.255   4.091 -10.898
  926    HE2  PHE 146           HE2      PHE 146  -0.448   7.329 -10.388
  927    HZ   PHE 146           HZ       PHE 146  -2.643   6.508 -11.175
  928    H    SER 147           H        SER 147   4.033   3.040  -9.205
  929    HA   SER 147           HA       SER 147   5.214   0.426  -9.815
  930   1HB   SER 147          1HB       SER 147   7.155   1.452  -8.465
  931   2HB   SER 147          2HB       SER 147   6.660   2.340  -9.925
  932    HG   SER 147           HG       SER 147   6.944   3.712  -8.101
  933    H    LEU 148           H        LEU 148   3.397   1.845  -7.197
  934    HA   LEU 148           HA       LEU 148   3.810  -0.628  -5.616
  935   1HB   LEU 148          1HB       LEU 148   4.411   2.198  -4.707
  936   2HB   LEU 148          2HB       LEU 148   3.826   1.028  -3.537
  937    HG   LEU 148           HG       LEU 148   6.322   0.572  -5.211
  938   1HD1  LEU 148          1HD1      LEU 148   7.556   1.062  -3.146
  939   2HD1  LEU 148          2HD1      LEU 148   6.643   2.476  -3.703
  940   3HD1  LEU 148          3HD1      LEU 148   6.042   1.516  -2.334
  941   1HD2  LEU 148          1HD2      LEU 148   5.171  -1.477  -4.326
  942   2HD2  LEU 148          2HD2      LEU 148   6.776  -1.236  -3.593
  943   3HD2  LEU 148          3HD2      LEU 148   5.320  -0.827  -2.680
  944    HA   PRO 149           HA       PRO 149  -0.541  -0.409  -5.054
  945   1HB   PRO 149          1HB       PRO 149  -0.832  -1.454  -2.477
  946   2HB   PRO 149          2HB       PRO 149  -0.505  -2.403  -3.942
  947   1HG   PRO 149          1HG       PRO 149   1.455  -1.495  -1.836
  948   2HG   PRO 149          2HG       PRO 149   1.343  -3.081  -2.692
  949   1HD   PRO 149          1HD       PRO 149   3.177  -1.226  -3.468
  950   2HD   PRO 149          2HD       PRO 149   2.328  -2.236  -4.595
  951    H    SER 150           H        SER 150   1.553   1.116  -2.652
  952    HA   SER 150           HA       SER 150  -0.448   2.632  -1.244
  953   1HB   SER 150          1HB       SER 150   1.607   4.139  -0.759
  954   2HB   SER 150          2HB       SER 150   1.658   2.457  -0.190
  955    HG   SER 150           HG       SER 150   3.425   3.612  -1.695
  956    H    ARG 151           H        ARG 151   1.515   3.288  -4.186
  957    HA   ARG 151           HA       ARG 151   0.547   6.026  -4.470
  958   1HB   ARG 151          1HB       ARG 151   2.268   4.151  -6.081
  959   2HB   ARG 151          2HB       ARG 151   1.446   5.432  -6.951
  960   1HG   ARG 151          1HG       ARG 151   3.463   5.752  -4.724
  961   2HG   ARG 151          2HG       ARG 151   3.585   6.261  -6.400
  962   1HD   ARG 151          1HD       ARG 151   2.100   7.547  -4.119
  963   2HD   ARG 151          2HD       ARG 151   3.256   8.266  -5.236
  964    HE   ARG 151           HE       ARG 151   1.095   7.585  -6.847
  965   1HH1  ARG 151          1HH1      ARG 151   1.438   9.840  -4.121
  966   2HH1  ARG 151          2HH1      ARG 151  -0.126  10.547  -4.512
  967   1HH2  ARG 151          1HH2      ARG 151  -0.886   8.653  -7.139
  968   2HH2  ARG 151          2HH2      ARG 151  -1.262   9.979  -6.029
  969    H    LEU 152           H        LEU 152  -0.414   2.824  -5.736
  970    HA   LEU 152           HA       LEU 152  -2.462   3.798  -7.542
  971   1HB   LEU 152          1HB       LEU 152  -1.595   1.527  -7.683
  972   2HB   LEU 152          2HB       LEU 152  -2.079   1.196  -6.014
  973    HG   LEU 152           HG       LEU 152  -4.411   1.201  -6.578
  974   1HD1  LEU 152          1HD1      LEU 152  -4.441   2.994  -8.364
  975   2HD1  LEU 152          2HD1      LEU 152  -3.650   1.843  -9.459
  976   3HD1  LEU 152          3HD1      LEU 152  -5.272   1.518  -8.813
  977   1HD2  LEU 152          1HD2      LEU 152  -2.997  -0.860  -7.045
  978   2HD2  LEU 152          2HD2      LEU 152  -4.483  -0.747  -8.018
  979   3HD2  LEU 152          3HD2      LEU 152  -2.917  -0.336  -8.737
  980    H    LYS 153           H        LYS 153  -2.457   2.710  -4.085
  981    HA   LYS 153           HA       LYS 153  -5.184   3.074  -3.474
  982   1HB   LYS 153          1HB       LYS 153  -3.863   2.080  -1.798
  983   2HB   LYS 153          2HB       LYS 153  -2.628   3.307  -1.901
  984   1HG   LYS 153          1HG       LYS 153  -4.205   4.938  -0.772
  985   2HG   LYS 153          2HG       LYS 153  -5.296   3.567  -0.489
  986   1HD   LYS 153          1HD       LYS 153  -3.525   2.423   0.780
  987   2HD   LYS 153          2HD       LYS 153  -2.359   3.689   0.383
  988   1HE   LYS 153          1HE       LYS 153  -4.882   4.096   2.046
  989   2HE   LYS 153          2HE       LYS 153  -3.260   3.843   2.696
  990   1HZ   LYS 153          1HZ       LYS 153  -2.555   5.912   1.524
  991   2HZ   LYS 153          2HZ       LYS 153  -4.100   6.162   1.047
  992   3HZ   LYS 153          3HZ       LYS 153  -3.722   6.183   2.632
  993    H    ARG 154           H        ARG 154  -2.531   5.520  -3.391
  994    HA   ARG 154           HA       ARG 154  -4.217   7.725  -2.603
  995   1HB   ARG 154          1HB       ARG 154  -1.507   7.468  -3.937
  996   2HB   ARG 154          2HB       ARG 154  -2.269   9.043  -3.815
  997   1HG   ARG 154          1HG       ARG 154  -2.297   7.523  -1.261
  998   2HG   ARG 154          2HG       ARG 154  -0.685   7.856  -1.874
  999   1HD   ARG 154          1HD       ARG 154  -1.522   9.573  -0.275
 1000   2HD   ARG 154          2HD       ARG 154  -1.023  10.227  -1.837
 1001    HE   ARG 154           HE       ARG 154  -3.545  10.142  -2.400
 1002   1HH1  ARG 154          1HH1      ARG 154  -2.155  11.443   0.566
 1003   2HH1  ARG 154          2HH1      ARG 154  -3.486  12.575   0.666
 1004   1HH2  ARG 154          1HH2      ARG 154  -4.917  11.655  -2.204
 1005   2HH2  ARG 154          2HH2      ARG 154  -5.004  12.675  -0.779
 1006    H    HIS 155           H        HIS 155  -3.248   6.430  -5.813
 1007    HA   HIS 155           HA       HIS 155  -4.478   8.464  -7.391
 1008   1HB   HIS 155          1HB       HIS 155  -2.906   6.867  -8.345
 1009   2HB   HIS 155          2HB       HIS 155  -4.003   5.514  -8.023
 1010    HD1  HIS 155           HD1      HIS 155  -3.962   8.749 -10.142
 1011    HD2  HIS 155           HD2      HIS 155  -5.967   5.072  -9.707
 1012    HE1  HIS 155           HE1      HIS 155  -5.826   8.777 -11.860
 1013    H    GLU 156           H        GLU 156  -5.809   5.374  -6.067
 1014    HA   GLU 156           HA       GLU 156  -8.318   5.445  -7.317
 1015   1HB   GLU 156          1HB       GLU 156  -7.428   4.386  -4.601
 1016   2HB   GLU 156          2HB       GLU 156  -9.098   4.262  -5.141
 1017   1HG   GLU 156          1HG       GLU 156  -8.381   3.069  -7.186
 1018   2HG   GLU 156          2HG       GLU 156  -6.710   3.109  -6.635
 1019    H    LYS 157           H        LYS 157  -7.130   7.382  -4.579
 1020    HA   LYS 157           HA       LYS 157  -9.650   8.311  -3.567
 1021   1HB   LYS 157          1HB       LYS 157  -7.267   8.571  -2.556
 1022   2HB   LYS 157          2HB       LYS 157  -7.090   9.937  -3.658
 1023   1HG   LYS 157          1HG       LYS 157  -7.743  10.863  -1.597
 1024   2HG   LYS 157          2HG       LYS 157  -9.184  10.941  -2.606
 1025   1HD   LYS 157          1HD       LYS 157 -10.002   8.806  -1.447
 1026   2HD   LYS 157          2HD       LYS 157  -8.561   8.899  -0.431
 1027   1HE   LYS 157          1HE       LYS 157 -10.184   9.904   0.895
 1028   2HE   LYS 157          2HE       LYS 157  -9.334  11.281   0.193
 1029   1HZ   LYS 157          1HZ       LYS 157 -11.933  10.173  -0.746
 1030   2HZ   LYS 157          2HZ       LYS 157 -11.733  11.569   0.064
 1031   3HZ   LYS 157          3HZ       LYS 157 -11.183  11.431  -1.467
 1032    H    VAL 158           H        VAL 158  -7.785   9.157  -6.459
 1033    HA   VAL 158           HA       VAL 158  -9.006  11.680  -7.068
 1034    HB   VAL 158           HB       VAL 158  -8.044   9.555  -9.061
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.135  12.573  -9.257
 1036   2HG1  VAL 158          2HG1      VAL 158  -7.573  11.448 -10.513
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.293  11.476 -10.079
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.614  11.906  -7.805
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.180  10.226  -7.459
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.914  10.897  -9.093
 1041    H    HIS 159           H        HIS 159  -9.985   8.302  -7.803
 1042    HA   HIS 159           HA       HIS 159 -12.354   9.133  -9.300
 1043   1HB   HIS 159          1HB       HIS 159 -11.411   6.444  -8.206
 1044   2HB   HIS 159          2HB       HIS 159 -12.896   6.663  -9.152
 1045    HD1  HIS 159           HD1      HIS 159 -12.217   8.240 -11.594
 1046    HD2  HIS 159           HD2      HIS 159  -9.363   5.809  -9.685
 1047    HE1  HIS 159           HE1      HIS 159 -10.326   7.882 -13.273
 1048    H    ALA 160           H        ALA 160 -11.592   8.259  -5.936
 1049    HA   ALA 160           HA       ALA 160 -14.348   8.042  -5.048
 1050   1HB   ALA 160          1HB       ALA 160 -13.388   8.134  -2.804
 1051   2HB   ALA 160          2HB       ALA 160 -12.384   7.079  -3.817
 1052   3HB   ALA 160          3HB       ALA 160 -11.848   8.736  -3.438
 1053    H    GLY 161           H        GLY 161 -12.053  10.710  -5.536
 1054   1HA   GLY 161          1HA       GLY 161 -12.639  12.964  -5.854
 1055   2HA   GLY 161          2HA       GLY 161 -14.241  12.640  -5.223
 1056    H    TYR 162           H        TYR 162 -13.230  14.907  -4.403
 1057    HA   TYR 162           HA       TYR 162 -12.235  14.372  -1.628
 1058   1HB   TYR 162          1HB       TYR 162 -11.564  16.671  -3.496
 1059   2HB   TYR 162          2HB       TYR 162 -11.062  16.573  -1.792
 1060    HD1  TYR 162           HD1      TYR 162 -10.739  15.094  -5.192
 1061    HD2  TYR 162           HD2      TYR 162  -9.308  14.996  -1.115
 1062    HE1  TYR 162           HE1      TYR 162  -9.076  13.406  -5.822
 1063    HE2  TYR 162           HE2      TYR 162  -7.439  13.506  -1.821
 1064    HH   TYR 162           HH       TYR 162  -6.878  12.613  -5.193
 1065    HA   PRO 163           HA       PRO 163 -16.258  16.402  -1.346
 1066   1HB   PRO 163          1HB       PRO 163 -17.169  15.193   0.938
 1067   2HB   PRO 163          2HB       PRO 163 -17.079  14.330  -0.624
 1068   1HG   PRO 163          1HG       PRO 163 -15.078  14.246   1.650
 1069   2HG   PRO 163          2HG       PRO 163 -15.786  12.873   0.738
 1070   1HD   PRO 163          1HD       PRO 163 -13.341  13.962   0.143
 1071   2HD   PRO 163          2HD       PRO 163 -14.418  13.281  -1.122
 1072    H    CYS 164           H        CYS 164 -16.939  18.222  -0.294
 1073    HA   CYS 164           HA       CYS 164 -15.049  19.583   1.431
 1074   1HB   CYS 164          1HB       CYS 164 -16.768  20.529  -0.328
 1075   2HB   CYS 164          2HB       CYS 164 -17.916  20.473   1.033
 1076    H    LYS 165           H        LYS 165 -15.148  20.050   3.564
 1077    HA   LYS 165           HA       LYS 165 -17.509  19.231   5.151
 1078   1HB   LYS 165          1HB       LYS 165 -16.161  18.067   6.827
 1079   2HB   LYS 165          2HB       LYS 165 -16.002  17.276   5.265
 1080   1HG   LYS 165          1HG       LYS 165 -13.799  18.373   4.908
 1081   2HG   LYS 165          2HG       LYS 165 -13.922  19.160   6.480
 1082   1HD   LYS 165          1HD       LYS 165 -13.800  16.164   5.952
 1083   2HD   LYS 165          2HD       LYS 165 -12.481  17.161   6.556
 1084   1HE   LYS 165          1HE       LYS 165 -15.105  16.595   8.015
 1085   2HE   LYS 165          2HE       LYS 165 -13.559  15.810   8.325
 1086   1HZ   LYS 165          1HZ       LYS 165 -13.926  17.595   9.898
 1087   2HZ   LYS 165          2HZ       LYS 165 -12.651  17.985   8.959
 1088   3HZ   LYS 165          3HZ       LYS 165 -14.102  18.706   8.721
 1089    H    LYS 166           H        LYS 166 -15.728  21.660   4.162
 1090    HA   LYS 166           HA       LYS 166 -14.744  22.925   6.590
 1091   1HB   LYS 166          1HB       LYS 166 -15.560  23.997   3.878
 1092   2HB   LYS 166          2HB       LYS 166 -14.862  25.021   5.131
 1093   1HG   LYS 166          1HG       LYS 166 -13.435  22.565   4.020
 1094   2HG   LYS 166          2HG       LYS 166 -13.285  24.188   3.334
 1095   1HD   LYS 166          1HD       LYS 166 -12.355  25.081   5.361
 1096   2HD   LYS 166          2HD       LYS 166 -12.608  23.547   6.231
 1097   1HE   LYS 166          1HE       LYS 166 -11.059  22.400   4.689
 1098   2HE   LYS 166          2HE       LYS 166 -10.832  23.899   3.779
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.086  23.513   6.630
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.040  23.539   5.379
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.862  24.892   5.783
 1102    H    ASP 167           H        ASP 167 -17.921  22.556   5.165
 1103    HA   ASP 167           HA       ASP 167 -19.102  23.952   7.486
 1104   1HB   ASP 167          1HB       ASP 167 -18.800  25.692   5.643
 1105   2HB   ASP 167          2HB       ASP 167 -19.911  24.749   4.653
 1106    H    ASP 168           H        ASP 168 -21.143  23.171   8.033
 1107    HA   ASP 168           HA       ASP 168 -21.754  20.529   7.192
 1108   1HB   ASP 168          1HB       ASP 168 -23.444  22.576   8.692
 1109   2HB   ASP 168          2HB       ASP 168 -23.863  20.873   8.523
 1110    H    SER 169           H        SER 169 -22.874  23.654   5.960
 1111    HA   SER 169           HA       SER 169 -25.071  22.364   4.412
 1112   1HB   SER 169          1HB       SER 169 -24.279  25.299   4.715
 1113   2HB   SER 169          2HB       SER 169 -25.703  24.698   3.853
 1114    HG   SER 169           HG       SER 169 -26.175  25.354   6.013
 1115    H    CYS 170           H        CYS 170 -22.043  22.088   3.858
 1116    HA   CYS 170           HA       CYS 170 -22.139  22.958   0.997
 1117   1HB   CYS 170          1HB       CYS 170 -20.348  23.988   2.503
 1118   2HB   CYS 170          2HB       CYS 170 -19.676  22.374   2.660
 1119    H    SER 171           H        SER 171 -21.983  21.356  -0.524
 1120    HA   SER 171           HA       SER 171 -21.381  18.566   0.415
 1121   1HB   SER 171          1HB       SER 171 -23.678  19.432  -1.395
 1122   2HB   SER 171          2HB       SER 171 -23.300  17.769  -0.917
 1123    HG   SER 171           HG       SER 171 -24.967  18.685   0.363
 1124    H    PHE 172           H        PHE 172 -20.000  20.780  -1.339
 1125    HA   PHE 172           HA       PHE 172 -19.840  19.782  -4.026
 1126   1HB   PHE 172          1HB       PHE 172 -19.053  21.987  -3.604
 1127   2HB   PHE 172          2HB       PHE 172 -18.058  21.474  -2.258
 1128    HD1  PHE 172           HD1      PHE 172 -15.911  20.325  -2.560
 1129    HD2  PHE 172           HD2      PHE 172 -18.188  21.698  -5.943
 1130    HE1  PHE 172           HE1      PHE 172 -13.943  19.983  -4.016
 1131    HE2  PHE 172           HE2      PHE 172 -16.150  21.540  -7.372
 1132    HZ   PHE 172           HZ       PHE 172 -14.010  20.726  -6.393
 1133    H    VAL 173           H        VAL 173 -18.503  18.283  -4.998
 1134    HA   VAL 173           HA       VAL 173 -16.403  16.991  -3.311
 1135    HB   VAL 173           HB       VAL 173 -18.191  15.551  -5.305
 1136   1HG1  VAL 173          1HG1      VAL 173 -15.842  14.591  -5.198
 1137   2HG1  VAL 173          2HG1      VAL 173 -15.992  14.497  -3.433
 1138   3HG1  VAL 173          3HG1      VAL 173 -17.018  13.498  -4.476
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.136  15.591  -2.261
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.500  15.905  -3.336
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.881  14.257  -3.189
 1142    H    GLY 174           H        GLY 174 -14.461  17.317  -4.144
 1143   1HA   GLY 174          1HA       GLY 174 -14.220  18.351  -6.887
 1144   2HA   GLY 174          2HA       GLY 174 -12.914  18.153  -5.704
 1145    H    LYS 175           H        LYS 175 -13.728  17.249  -8.696
 1146    HA   LYS 175           HA       LYS 175 -13.398  14.423  -8.766
 1147   1HB   LYS 175          1HB       LYS 175 -14.103  16.037 -10.638
 1148   2HB   LYS 175          2HB       LYS 175 -12.382  16.353 -10.897
 1149   1HG   LYS 175          1HG       LYS 175 -12.020  13.956 -11.410
 1150   2HG   LYS 175          2HG       LYS 175 -13.728  13.622 -11.063
 1151   1HD   LYS 175          1HD       LYS 175 -14.386  15.136 -12.938
 1152   2HD   LYS 175          2HD       LYS 175 -12.682  15.496 -13.233
 1153   1HE   LYS 175          1HE       LYS 175 -13.318  13.896 -14.868
 1154   2HE   LYS 175          2HE       LYS 175 -12.272  13.068 -13.714
 1155   1HZ   LYS 175          1HZ       LYS 175 -15.248  12.924 -13.737
 1156   2HZ   LYS 175          2HZ       LYS 175 -14.250  11.750 -14.266
 1157   3HZ   LYS 175          3HZ       LYS 175 -14.284  12.131 -12.679
 1158    H    THR 176           H        THR 176 -11.097  16.906  -8.009
 1159    HA   THR 176           HA       THR 176  -8.997  14.868  -7.675
 1160    HB   THR 176           HB       THR 176  -7.417  16.839  -8.705
 1161    HG1  THR 176           HG1      THR 176  -8.593  18.088  -9.842
 1162   1HG2  THR 176          1HG2      THR 176  -7.219  15.447 -10.738
 1163   2HG2  THR 176          2HG2      THR 176  -7.171  14.495  -9.238
 1164   3HG2  THR 176          3HG2      THR 176  -8.642  14.542 -10.255
 1165    H    TRP 177           H        TRP 177  -7.182  15.678  -6.385
 1166    HA   TRP 177           HA       TRP 177  -8.102  16.962  -4.070
 1167   1HB   TRP 177          1HB       TRP 177  -6.195  15.527  -4.020
 1168   2HB   TRP 177          2HB       TRP 177  -5.328  16.493  -5.188
 1169    HD1  TRP 177           HD1      TRP 177  -3.383  17.436  -4.161
 1170    HE1  TRP 177           HE1      TRP 177  -2.728  18.673  -1.990
 1171    HE3  TRP 177           HE3      TRP 177  -7.737  16.835  -1.604
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.674  18.509   0.729
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.754  17.162   0.856
 1174    HH2  TRP 177           HH2      TRP 177  -5.715  17.931   2.035
 1175    H    THR 178           H        THR 178  -6.295  18.381  -6.851
 1176    HA   THR 178           HA       THR 178  -5.875  20.982  -5.807
 1177    HB   THR 178           HB       THR 178  -6.126  21.711  -8.249
 1178    HG1  THR 178           HG1      THR 178  -5.884  19.126  -9.111
 1179   1HG2  THR 178          1HG2      THR 178  -3.930  21.234  -7.314
 1180   2HG2  THR 178          2HG2      THR 178  -4.096  19.527  -7.762
 1181   3HG2  THR 178          3HG2      THR 178  -4.053  20.772  -9.020
 1182    H    LEU 179           H        LEU 179  -8.699  19.716  -7.659
 1183    HA   LEU 179           HA       LEU 179 -10.096  22.155  -7.804
 1184   1HB   LEU 179          1HB       LEU 179 -11.220  19.320  -7.672
 1185   2HB   LEU 179          2HB       LEU 179 -12.123  20.750  -8.168
 1186    HG   LEU 179           HG       LEU 179  -9.744  19.539  -9.595
 1187   1HD1  LEU 179          1HD1      LEU 179 -12.671  19.809 -10.395
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.376  19.050 -11.357
 1189   3HD1  LEU 179          3HD1      LEU 179 -11.870  18.325  -9.825
 1190   1HD2  LEU 179          1HD2      LEU 179 -11.368  22.015 -10.320
 1191   2HD2  LEU 179          2HD2      LEU 179  -9.626  21.950  -9.958
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.244  21.182 -11.418
 1193    H    TYR 180           H        TYR 180  -9.983  19.774  -5.159
 1194    HA   TYR 180           HA       TYR 180 -12.161  20.992  -3.644
 1195   1HB   TYR 180          1HB       TYR 180 -11.740  18.783  -3.090
 1196   2HB   TYR 180          2HB       TYR 180  -9.986  18.972  -3.057
 1197    HD1  TYR 180           HD1      TYR 180  -8.928  19.084  -0.968
 1198    HD2  TYR 180           HD2      TYR 180 -13.048  20.329  -1.298
 1199    HE1  TYR 180           HE1      TYR 180  -8.994  19.529   1.484
 1200    HE2  TYR 180           HE2      TYR 180 -13.072  20.872   1.124
 1201    HH   TYR 180           HH       TYR 180 -11.949  20.748   3.105
 1202    H    LEU 181           H        LEU 181  -8.563  21.063  -3.436
 1203    HA   LEU 181           HA       LEU 181  -8.386  22.915  -1.318
 1204   1HB   LEU 181          1HB       LEU 181  -6.579  22.369  -3.710
 1205   2HB   LEU 181          2HB       LEU 181  -6.159  23.511  -2.469
 1206    HG   LEU 181           HG       LEU 181  -6.658  20.503  -2.080
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.156  20.652  -1.450
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.578  20.686  -3.161
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.155  22.196  -2.299
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.954  22.630  -0.052
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.304  21.487  -0.021
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.670  20.881   0.234
 1213    H    LYS 182           H        LYS 182  -8.640  23.547  -4.855
 1214    HA   LYS 182           HA       LYS 182  -8.460  26.439  -4.627
 1215   1HB   LYS 182          1HB       LYS 182  -9.505  24.594  -6.835
 1216   2HB   LYS 182          2HB       LYS 182  -9.498  26.362  -6.952
 1217   1HG   LYS 182          1HG       LYS 182  -6.972  26.162  -6.231
 1218   2HG   LYS 182          2HG       LYS 182  -7.103  24.504  -6.791
 1219   1HD   LYS 182          1HD       LYS 182  -7.683  27.006  -8.429
 1220   2HD   LYS 182          2HD       LYS 182  -6.172  26.101  -8.443
 1221   1HE   LYS 182          1HE       LYS 182  -7.373  24.103  -9.327
 1222   2HE   LYS 182          2HE       LYS 182  -8.876  25.044  -9.365
 1223   1HZ   LYS 182          1HZ       LYS 182  -7.796  26.603 -10.883
 1224   2HZ   LYS 182          2HZ       LYS 182  -6.404  25.758 -10.849
 1225   3HZ   LYS 182          3HZ       LYS 182  -7.703  25.102 -11.557
 1226    H    HIS 183           H        HIS 183 -11.193  24.109  -4.640
 1227    HA   HIS 183           HA       HIS 183 -13.319  26.031  -4.653
 1228   1HB   HIS 183          1HB       HIS 183 -13.872  23.743  -5.037
 1229   2HB   HIS 183          2HB       HIS 183 -13.063  23.192  -3.586
 1230    HD1  HIS 183           HD1      HIS 183 -16.396  24.808  -4.587
 1231    HD2  HIS 183           HD2      HIS 183 -14.307  23.363  -1.233
 1232    HE1  HIS 183           HE1      HIS 183 -18.069  24.755  -2.658
 1233    H    VAL 184           H        VAL 184 -11.372  24.601  -1.990
 1234    HA   VAL 184           HA       VAL 184 -12.820  25.757   0.184
 1235    HB   VAL 184           HB       VAL 184  -9.981  24.756  -0.155
 1236   1HG1  VAL 184          1HG1      VAL 184 -11.131  25.886   2.420
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.608  24.969   2.244
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.756  26.562   1.500
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.516  23.855   1.266
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.619  23.043  -0.037
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.899  23.102   1.548
 1242    H    ALA 185           H        ALA 185  -9.988  26.945  -1.660
 1243    HA   ALA 185           HA       ALA 185  -9.556  29.242  -0.060
 1244   1HB   ALA 185          1HB       ALA 185  -7.902  28.325  -1.666
 1245   2HB   ALA 185          2HB       ALA 185  -8.944  28.810  -3.025
 1246   3HB   ALA 185          3HB       ALA 185  -8.218  30.046  -1.976
 1247    H    GLU 186           H        GLU 186 -11.799  28.653  -2.762
 1248    HA   GLU 186           HA       GLU 186 -12.453  31.515  -3.056
 1249   1HB   GLU 186          1HB       GLU 186 -12.284  29.847  -4.971
 1250   2HB   GLU 186          2HB       GLU 186 -13.751  29.091  -4.364
 1251   1HG   GLU 186          1HG       GLU 186 -14.354  30.524  -6.176
 1252   2HG   GLU 186          2HG       GLU 186 -14.965  31.276  -4.716
 1253    H    CYS 187           H        CYS 187 -13.951  28.553  -1.703
 1254    HA   CYS 187           HA       CYS 187 -16.506  30.000  -1.261
 1255   1HB   CYS 187          1HB       CYS 187 -16.234  27.656  -2.350
 1256   2HB   CYS 187          2HB       CYS 187 -15.966  27.061  -0.707
 1257    HG   CYS 187           HG       CYS 187 -18.395  26.514  -1.145
 1258    H    HIS 188           H        HIS 188 -13.750  28.853   0.604
 1259    HA   HIS 188           HA       HIS 188 -15.214  29.510   3.137
 1260   1HB   HIS 188          1HB       HIS 188 -13.265  27.190   2.763
 1261   2HB   HIS 188          2HB       HIS 188 -14.107  27.626   4.259
 1262    HD1  HIS 188           HD1      HIS 188 -16.973  27.434   3.998
 1263    HD2  HIS 188           HD2      HIS 188 -14.455  25.531   1.221
 1264    HE1  HIS 188           HE1      HIS 188 -18.415  25.693   2.800
 1265    H    GLN 189           H        GLN 189 -13.503  31.239   1.559
 1266    HA   GLN 189           HA       GLN 189 -10.853  31.430   2.709
 1267   1HB   GLN 189          1HB       GLN 189 -11.320  33.975   1.977
 1268   2HB   GLN 189          2HB       GLN 189 -10.884  32.721   0.864
 1269   1HG   GLN 189          1HG       GLN 189 -12.623  34.123  -0.068
 1270   2HG   GLN 189          2HG       GLN 189 -13.213  32.481   0.109
 1271   1HE2  GLN 189          1HE2      GLN 189 -13.466  35.811   1.404
 1272   2HE2  GLN 189          2HE2      GLN 189 -14.979  35.506   2.248
 1273    H    ASP 190           H        ASP 190 -14.064  32.351   3.825
 1274    HA   ASP 190           HA       ASP 190 -12.905  33.242   6.407
 1275   1HB   ASP 190          1HB       ASP 190 -13.150  35.311   5.008
 1276   2HB   ASP 190          2HB       ASP 190 -14.866  34.957   4.812
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -6.274  31.353 -13.047
    2   2H5*    G   1          2H5*        G   1  -7.226  29.872 -12.864
    3    H4*    G   1           H4*        G   1  -6.538  30.159 -15.177
    4    H3*    G   1           H3*        G   1  -5.124  27.892 -13.758
    5    H2*    G   1           H2*        G   1  -4.256  27.269 -15.936
    6   2HO*    G   1          2HO*        G   1  -6.313  28.057 -17.057
    7    H1*    G   1           H1*        G   1  -3.433  29.773 -16.518
    8    H8     G   1           H8         G   1  -2.998  29.862 -12.804
    9    H1     G   1           H1         G   1   1.642  26.659 -15.879
   10   1H2     G   1          1H2         G   1   0.945  25.999 -17.830
   11   2H2     G   1          2H2         G   1  -0.566  26.585 -18.502
   12   1H5*    G   2          1H5*        G   2  -6.623  26.027 -17.177
   13   2H5*    G   2          2H5*        G   2  -7.415  24.503 -16.762
   14    H4*    G   2           H4*        G   2  -5.711  24.157 -18.467
   15    H3*    G   2           H3*        G   2  -4.987  22.980 -15.773
   16    H2*    G   2           H2*        G   2  -3.174  21.873 -16.955
   17   2HO*    G   2          2HO*        G   2  -4.540  21.656 -19.003
   18    H1*    G   2           H1*        G   2  -2.393  24.149 -18.218
   19    H8     G   2           H8         G   2  -3.665  25.437 -14.902
   20    H1     G   2           H1         G   2   2.128  22.668 -14.539
   21   1H2     G   2          1H2         G   2   2.442  21.381 -16.248
   22   2H2     G   2          2H2         G   2   1.336  21.359 -17.608
   23   1H5*    G   3          1H5*        G   3  -4.581  19.730 -18.310
   24   2H5*    G   3          2H5*        G   3  -5.390  18.301 -17.654
   25    H4*    G   3           H4*        G   3  -3.066  17.808 -18.192
   26    H3*    G   3           H3*        G   3  -3.658  17.882 -15.217
   27    H2*    G   3           H2*        G   3  -1.468  16.902 -14.948
   28   2HO*    G   3          2HO*        G   3  -1.719  15.578 -16.998
   29    H1*    G   3           H1*        G   3  -0.285  18.605 -16.738
   30    H8     G   3           H8         G   3  -2.901  20.669 -14.897
   31    H1     G   3           H1         G   3   2.616  19.864 -11.679
   32   1H2     G   3          1H2         G   3   3.696  18.176 -12.474
   33   2H2     G   3          2H2         G   3   3.195  17.364 -13.945
   34   1H5*    C   4          1H5*        C   4  -2.188  13.976 -15.663
   35   2H5*    C   4          2H5*        C   4  -3.127  12.816 -14.717
   36    H4*    C   4           H4*        C   4  -0.752  12.775 -14.088
   37    H3*    C   4           H3*        C   4  -2.598  13.824 -11.929
   38    H2*    C   4           H2*        C   4  -0.686  14.065 -10.523
   39   2HO*    C   4          2HO*        C   4   0.179  11.908 -11.432
   40    H1*    C   4           H1*        C   4   1.086  14.890 -12.499
   41   1H4     C   4          1H4         C   4  -0.966  19.861  -9.059
   42   2H4     C   4          2H4         C   4  -2.469  19.906  -9.950
   43    H5     C   4           H5         C   4  -3.029  18.322 -11.667
   44    H6     C   4           H6         C   4  -2.249  16.347 -12.872
   45   1H5*    C   5          1H5*        C   5  -1.302  12.458  -9.106
   46   2H5*    C   5          2H5*        C   5  -2.273  11.259  -8.277
   47    H4*    C   5           H4*        C   5  -1.721  13.222  -6.926
   48    H3*    C   5           H3*        C   5  -4.161  11.937  -6.785
   49    H2*    C   5           H2*        C   5  -5.251  13.488  -8.293
   50   2HO*    C   5          2HO*        C   5  -5.522  14.292  -5.599
   51    H1*    C   5           H1*        C   5  -3.959  15.781  -6.874
   52   1H4     C   5          1H4         C   5  -6.058  18.961 -11.920
   53   2H4     C   5          2H4         C   5  -5.717  17.621 -12.996
   54    H5     C   5           H5         C   5  -4.888  15.527 -12.219
   55    H6     C   5           H6         C   5  -4.281  14.224 -10.251
   56   1H5*    A   6          1H5*        A   6  -2.188  15.274  -4.526
   57   2H5*    A   6          2H5*        A   6  -0.800  14.180  -4.512
   58    H4*    A   6           H4*        A   6  -0.218  16.085  -3.396
   59    H3*    A   6           H3*        A   6  -0.581  13.794  -1.531
   60    H2*    A   6           H2*        A   6  -0.249  15.205   0.389
   61   2HO*    A   6          2HO*        A   6   1.454  16.528  -0.072
   62    H1*    A   6           H1*        A   6  -1.566  17.419  -0.479
   63    H8     A   6           H8         A   6  -4.060  15.277  -1.874
   64   1H6     A   6          1H6         A   6  -6.113  14.091   3.848
   65   2H6     A   6          2H6         A   6  -6.381  13.791   2.150
   66    H2     A   6           H2         A   6  -2.287  16.304   4.206
   67   1H5*    U   7          1H5*        U   7   3.050  13.113   0.867
   68   2H5*    U   7          2H5*        U   7   2.071  14.456   0.292
   69    H4*    U   7           H4*        U   7   3.838  15.259   1.707
   70    H3*    U   7           H3*        U   7   3.229  16.437  -0.732
   71    H2*    U   7           H2*        U   7   4.973  15.282  -1.885
   72   2HO*    U   7          2HO*        U   7   5.790  17.832  -0.994
   73    H1*    U   7           H1*        U   7   6.810  15.866   0.464
   74    H3     U   7           H3         U   7  10.341  13.996  -1.569
   75    H5     U   7           H5         U   7   7.441  10.986  -1.634
   76    H6     U   7           H6         U   7   5.770  12.645  -0.956
   77   1H5*    A   8          1H5*        A   8   4.117  20.178  -0.782
   78   2H5*    A   8          2H5*        A   8   3.400  20.995   0.612
   79    H4*    A   8           H4*        A   8   2.657  22.148  -1.277
   80    H3*    A   8           H3*        A   8   0.816  21.170   0.473
   81    H2*    A   8           H2*        A   8   0.401  19.217  -0.903
   82   2HO*    A   8          2HO*        A   8  -1.667  20.160  -0.374
   83    H1*    A   8           H1*        A   8   0.182  21.190  -3.168
   84    H8     A   8           H8         A   8   2.358  18.024  -3.103
   85   1H6     A   8          1H6         A   8  -1.355  16.071  -7.670
   86   2H6     A   8          2H6         A   8   0.195  15.852  -6.896
   87    H2     A   8           H2         A   8  -3.207  19.676  -5.847
   88   1H5*    C   9          1H5*        C   9  -2.437  22.577  -0.370
   89   2H5*    C   9          2H5*        C   9  -2.747  24.077   0.513
   90    H4*    C   9           H4*        C   9  -4.322  22.440   1.207
   91    H3*    C   9           H3*        C   9  -2.304  23.047   3.345
   92    H2*    C   9           H2*        C   9  -3.504  21.493   4.763
   93   2HO*    C   9          2HO*        C   9  -5.622  22.220   3.537
   94    H1*    C   9           H1*        C   9  -3.810  19.540   2.911
   95   1H4     C   9          1H4         C   9   1.848  18.417   5.705
   96   2H4     C   9          2H4         C   9   2.619  18.953   4.225
   97    H5     C   9           H5         C   9   1.438  20.120   2.506
   98    H6     C   9           H6         C   9  -0.756  20.860   1.752
   99   1H5*    C  10          1H5*        C  10  -5.748  23.002   5.386
  100   2H5*    C  10          2H5*        C  10  -6.015  24.388   6.439
  101    H4*    C  10           H4*        C  10  -6.076  22.278   7.701
  102    H3*    C  10           H3*        C  10  -3.685  24.045   8.323
  103    H2*    C  10           H2*        C  10  -3.244  22.523  10.127
  104   2HO*    C  10          2HO*        C  10  -5.598  22.186  10.603
  105    H1*    C  10           H1*        C  10  -3.657  20.263   8.597
  106   1H4     C  10          1H4         C  10   2.555  21.004   7.958
  107   2H4     C  10          2H4         C  10   2.290  21.798   6.422
  108    H5     C  10           H5         C  10   0.125  22.521   5.672
  109    H6     C  10           H6         C  10  -2.262  22.546   6.223
  110   1H5*    U  11          1H5*        U  11  -4.780  24.439  12.220
  111   2H5*    U  11          2H5*        U  11  -4.386  26.106  12.670
  112    H4*    U  11           H4*        U  11  -2.902  24.294  13.628
  113    H3*    U  11           H3*        U  11  -1.636  26.439  11.934
  114    H2*    U  11           H2*        U  11   0.462  25.602  12.732
  115   2HO*    U  11          2HO*        U  11  -0.545  25.150  14.960
  116    H1*    U  11           H1*        U  11  -0.260  22.957  12.441
  117    H3     U  11           H3         U  11   2.878  23.903   9.227
  118    H5     U  11           H5         U  11  -0.624  25.633   7.722
  119    H6     U  11           H6         U  11  -1.746  25.064   9.829
  120   1H5*    C  12          1H5*        C  12   0.614  27.379  15.656
  121   2H5*    C  12          2H5*        C  12   1.440  28.839  15.108
  122    H4*    C  12           H4*        C  12   2.093  25.933  14.675
  123    H3*    C  12           H3*        C  12   3.294  27.914  16.127
  124    H2*    C  12           H2*        C  12   3.612  29.349  14.227
  125   2HO*    C  12          2HO*        C  12   5.854  28.143  15.203
  126    H1*    C  12           H1*        C  12   4.702  26.939  12.735
  127   1H4     C  12          1H4         C  12   4.899  31.474   8.264
  128   2H4     C  12          2H4         C  12   3.233  31.911   8.551
  129    H5     C  12           H5         C  12   1.878  30.876  10.240
  130    H6     C  12           H6         C  12   1.853  29.191  12.022
  131   1H5*    U  13          1H5*        U  13   4.215  23.396  16.332
  132   2H5*    U  13          2H5*        U  13   4.968  23.312  17.927
  133    H4*    U  13           H4*        U  13   5.821  21.389  17.094
  134    H3*    U  13           H3*        U  13   7.836  23.287  17.076
  135    H2*    U  13           H2*        U  13   7.416  23.986  14.828
  136   2HO*    U  13          2HO*        U  13   9.461  22.038  14.958
  137    H1*    U  13           H1*        U  13   7.217  21.085  13.975
  138    H3     U  13           H3         U  13   6.709  22.569   9.720
  139    H5     U  13           H5         U  13   3.957  24.891  11.845
  140    H6     U  13           H6         U  13   4.809  23.905  13.927
  141   1H5*    U  14          1H5*        U  14   9.548  18.183  17.566
  142   2H5*    U  14          2H5*        U  14  11.273  18.536  17.433
  143    H4*    U  14           H4*        U  14   9.117  19.214  15.378
  144    H3*    U  14           H3*        U  14  11.515  17.324  15.432
  145    H2*    U  14           H2*        U  14  11.778  17.684  13.126
  146   2HO*    U  14          2HO*        U  14   9.380  17.484  12.781
  147    H1*    U  14           H1*        U  14  10.954  20.378  13.126
  148    H3     U  14           H3         U  14  15.264  20.518  11.613
  149    H5     U  14           H5         U  14  15.697  19.474  15.642
  150    H6     U  14           H6         U  14  13.249  19.348  15.820
  151   1H5*    G  15          1H5*        G  15   6.660  14.624  15.260
  152   2H5*    G  15          2H5*        G  15   7.061  16.113  14.404
  153    H4*    G  15           H4*        G  15   5.288  16.090  16.878
  154    H3*    G  15           H3*        G  15   4.658  15.695  13.939
  155    H2*    G  15           H2*        G  15   2.513  16.730  14.379
  156   2HO*    G  15          2HO*        G  15   2.414  15.816  16.657
  157    H1*    G  15           H1*        G  15   3.632  18.836  15.644
  158    H8     G  15           H8         G  15   6.433  18.210  13.292
  159    H1     G  15           H1         G  15   1.224  20.513  10.309
  160   1H2     G  15          1H2         G  15  -0.516  20.272  11.562
  161   2H2     G  15          2H2         G  15  -0.391  19.781  13.239
  162   1H5*    G  16          1H5*        G  16   1.046  14.451  15.642
  163   2H5*    G  16          2H5*        G  16   0.571  12.869  15.008
  164    H4*    G  16           H4*        G  16  -1.233  14.477  14.746
  165    H3*    G  16           H3*        G  16   0.054  13.666  12.125
  166    H2*    G  16           H2*        G  16  -1.787  14.836  11.074
  167   2HO*    G  16          2HO*        G  16  -3.359  14.168  12.818
  168    H1*    G  16           H1*        G  16  -1.545  17.038  12.639
  169    H8     G  16           H8         G  16   2.050  16.069  12.403
  170    H1     G  16           H1         G  16  -0.250  17.891   6.714
  171   1H2     G  16          1H2         G  16  -2.401  18.195   6.811
  172   2H2     G  16          2H2         G  16  -3.316  17.764   8.244
  173   1H5*    G  17          1H5*        G  17  -3.773  12.721  11.038
  174   2H5*    G  17          2H5*        G  17  -3.822  11.174  10.181
  175    H4*    G  17           H4*        G  17  -4.621  13.044   8.805
  176    H3*    G  17           H3*        G  17  -2.059  11.773   7.801
  177    H2*    G  17           H2*        G  17  -2.371  13.222   5.840
  178   2HO*    G  17          2HO*        G  17  -4.785  13.056   6.030
  179    H1*    G  17           H1*        G  17  -2.646  15.443   7.265
  180    H8     G  17           H8         G  17  -0.528  13.645   9.724
  181    H1     G  17           H1         G  17   2.720  15.855   4.642
  182   1H2     G  17          1H2         G  17   1.349  16.387   3.044
  183   2H2     G  17          2H2         G  17  -0.373  16.051   3.156
  184   1H5*    C  18          1H5*        C  18  -3.850  11.587   4.266
  185   2H5*    C  18          2H5*        C  18  -3.713  10.004   3.482
  186    H4*    C  18           H4*        C  18  -2.611  11.670   2.117
  187    H3*    C  18           H3*        C  18  -0.531   9.990   3.556
  188    H2*    C  18           H2*        C  18   1.083  11.117   2.059
  189   2HO*    C  18          2HO*        C  18   0.037  11.657   0.143
  190    H1*    C  18           H1*        C  18   0.204  13.480   2.784
  191   1H4     C  18          1H4         C  18   4.148  11.823   7.490
  192   2H4     C  18          2H4         C  18   2.773  11.371   8.467
  193    H5     C  18           H5         C  18   0.516  11.378   7.650
  194    H6     C  18           H6         C  18  -0.866  11.721   5.674
  195   1H5*    C  19          1H5*        C  19   0.901   9.809  -0.107
  196   2H5*    C  19          2H5*        C  19   1.321   8.157  -0.594
  197    H4*    C  19           H4*        C  19   3.168   9.664  -0.984
  198    H3*    C  19           H3*        C  19   3.656   7.713   1.295
  199    H2*    C  19           H2*        C  19   5.967   8.385   1.067
  200   2HO*    C  19          2HO*        C  19   5.633   8.681  -1.378
  201    H1*    C  19           H1*        C  19   5.367  11.044   1.047
  202   1H4     C  19          1H4         C  19   6.048   9.207   7.143
  203   2H4     C  19          2H4         C  19   4.349   8.804   7.234
  204    H5     C  19           H5         C  19   2.874   8.879   5.347
  205    H6     C  19           H6         C  19   2.708   9.462   2.975
  206   1H5*    U  20          1H5*        U  20   6.727   6.983  -1.144
  207   2H5*    U  20          2H5*        U  20   6.962   5.264  -1.452
  208    H4*    U  20           H4*        U  20   9.012   6.257  -0.675
  209    H3*    U  20           H3*        U  20   7.738   4.441   1.401
  210    H2*    U  20           H2*        U  20   9.927   4.535   2.442
  211   2HO*    U  20          2HO*        U  20  11.155   4.643   0.368
  212    H1*    U  20           H1*        U  20  10.035   7.249   2.208
  213    H3     U  20           H3         U  20   9.034   6.188   6.573
  214    H5     U  20           H5         U  20   5.325   6.248   4.644
  215    H6     U  20           H6         U  20   6.502   6.473   2.499
  216   1H5*    G  21          1H5*        G  21  11.432   2.691   0.364
  217   2H5*    G  21          2H5*        G  21  11.354   0.928   0.352
  218    H4*    G  21           H4*        G  21  13.157   1.733   1.770
  219    H3*    G  21           H3*        G  21  10.919   0.504   3.410
  220    H2*    G  21           H2*        G  21  12.556   0.591   5.226
  221   2HO*    G  21          2HO*        G  21  14.446   0.287   3.622
  222    H1*    G  21           H1*        G  21  13.118   3.193   4.723
  223    H8     G  21           H8         G  21   9.469   2.818   3.718
  224    H1     G  21           H1         G  21  10.381   2.886  10.089
  225   1H2     G  21          1H2         G  21  12.469   2.586  10.543
  226   2H2     G  21          2H2         G  21  13.694   2.525   9.292
  227   1H5*    G  22          1H5*        G  22  14.337  -1.465   4.429
  228   2H5*    G  22          2H5*        G  22  14.167  -3.215   4.477
  229    H4*    G  22           H4*        G  22  15.220  -2.374   6.502
  230    H3*    G  22           H3*        G  22  12.444  -3.517   6.952
  231    H2*    G  22           H2*        G  22  12.845  -3.228   9.293
  232   2HO*    G  22          2HO*        G  22  15.130  -3.881   9.208
  233    H1*    G  22           H1*        G  22  13.930  -0.728   9.063
  234    H8     G  22           H8         G  22  11.196  -0.765   6.456
  235    H1     G  22           H1         G  22   8.958  -0.327  12.476
  236   1H2     G  22          1H2         G  22  10.506  -0.840  13.885
  237   2H2     G  22          2H2         G  22  12.154  -1.167  13.382
  238   1H5*    U  23          1H5*        U  23  12.307  -7.666   9.453
  239   2H5*    U  23          2H5*        U  23  11.310  -6.281   8.951
  240    H4*    U  23           H4*        U  23  12.935  -6.402  11.514
  241    H3*    U  23           H3*        U  23   9.984  -6.693  10.844
  242    H2*    U  23           H2*        U  23   9.547  -6.030  13.091
  243   2HO*    U  23          2HO*        U  23  11.553  -7.060  13.997
  244    H1*    U  23           H1*        U  23  11.183  -3.860  12.853
  245    H3     U  23           H3         U  23   6.612  -2.920  12.331
  246    H5     U  23           H5         U  23   8.156  -3.315   8.465
  247    H6     U  23           H6         U  23  10.283  -4.069   9.444
  248   1H5*    U  24          1H5*        U  24   9.800  -8.600  13.874
  249   2H5*    U  24          2H5*        U  24   9.182 -10.251  13.881
  250    H4*    U  24           H4*        U  24   7.849  -8.901  15.348
  251    H3*    U  24           H3*        U  24   6.411  -9.459  12.756
  252    H2*    U  24           H2*        U  24   4.437  -8.683  13.797
  253   2HO*    U  24          2HO*        U  24   4.878  -9.590  15.962
  254    H1*    U  24           H1*        U  24   5.731  -6.489  14.871
  255    H3     U  24           H3         U  24   3.032  -5.182  11.334
  256    H5     U  24           H5         U  24   6.640  -6.351   9.554
  257    H6     U  24           H6         U  24   7.434  -7.092  11.756
  258   1H5*    A  25          1H5*        A  25   5.112 -13.585  11.570
  259   2H5*    A  25          2H5*        A  25   6.830 -13.807  11.275
  260    H4*    A  25           H4*        A  25   5.780 -13.442   9.163
  261    H3*    A  25           H3*        A  25   7.868 -11.706   9.859
  262    H2*    A  25           H2*        A  25   6.299  -9.944  10.491
  263   2HO*    A  25          2HO*        A  25   7.784  -9.048   8.998
  264    H1*    A  25           H1*        A  25   4.924 -10.903   7.932
  265    H8     A  25           H8         A  25   3.536  -9.754  11.420
  266   1H6     A  25          1H6         A  25   0.436  -5.513   8.059
  267   2H6     A  25          2H6         A  25   0.498  -6.321   9.614
  268    H2     A  25           H2         A  25   3.225  -7.693   5.361
  269   1H5*    G  26          1H5*        G  26   7.885 -14.794   4.838
  270   2H5*    G  26          2H5*        G  26   7.789 -13.067   4.574
  271    H4*    G  26           H4*        G  26   5.859 -13.782   6.612
  272    H3*    G  26           H3*        G  26   6.156 -16.037   4.964
  273    H2*    G  26           H2*        G  26   5.902 -14.602   3.094
  274   2HO*    G  26          2HO*        G  26   3.494 -16.063   3.585
  275    H1*    G  26           H1*        G  26   3.412 -13.645   4.568
  276    H8     G  26           H8         G  26   5.427 -13.409   1.356
  277    H1     G  26           H1         G  26   0.830  -8.977   1.920
  278   1H2     G  26          1H2         G  26   0.243  -8.813   3.987
  279   2H2     G  26          2H2         G  26   0.734  -9.985   5.200
  280   1H5*    U  27          1H5*        U  27   4.896 -16.506   8.244
  281   2H5*    U  27          2H5*        U  27   4.199 -18.101   8.594
  282    H4*    U  27           H4*        U  27   3.951 -17.052  10.635
  283    H3*    U  27           H3*        U  27   1.367 -16.374   9.168
  284    H2*    U  27           H2*        U  27   0.735 -15.041  11.064
  285   2HO*    U  27          2HO*        U  27   1.948 -16.671  12.551
  286    H1*    U  27           H1*        U  27   3.072 -13.738  11.336
  287    H3     U  27           H3         U  27   0.180 -10.960   9.051
  288    H5     U  27           H5         U  27   2.756 -12.616   6.228
  289    H6     U  27           H6         U  27   3.430 -14.287   7.886
  290   1H5*    A  28          1H5*        A  28  -0.198 -16.502  12.845
  291   2H5*    A  28          2H5*        A  28  -1.436 -17.752  12.915
  292    H4*    A  28           H4*        A  28  -2.388 -15.653  13.644
  293    H3*    A  28           H3*        A  28  -3.379 -16.471  10.884
  294    H2*    A  28           H2*        A  28  -4.862 -14.560  11.036
  295   2HO*    A  28          2HO*        A  28  -5.138 -14.893  13.460
  296    H1*    A  28           H1*        A  28  -2.935 -12.867  11.934
  297    H8     A  28           H8         A  28  -0.824 -14.793   9.588
  298   1H6     A  28          1H6         A  28  -3.323 -11.293   5.082
  299   2H6     A  28          2H6         A  28  -2.027 -12.414   5.468
  300    H2     A  28           H2         A  28  -6.135 -11.344   8.508
  301   1H5*    C  29          1H5*        C  29  -6.919 -15.762  12.194
  302   2H5*    C  29          2H5*        C  29  -8.106 -17.031  11.862
  303    H4*    C  29           H4*        C  29  -8.694 -15.014  10.655
  304    H3*    C  29           H3*        C  29  -7.659 -17.195   8.830
  305    H2*    C  29           H2*        C  29  -8.275 -15.717   6.990
  306   2HO*    C  29          2HO*        C  29 -10.241 -14.892   8.189
  307    H1*    C  29           H1*        C  29  -7.149 -13.535   8.036
  308   1H4     C  29          1H4         C  29  -2.412 -16.300   4.805
  309   2H4     C  29          2H4         C  29  -1.856 -17.055   6.281
  310    H5     C  29           H5         C  29  -3.091 -17.013   8.326
  311    H6     C  29           H6         C  29  -5.105 -16.152   9.407
  312   1H5*    C  30          1H5*        C  30 -11.343 -16.397   7.081
  313   2H5*    C  30          2H5*        C  30 -12.173 -17.878   6.578
  314    H4*    C  30           H4*        C  30 -11.732 -16.396   4.671
  315    H3*    C  30           H3*        C  30 -10.039 -18.907   4.613
  316    H2*    C  30           H2*        C  30  -9.456 -18.210   2.360
  317   2HO*    C  30          2HO*        C  30 -11.722 -17.206   2.065
  318    H1*    C  30           H1*        C  30  -8.992 -15.623   3.135
  319   1H4     C  30          1H4         C  30  -3.601 -19.044   3.445
  320   2H4     C  30          2H4         C  30  -3.954 -19.507   5.095
  321    H5     C  30           H5         C  30  -5.983 -18.894   6.228
  322    H6     C  30           H6         C  30  -8.135 -17.753   5.962
  323   1H5*    U  31          1H5*        U  31 -12.186 -18.685   0.883
  324   2H5*    U  31          2H5*        U  31 -13.080 -20.172   0.572
  325    H4*    U  31           H4*        U  31 -12.033 -19.392  -1.459
  326    H3*    U  31           H3*        U  31 -10.711 -21.893  -0.394
  327    H2*    U  31           H2*        U  31  -9.509 -21.964  -2.464
  328   2HO*    U  31          2HO*        U  31 -11.428 -21.141  -3.729
  329    H1*    U  31           H1*        U  31  -8.899 -19.296  -2.457
  330    H3     U  31           H3         U  31  -5.008 -21.534  -1.368
  331    H5     U  31           H5         U  31  -6.964 -20.851   2.278
  332    H6     U  31           H6         U  31  -8.969 -20.197   1.028
  333   1H5*    C  32          1H5*        C  32 -11.843 -23.349  -3.901
  334   2H5*    C  32          2H5*        C  32 -12.540 -24.972  -3.841
  335    H4*    C  32           H4*        C  32 -10.493 -24.993  -5.148
  336    H3*    C  32           H3*        C  32 -10.087 -26.332  -2.453
  337    H2*    C  32           H2*        C  32  -7.886 -26.905  -3.261
  338   2HO*    C  32          2HO*        C  32  -8.831 -27.196  -5.564
  339    H1*    C  32           H1*        C  32  -7.407 -24.435  -4.389
  340   1H4     C  32          1H4         C  32  -4.921 -24.622   1.485
  341   2H4     C  32          2H4         C  32  -6.474 -24.252   2.200
  342    H5     C  32           H5         C  32  -8.482 -23.986   0.913
  343    H6     C  32           H6         C  32  -9.420 -24.092  -1.348
  344   1H5*    U  33          1H5*        U  33  -8.173 -28.967  -4.451
  345   2H5*    U  33          2H5*        U  33  -8.832 -30.599  -4.313
  346    H4*    U  33           H4*        U  33  -6.504 -30.694  -3.680
  347    H3*    U  33           H3*        U  33  -8.333 -30.766  -1.259
  348    H2*    U  33           H2*        U  33  -6.514 -31.064   0.076
  349   2HO*    U  33          2HO*        U  33  -4.553 -31.606  -1.951
  350    H1*    U  33           H1*        U  33  -4.754 -29.497  -1.490
  351    H3     U  33           H3         U  33  -4.741 -27.713   2.719
  352    H5     U  33           H5         U  33  -8.685 -27.129   1.454
  353    H6     U  33           H6         U  33  -8.128 -28.267  -0.650
  354   1H5*    U  34          1H5*        U  34  -8.343 -36.359  -0.386
  355   2H5*    U  34          2H5*        U  34  -7.625 -35.348   0.873
  356    H4*    U  34           H4*        U  34  -6.433 -37.465   0.635
  357    H3*    U  34           H3*        U  34  -5.087 -35.089   0.897
  358    H2*    U  34           H2*        U  34  -4.816 -34.768  -1.466
  359   2HO*    U  34          2HO*        U  34  -2.525 -36.138  -0.446
  360    H1*    U  34           H1*        U  34  -4.040 -37.706  -1.625
  361    H3     U  34           H3         U  34  -3.100 -37.324  -6.026
  362    H5     U  34           H5         U  34  -6.509 -34.930  -5.642
  363    H6     U  34           H6         U  34  -6.524 -35.431  -3.237
  364   1H5*    C  35          1H5*        C  35  -1.614 -35.192   1.591
  365   2H5*    C  35          2H5*        C  35  -1.228 -36.026   3.098
  366    H4*    C  35           H4*        C  35  -0.259 -33.799   3.021
  367    H3*    C  35           H3*        C  35  -1.425 -34.794   5.283
  368    H2*    C  35           H2*        C  35  -3.582 -33.875   4.793
  369   2HO*    C  35          2HO*        C  35  -2.135 -32.080   6.465
  370    H1*    C  35           H1*        C  35  -2.287 -31.226   4.074
  371   1H4     C  35          1H4         C  35  -8.499 -30.501   2.785
  372   2H4     C  35          2H4         C  35  -8.458 -31.842   1.653
  373    H5     C  35           H5         C  35  -6.542 -33.228   1.368
  374    H6     C  35           H6         C  35  -4.171 -33.474   1.887
  375   1H5*    G  36          1H5*        G  36   2.998 -31.453   5.126
  376   2H5*    G  36          2H5*        G  36   1.441 -31.562   4.288
  377    H4*    G  36           H4*        G  36   4.007 -32.937   3.400
  378    H3*    G  36           H3*        G  36   2.467 -30.541   2.328
  379    H2*    G  36           H2*        G  36   3.266 -31.143   0.178
  380   2HO*    G  36          2HO*        G  36   5.512 -31.587   1.253
  381    H1*    G  36           H1*        G  36   3.354 -33.923   0.762
  382    H8     G  36           H8         G  36   2.040 -34.467  -1.448
  383    H1     G  36           H1         G  36  -2.655 -30.290  -0.032
  384   1H2     G  36          1H2         G  36  -2.220 -29.247   1.780
  385   2H2     G  36          2H2         G  36  -0.739 -29.496   2.678
  386   1H5*    G  37          1H5*        G  37   4.999 -29.545   0.274
  387   2H5*    G  37          2H5*        G  37   5.433 -27.839   0.168
  388    H4*    G  37           H4*        G  37   4.121 -28.855  -1.784
  389    H3*    G  37           H3*        G  37   2.981 -26.400  -0.396
  390    H2*    G  37           H2*        G  37   1.426 -26.411  -2.309
  391   2HO*    G  37          2HO*        G  37   3.193 -27.406  -3.785
  392    H1*    G  37           H1*        G  37   0.830 -29.017  -2.016
  393    H8     G  37           H8         G  37   1.599 -27.608   1.471
  394    H1     G  37           H1         G  37  -4.030 -25.668  -0.941
  395   1H2     G  37          1H2         G  37  -4.197 -26.281  -3.003
  396   2H2     G  37          2H2         G  37  -3.026 -27.344  -3.757
  397   1H5*    U  38          1H5*        U  38   2.424 -25.552  -4.264
  398   2H5*    U  38          2H5*        U  38   3.077 -24.023  -4.828
  399    H4*    U  38           H4*        U  38   0.753 -24.279  -5.473
  400    H3*    U  38           H3*        U  38   1.132 -22.144  -3.395
  401    H2*    U  38           H2*        U  38  -1.109 -21.440  -3.922
  402   2HO*    U  38          2HO*        U  38  -1.078 -21.893  -6.226
  403    H1*    U  38           H1*        U  38  -2.085 -23.975  -3.719
  404    H3     U  38           H3         U  38  -3.196 -22.059   0.304
  405    H5     U  38           H5         U  38   0.720 -23.416   0.837
  406    H6     U  38           H6         U  38   0.824 -23.905  -1.559
  407   1H5*    G  39          1H5*        G  39   0.021 -19.975  -6.727
  408   2H5*    G  39          2H5*        G  39   0.851 -18.423  -6.787
  409    H4*    G  39           H4*        G  39  -1.524 -18.122  -6.854
  410    H3*    G  39           H3*        G  39  -0.483 -17.230  -4.157
  411    H2*    G  39           H2*        G  39  -2.749 -16.349  -3.867
  412   2HO*    G  39          2HO*        G  39  -2.986 -15.879  -6.280
  413    H1*    G  39           H1*        G  39  -3.877 -18.689  -4.590
  414    H8     G  39           H8         G  39  -0.495 -19.525  -2.988
  415    H1     G  39           H1         G  39  -5.090 -17.981   1.229
  416   1H2     G  39          1H2         G  39  -6.754 -17.072   0.195
  417   2H2     G  39          2H2         G  39  -6.855 -17.032  -1.553
  418   1H5*    G  40          1H5*        G  40  -2.623 -14.038  -5.669
  419   2H5*    G  40          2H5*        G  40  -1.887 -12.465  -5.318
  420    H4*    G  40           H4*        G  40  -4.232 -12.527  -4.662
  421    H3*    G  40           H3*        G  40  -2.199 -12.208  -2.424
  422    H2*    G  40           H2*        G  40  -4.135 -11.938  -0.958
  423   2HO*    G  40          2HO*        G  40  -5.355 -10.772  -2.802
  424    H1*    G  40           H1*        G  40  -5.539 -14.008  -1.960
  425    H8     G  40           H8         G  40  -1.993 -15.264  -2.170
  426    H1     G  40           H1         G  40  -4.212 -15.014   3.857
  427   1H2     G  40          1H2         G  40  -6.025 -13.849   3.938
  428   2H2     G  40          2H2         G  40  -6.737 -13.135   2.505
  429   1H5*    G  41          1H5*        G  41  -4.617  -9.739  -0.910
  430   2H5*    G  41          2H5*        G  41  -3.895  -8.174  -0.537
  431    H4*    G  41           H4*        G  41  -4.619  -9.159   1.535
  432    H3*    G  41           H3*        G  41  -1.614  -9.367   1.220
  433    H2*    G  41           H2*        G  41  -1.611 -10.135   3.543
  434   2HO*    G  41          2HO*        G  41  -3.435  -8.893   4.337
  435    H1*    G  41           H1*        G  41  -3.472 -12.006   3.060
  436    H8     G  41           H8         G  41  -1.761 -11.649  -0.307
  437    H1     G  41           H1         G  41   1.474 -15.303   3.869
  438   1H2     G  41          1H2         G  41   0.702 -15.066   5.850
  439   2H2     G  41          2H2         G  41  -0.642 -14.003   6.229
  440   1H5*    A  42          1H5*        A  42  -0.737  -5.365   4.779
  441   2H5*    A  42          2H5*        A  42  -0.483  -6.700   5.906
  442    H4*    A  42           H4*        A  42  -3.136  -5.878   4.662
  443    H3*    A  42           H3*        A  42  -2.011  -5.960   7.478
  444    H2*    A  42           H2*        A  42  -4.249  -6.378   8.287
  445   2HO*    A  42          2HO*        A  42  -5.260  -5.030   6.481
  446    H1*    A  42           H1*        A  42  -4.676  -8.418   6.607
  447    H8     A  42           H8         A  42  -1.114  -9.068   6.667
  448   1H6     A  42          1H6         A  42  -1.607 -10.914  12.593
  449   2H6     A  42          2H6         A  42  -0.627 -11.009  11.147
  450    H2     A  42           H2         A  42  -5.343  -8.785  11.519
  451   1H5*    A  43          1H5*        A  43  -4.823  -3.537   7.885
  452   2H5*    A  43          2H5*        A  43  -4.875  -1.942   8.597
  453    H4*    A  43           H4*        A  43  -6.177  -3.435   9.968
  454    H3*    A  43           H3*        A  43  -3.505  -2.831  11.301
  455    H2*    A  43           H2*        A  43  -4.217  -4.244  13.125
  456   2HO*    A  43          2HO*        A  43  -6.554  -3.436  12.819
  457    H1*    A  43           H1*        A  43  -5.230  -6.240  11.509
  458    H8     A  43           H8         A  43  -2.243  -5.333   9.553
  459   1H6     A  43          1H6         A  43   1.104  -8.722  13.520
  460   2H6     A  43          2H6         A  43   1.057  -8.039  11.905
  461    H2     A  43           H2         A  43  -2.799  -7.834  15.445
  462   1H5*    U  44          1H5*        U  44  -5.490  -2.290  14.508
  463   2H5*    U  44          2H5*        U  44  -5.132  -0.761  15.328
  464    H4*    U  44           H4*        U  44  -4.356  -2.593  16.705
  465    H3*    U  44           H3*        U  44  -2.068  -1.140  15.342
  466    H2*    U  44           H2*        U  44  -0.613  -2.462  16.724
  467   2HO*    U  44          2HO*        U  44  -2.256  -2.391  18.587
  468    H1*    U  44           H1*        U  44  -1.950  -4.798  16.272
  469    H3     U  44           H3         U  44   1.828  -5.198  13.698
  470    H5     U  44           H5         U  44  -0.734  -2.825  11.391
  471    H6     U  44           H6         U  44  -2.227  -2.653  13.324
  472   1H5*    A  45          1H5*        A  45  -1.002  -0.971  19.322
  473   2H5*    A  45          2H5*        A  45  -0.254   0.567  19.760
  474    H4*    A  45           H4*        A  45   1.249  -1.301  20.186
  475    H3*    A  45           H3*        A  45   2.194   0.424  17.866
  476    H2*    A  45           H2*        A  45   4.244  -0.847  18.037
  477   2HO*    A  45          2HO*        A  45   3.969  -1.094  20.494
  478    H1*    A  45           H1*        A  45   2.947  -3.229  18.071
  479    H8     A  45           H8         A  45   0.779  -0.881  15.987
  480   1H6     A  45          1H6         A  45   4.497  -2.313  11.208
  481   2H6     A  45          2H6         A  45   2.962  -1.604  11.669
  482    H2     A  45           H2         A  45   6.353  -3.890  14.907
  483   1H5*    C  46          1H5*        C  46   5.292   0.332  20.566
  484   2H5*    C  46          2H5*        C  46   6.011   1.921  20.821
  485    H4*    C  46           H4*        C  46   7.703   0.290  20.211
  486    H3*    C  46           H3*        C  46   7.193   2.323  18.006
  487    H2*    C  46           H2*        C  46   9.236   1.455  17.057
  488   2HO*    C  46          2HO*        C  46  10.215   1.071  19.282
  489    H1*    C  46           H1*        C  46   8.488  -1.153  17.460
  490   1H4     C  46          1H4         C  46   6.442   0.407  11.629
  491   2H4     C  46          2H4         C  46   4.894   0.890  12.286
  492    H5     C  46           H5         C  46   4.443   1.016  14.641
  493    H6     C  46           H6         C  46   5.395   0.652  16.873
  494   1H5*    C  47          1H5*        C  47  11.221   2.762  19.001
  495   2H5*    C  47          2H5*        C  47  11.691   4.463  19.052
  496    H4*    C  47           H4*        C  47  13.118   3.206  17.532
  497    H3*    C  47           H3*        C  47  11.249   5.103  16.084
  498    H2*    C  47           H2*        C  47  12.684   4.673  14.170
  499   2HO*    C  47          2HO*        C  47  14.699   4.494  15.511
  500    H1*    C  47           H1*        C  47  12.676   1.966  14.616
  501   1H4     C  47          1H4         C  47   7.826   3.161  10.654
  502   2H4     C  47          2H4         C  47   6.765   3.482  12.006
  503    H5     C  47           H5         C  47   7.513   3.538  14.288
  504    H6     C  47           H6         C  47   9.464   3.274  15.748
  505   1H5*    A  48          1H5*        A  48  15.228   6.355  15.191
  506   2H5*    A  48          2H5*        A  48  15.362   8.112  15.127
  507    H4*    A  48           H4*        A  48  16.226   7.081  13.095
  508    H3*    A  48           H3*        A  48  13.642   8.590  12.615
  509    H2*    A  48           H2*        A  48  14.187   8.295  10.251
  510   2HO*    A  48          2HO*        A  48  16.619   8.383  10.707
  511    H1*    A  48           H1*        A  48  14.630   5.642  10.567
  512    H8     A  48           H8         A  48  12.002   6.474  13.175
  513   1H6     A  48          1H6         A  48   7.824   6.235   8.574
  514   2H6     A  48          2H6         A  48   8.047   6.326  10.308
  515    H2     A  48           H2         A  48  11.874   6.131   6.754
  516   1H5*    G  49          1H5*        G  49  16.441  10.201  10.015
  517   2H5*    G  49          2H5*        G  49  16.385  11.958   9.910
  518    H4*    G  49           H4*        G  49  16.300  10.927   7.706
  519    H3*    G  49           H3*        G  49  13.677  12.260   8.466
  520    H2*    G  49           H2*        G  49  13.087  11.872   6.122
  521   2HO*    G  49          2HO*        G  49  15.504  12.114   5.468
  522    H1*    G  49           H1*        G  49  13.856   9.285   6.197
  523    H8     G  49           H8         G  49  12.635   9.824   9.722
  524    H1     G  49           H1         G  49   7.872   9.625   5.409
  525   1H2     G  49          1H2         G  49   8.659   9.969   3.428
  526   2H2     G  49          2H2         G  49  10.382   9.997   3.107
  527   1H5*    G  50          1H5*        G  50  14.484  13.680   4.746
  528   2H5*    G  50          2H5*        G  50  14.418  15.433   4.612
  529    H4*    G  50           H4*        G  50  13.101  14.334   2.861
  530    H3*    G  50           H3*        G  50  11.422  15.871   4.876
  531    H2*    G  50           H2*        G  50   9.556  15.410   3.355
  532   2HO*    G  50          2HO*        G  50  11.164  15.506   1.420
  533    H1*    G  50           H1*        G  50  10.207  12.783   3.037
  534    H8     G  50           H8         G  50  11.125  13.133   6.624
  535    H1     G  50           H1         G  50   4.761  13.030   5.633
  536   1H2     G  50          1H2         G  50   4.344  13.288   3.545
  537   2H2     G  50          2H2         G  50   5.591  13.703   2.387
  538   1H5*    U  51          1H5*        U  51  10.159  17.133   1.222
  539   2H5*    U  51          2H5*        U  51  10.383  18.845   0.876
  540    H4*    U  51           H4*        U  51   8.134  18.133   0.265
  541    H3*    U  51           H3*        U  51   8.688  20.352   1.886
  542    H2*    U  51           H2*        U  51   7.966  19.470   3.848
  543   2HO*    U  51          2HO*        U  51   5.287  19.910   2.978
  544    H1*    U  51           H1*        U  51   5.787  17.857   2.533
  545    H3     U  51           H3         U  51   4.630  16.268   6.549
  546    H5     U  51           H5         U  51   8.776  16.711   6.946
  547    H6     U  51           H6         U  51   8.879  17.360   4.582
  548   1H5*    G  52          1H5*        G  52   7.694  22.378  -2.268
  549   2H5*    G  52          2H5*        G  52   6.079  22.623  -2.904
  550    H4*    G  52           H4*        G  52   7.344  19.897  -2.381
  551    H3*    G  52           H3*        G  52   6.750  21.564  -4.857
  552    H2*    G  52           H2*        G  52   6.591  19.500  -6.078
  553   2HO*    G  52          2HO*        G  52   8.387  18.490  -4.738
  554    H1*    G  52           H1*        G  52   5.075  18.283  -4.149
  555    H8     G  52           H8         G  52   3.896  21.885  -4.196
  556    H1     G  52           H1         G  52   1.340  18.184  -8.792
  557   1H2     G  52          1H2         G  52   2.589  16.464  -9.143
  558   2H2     G  52          2H2         G  52   3.981  16.103  -8.140
  559   1H5*    C  53          1H5*        C  53   9.638  18.925  -6.403
  560   2H5*    C  53          2H5*        C  53  10.739  19.752  -7.509
  561    H4*    C  53           H4*        C  53   9.607  17.892  -8.611
  562    H3*    C  53           H3*        C  53   8.650  20.578  -9.649
  563    H2*    C  53           H2*        C  53   7.556  19.265 -11.373
  564   2HO*    C  53          2HO*        C  53   9.375  17.607 -11.374
  565    H1*    C  53           H1*        C  53   6.526  17.469  -9.591
  566   1H4     C  53          1H4         C  53   2.042  21.932  -9.937
  567   2H4     C  53          2H4         C  53   2.814  22.834  -8.652
  568    H5     C  53           H5         C  53   5.023  22.348  -7.847
  569    H6     C  53           H6         C  53   6.831  20.700  -7.920
  570   1H5*    C  54          1H5*        C  54   9.875  18.522 -13.107
  571   2H5*    C  54          2H5*        C  54  10.745  19.587 -14.216
  572    H4*    C  54           H4*        C  54   8.859  18.518 -15.328
  573    H3*    C  54           H3*        C  54   8.416  21.495 -14.911
  574    H2*    C  54           H2*        C  54   6.542  21.199 -16.418
  575   2HO*    C  54          2HO*        C  54   7.772  19.463 -17.682
  576    H1*    C  54           H1*        C  54   5.649  18.961 -15.136
  577   1H4     C  54          1H4         C  54   2.701  23.809 -12.270
  578   2H4     C  54          2H4         C  54   4.020  23.967 -11.135
  579    H5     C  54           H5         C  54   6.078  22.750 -11.326
  580    H6     C  54           H6         C  54   7.265  21.050 -12.628
  581   1H5*    C  55          1H5*        C  55   7.866  21.016 -19.027
  582   2H5*    C  55          2H5*        C  55   8.719  22.280 -19.920
  583    H4*    C  55           H4*        C  55   6.366  22.222 -20.551
  584    H3*    C  55           H3*        C  55   7.132  24.679 -18.955
  585    H2*    C  55           H2*        C  55   4.966  25.527 -19.486
  586   2HO*    C  55          2HO*        C  55   5.030  24.636 -21.745
  587    H1*    C  55           H1*        C  55   3.666  23.121 -19.073
  588   1H4     C  55          1H4         C  55   3.224  26.589 -13.733
  589   2H4     C  55          2H4         C  55   4.797  26.036 -13.207
  590    H5     C  55           H5         C  55   6.201  24.611 -14.529
  591    H6     C  55           H6         C  55   6.401  23.459 -16.679
  592   1H    MET 104          1H        MET 104  10.324 -16.894   2.376
  593    HA   MET 104           HA       MET 104  11.083 -14.057   2.121
  594   1HB   MET 104          1HB       MET 104  13.022 -15.255   3.246
  595   2HB   MET 104          2HB       MET 104  13.179 -16.253   1.807
  596   1HG   MET 104          1HG       MET 104  14.464 -14.706   0.882
  597   2HG   MET 104          2HG       MET 104  13.155 -13.533   0.901
  598   1HE   MET 104          1HE       MET 104  13.813 -11.480   4.172
  599   2HE   MET 104          2HE       MET 104  13.161 -11.346   2.534
  600   3HE   MET 104          3HE       MET 104  12.544 -12.600   3.641
  601    H    TYR 105           H        TYR 105  10.766 -13.368   0.078
  602    HA   TYR 105           HA       TYR 105  10.223 -15.451  -2.015
  603   1HB   TYR 105          1HB       TYR 105   9.077 -12.679  -1.504
  604   2HB   TYR 105          2HB       TYR 105   8.869 -13.511  -3.046
  605    HD1  TYR 105           HD1      TYR 105   7.316 -15.224  -3.360
  606    HD2  TYR 105           HD2      TYR 105   8.214 -14.052   0.730
  607    HE1  TYR 105           HE1      TYR 105   5.604 -16.796  -2.504
  608    HE2  TYR 105           HE2      TYR 105   6.620 -15.749   1.555
  609    HH   TYR 105           HH       TYR 105   4.669 -17.774  -0.672
  610    H    VAL 106           H        VAL 106  11.604 -15.620  -3.657
  611    HA   VAL 106           HA       VAL 106  13.691 -13.487  -3.914
  612    HB   VAL 106           HB       VAL 106  13.767 -16.441  -4.627
  613   1HG1  VAL 106          1HG1      VAL 106  15.427 -15.235  -5.969
  614   2HG1  VAL 106          2HG1      VAL 106  16.046 -14.415  -4.516
  615   3HG1  VAL 106          3HG1      VAL 106  16.237 -16.166  -4.720
  616   1HG2  VAL 106          1HG2      VAL 106  13.621 -16.131  -2.207
  617   2HG2  VAL 106          2HG2      VAL 106  15.235 -16.679  -2.694
  618   3HG2  VAL 106          3HG2      VAL 106  14.967 -14.953  -2.275
  619    H    CYS 107           H        CYS 107  14.239 -12.573  -5.820
  620    HA   CYS 107           HA       CYS 107  12.585 -13.020  -8.201
  621   1HB   CYS 107          1HB       CYS 107  13.361 -10.744  -7.569
  622   2HB   CYS 107          2HB       CYS 107  15.035 -11.285  -7.691
  623    H    HIS 108           H        HIS 108  13.080 -14.305  -9.876
  624    HA   HIS 108           HA       HIS 108  15.736 -15.673  -9.828
  625   1HB   HIS 108          1HB       HIS 108  13.051 -16.648 -10.911
  626   2HB   HIS 108          2HB       HIS 108  14.570 -17.553 -10.967
  627    HD2  HIS 108           HD2      HIS 108  11.599 -17.775  -9.066
  628    HE1  HIS 108           HE1      HIS 108  14.486 -18.109  -5.934
  629    HE2  HIS 108           HE2      HIS 108  12.036 -18.455  -6.560
  630    H    PHE 109           H        PHE 109  14.924 -13.044 -11.169
  631    HA   PHE 109           HA       PHE 109  15.043 -13.442 -14.031
  632   1HB   PHE 109          1HB       PHE 109  14.553 -11.265 -12.591
  633   2HB   PHE 109          2HB       PHE 109  16.293 -11.046 -12.622
  634    HD1  PHE 109           HD1      PHE 109  13.163 -10.977 -14.466
  635    HD2  PHE 109           HD2      PHE 109  17.435 -10.491 -14.718
  636    HE1  PHE 109           HE1      PHE 109  12.877  -9.932 -16.708
  637    HE2  PHE 109           HE2      PHE 109  17.157  -9.424 -16.984
  638    HZ   PHE 109           HZ       PHE 109  14.866  -9.140 -17.959
  639    H    GLU 110           H        GLU 110  16.913 -13.218 -15.416
  640    HA   GLU 110           HA       GLU 110  18.924 -15.022 -14.753
  641   1HB   GLU 110          1HB       GLU 110  20.186 -14.004 -16.728
  642   2HB   GLU 110          2HB       GLU 110  18.572 -14.624 -17.023
  643   1HG   GLU 110          1HG       GLU 110  17.634 -12.371 -17.113
  644   2HG   GLU 110          2HG       GLU 110  19.197 -11.658 -16.715
  645    H    ASN 111           H        ASN 111  20.384 -14.912 -13.154
  646    HA   ASN 111           HA       ASN 111  22.332 -14.288 -12.070
  647   1HB   ASN 111          1HB       ASN 111  22.983 -13.435 -14.447
  648   2HB   ASN 111          2HB       ASN 111  22.581 -11.825 -13.847
  649   1HD2  ASN 111          1HD2      ASN 111  24.664 -10.960 -13.878
  650   2HD2  ASN 111          2HD2      ASN 111  25.952 -11.592 -12.859
  651    H    CYS 112           H        CYS 112  19.470 -12.988 -11.654
  652    HA   CYS 112           HA       CYS 112  20.145 -10.465 -10.303
  653   1HB   CYS 112          1HB       CYS 112  18.058 -10.728 -11.565
  654   2HB   CYS 112          2HB       CYS 112  17.493 -11.982 -10.433
  655    H    GLY 113           H        GLY 113  18.092 -13.157  -9.049
  656   1HA   GLY 113          1HA       GLY 113  18.192 -14.398  -7.101
  657   2HA   GLY 113          2HA       GLY 113  19.896 -13.929  -6.968
  658    H    LYS 114           H        LYS 114  17.659 -11.237  -7.078
  659    HA   LYS 114           HA       LYS 114  18.333 -10.420  -4.364
  660   1HB   LYS 114          1HB       LYS 114  17.667  -9.027  -6.489
  661   2HB   LYS 114          2HB       LYS 114  16.008  -9.271  -5.921
  662   1HG   LYS 114          1HG       LYS 114  16.488  -8.090  -3.857
  663   2HG   LYS 114          2HG       LYS 114  18.244  -8.157  -4.149
  664   1HD   LYS 114          1HD       LYS 114  18.032  -6.697  -6.104
  665   2HD   LYS 114          2HD       LYS 114  16.280  -6.730  -5.937
  666   1HE   LYS 114          1HE       LYS 114  17.037  -4.640  -5.203
  667   2HE   LYS 114          2HE       LYS 114  16.382  -5.531  -3.820
  668   1HZ   LYS 114          1HZ       LYS 114  19.282  -5.237  -4.441
  669   2HZ   LYS 114          2HZ       LYS 114  18.490  -4.426  -3.269
  670   3HZ   LYS 114          3HZ       LYS 114  18.679  -6.041  -3.151
  671    H    ALA 115           H        ALA 115  17.084 -10.414  -2.489
  672    HA   ALA 115           HA       ALA 115  14.654 -12.173  -2.568
  673   1HB   ALA 115          1HB       ALA 115  16.631 -13.277  -1.611
  674   2HB   ALA 115          2HB       ALA 115  16.798 -11.972  -0.405
  675   3HB   ALA 115          3HB       ALA 115  15.367 -13.034  -0.401
  676    H    PHE 116           H        PHE 116  12.840 -11.546  -1.515
  677    HA   PHE 116           HA       PHE 116  12.940  -8.989   0.050
  678   1HB   PHE 116          1HB       PHE 116  10.607  -9.888  -1.674
  679   2HB   PHE 116          2HB       PHE 116  10.896  -8.356  -0.931
  680    HD1  PHE 116           HD1      PHE 116  12.007 -10.609  -3.670
  681    HD2  PHE 116           HD2      PHE 116  12.341  -6.659  -1.972
  682    HE1  PHE 116           HE1      PHE 116  13.419  -9.933  -5.565
  683    HE2  PHE 116           HE2      PHE 116  13.756  -5.973  -3.908
  684    HZ   PHE 116           HZ       PHE 116  14.320  -7.661  -5.670
  685    H    LYS 117           H        LYS 117  11.364  -8.711   1.689
  686    HA   LYS 117           HA       LYS 117  10.763 -11.136   3.114
  687   1HB   LYS 117          1HB       LYS 117  10.497  -9.770   4.851
  688   2HB   LYS 117          2HB       LYS 117  11.187  -8.548   3.793
  689   1HG   LYS 117          1HG       LYS 117   8.977  -7.718   3.247
  690   2HG   LYS 117          2HG       LYS 117   8.287  -8.942   4.355
  691   1HD   LYS 117          1HD       LYS 117  10.083  -6.645   5.208
  692   2HD   LYS 117          2HD       LYS 117   8.319  -6.647   5.245
  693   1HE   LYS 117          1HE       LYS 117   8.690  -7.285   7.394
  694   2HE   LYS 117          2HE       LYS 117   8.564  -8.872   6.619
  695   1HZ   LYS 117          1HZ       LYS 117  11.155  -7.523   7.091
  696   2HZ   LYS 117          2HZ       LYS 117  10.444  -8.592   8.169
  697   3HZ   LYS 117          3HZ       LYS 117  10.901  -9.103   6.682
  698    H    LYS 118           H        LYS 118   8.824  -8.915   1.061
  699    HA   LYS 118           HA       LYS 118   6.540 -10.888   1.285
  700   1HB   LYS 118          1HB       LYS 118   6.288  -7.924   0.658
  701   2HB   LYS 118          2HB       LYS 118   4.983  -9.040   0.882
  702   1HG   LYS 118          1HG       LYS 118   6.921  -8.171   3.013
  703   2HG   LYS 118          2HG       LYS 118   5.353  -7.461   2.776
  704   1HD   LYS 118          1HD       LYS 118   4.186  -9.199   3.648
  705   2HD   LYS 118          2HD       LYS 118   5.337 -10.396   3.084
  706   1HE   LYS 118          1HE       LYS 118   4.932 -10.233   5.541
  707   2HE   LYS 118          2HE       LYS 118   6.600 -10.419   4.949
  708   1HZ   LYS 118          1HZ       LYS 118   5.273  -8.067   6.120
  709   2HZ   LYS 118          2HZ       LYS 118   6.553  -8.844   6.687
  710   3HZ   LYS 118          3HZ       LYS 118   6.702  -7.893   5.317
  711    H    HIS 119           H        HIS 119   5.435 -11.489  -0.586
  712    HA   HIS 119           HA       HIS 119   6.962 -11.538  -3.018
  713   1HB   HIS 119          1HB       HIS 119   4.932 -12.545  -4.020
  714   2HB   HIS 119          2HB       HIS 119   5.472 -13.301  -2.548
  715    HD1  HIS 119           HD1      HIS 119   2.589 -10.659  -3.209
  716    HD2  HIS 119           HD2      HIS 119   3.641 -14.267  -1.284
  717    HE1  HIS 119           HE1      HIS 119   0.442 -11.536  -2.032
  718    HE2  HIS 119           HE2      HIS 119   1.113 -13.688  -0.869
  719    H    ASN 120           H        ASN 120   4.471  -9.311  -1.820
  720    HA   ASN 120           HA       ASN 120   3.855  -8.079  -4.341
  721   1HB   ASN 120          1HB       ASN 120   3.550  -7.312  -1.425
  722   2HB   ASN 120          2HB       ASN 120   3.421  -6.037  -2.636
  723   1HD2  ASN 120          1HD2      ASN 120   1.463  -8.287  -0.999
  724   2HD2  ASN 120          2HD2      ASN 120   0.228  -8.409  -2.251
  725    H    GLN 121           H        GLN 121   6.582  -7.678  -2.065
  726    HA   GLN 121           HA       GLN 121   7.698  -5.322  -3.421
  727   1HB   GLN 121          1HB       GLN 121   9.193  -7.319  -1.726
  728   2HB   GLN 121          2HB       GLN 121   9.611  -5.643  -2.122
  729   1HG   GLN 121          1HG       GLN 121   7.828  -4.831  -0.657
  730   2HG   GLN 121          2HG       GLN 121   7.444  -6.509  -0.229
  731   1HE2  GLN 121          1HE2      GLN 121   9.394  -3.848   0.696
  732   2HE2  GLN 121          2HE2      GLN 121  10.482  -4.751   1.728
  733    H    LEU 122           H        LEU 122   8.140  -8.902  -3.531
  734    HA   LEU 122           HA       LEU 122  10.258  -8.970  -5.405
  735   1HB   LEU 122          1HB       LEU 122   9.569 -10.951  -4.191
  736   2HB   LEU 122          2HB       LEU 122   7.957 -10.897  -4.863
  737    HG   LEU 122           HG       LEU 122   8.727 -11.501  -7.070
  738   1HD1  LEU 122          1HD1      LEU 122  10.988 -10.440  -6.960
  739   2HD1  LEU 122          2HD1      LEU 122  11.460 -11.686  -5.770
  740   3HD1  LEU 122          3HD1      LEU 122  10.996 -12.126  -7.439
  741   1HD2  LEU 122          1HD2      LEU 122   8.219 -13.340  -5.460
  742   2HD2  LEU 122          2HD2      LEU 122   9.505 -13.781  -6.603
  743   3HD2  LEU 122          3HD2      LEU 122   9.921 -13.356  -4.941
  744    H    LYS 123           H        LYS 123   6.688  -9.130  -6.008
  745    HA   LYS 123           HA       LYS 123   6.720  -8.974  -8.812
  746   1HB   LYS 123          1HB       LYS 123   4.774  -7.772  -6.793
  747   2HB   LYS 123          2HB       LYS 123   4.484  -7.768  -8.535
  748   1HG   LYS 123          1HG       LYS 123   4.531 -10.211  -8.618
  749   2HG   LYS 123          2HG       LYS 123   4.920 -10.299  -6.894
  750   1HD   LYS 123          1HD       LYS 123   2.762  -9.104  -6.385
  751   2HD   LYS 123          2HD       LYS 123   2.365  -9.165  -8.117
  752   1HE   LYS 123          1HE       LYS 123   2.542 -11.655  -8.048
  753   2HE   LYS 123          2HE       LYS 123   2.927 -11.576  -6.327
  754   1HZ   LYS 123          1HZ       LYS 123   0.361 -10.772  -7.579
  755   2HZ   LYS 123          2HZ       LYS 123   0.629 -12.047  -6.576
  756   3HZ   LYS 123          3HZ       LYS 123   0.711 -10.517  -5.998
  757    H    VAL 124           H        VAL 124   6.828  -6.273  -6.432
  758    HA   VAL 124           HA       VAL 124   6.888  -4.108  -8.291
  759    HB   VAL 124           HB       VAL 124   7.810  -4.554  -5.470
  760   1HG1  VAL 124          1HG1      VAL 124   8.471  -1.994  -6.976
  761   2HG1  VAL 124          2HG1      VAL 124   8.469  -2.195  -5.209
  762   3HG1  VAL 124          3HG1      VAL 124   9.634  -3.083  -6.179
  763   1HG2  VAL 124          1HG2      VAL 124   6.131  -2.534  -6.890
  764   2HG2  VAL 124          2HG2      VAL 124   5.471  -4.059  -6.225
  765   3HG2  VAL 124          3HG2      VAL 124   6.111  -2.854  -5.124
  766    H    HIS 125           H        HIS 125   9.559  -6.121  -6.948
  767    HA   HIS 125           HA       HIS 125  11.648  -4.615  -8.158
  768   1HB   HIS 125          1HB       HIS 125  12.048  -6.085  -6.285
  769   2HB   HIS 125          2HB       HIS 125  11.514  -7.502  -7.195
  770    HD1  HIS 125           HD1      HIS 125  14.430  -4.966  -7.203
  771    HD2  HIS 125           HD2      HIS 125  13.185  -8.656  -8.807
  772    HE1  HIS 125           HE1      HIS 125  16.471  -5.964  -8.350
  773    H    GLN 126           H        GLN 126   9.928  -7.615  -9.218
  774    HA   GLN 126           HA       GLN 126  11.493  -8.073 -11.544
  775   1HB   GLN 126          1HB       GLN 126   8.636  -8.819 -10.814
  776   2HB   GLN 126          2HB       GLN 126   9.387  -9.259 -12.378
  777   1HG   GLN 126          1HG       GLN 126  11.287 -10.310 -11.187
  778   2HG   GLN 126          2HG       GLN 126  10.624  -9.862  -9.620
  779   1HE2  GLN 126          1HE2      GLN 126  11.348 -12.384 -10.007
  780   2HE2  GLN 126          2HE2      GLN 126   9.930 -13.436 -10.135
  781    H    PHE 127           H        PHE 127   8.634  -6.000 -11.022
  782    HA   PHE 127           HA       PHE 127   8.091  -5.307 -13.697
  783   1HB   PHE 127          1HB       PHE 127   6.569  -4.125 -12.714
  784   2HB   PHE 127          2HB       PHE 127   7.249  -4.479 -11.157
  785    HD1  PHE 127           HD1      PHE 127   7.205  -2.667  -9.806
  786    HD2  PHE 127           HD2      PHE 127   8.039  -1.964 -13.965
  787    HE1  PHE 127           HE1      PHE 127   7.828  -0.439  -9.241
  788    HE2  PHE 127           HE2      PHE 127   8.718   0.299 -13.509
  789    HZ   PHE 127           HZ       PHE 127   8.690   1.151 -11.088
  790    H    SER 128           H        SER 128  10.701  -4.221 -11.536
  791    HA   SER 128           HA       SER 128  11.567  -1.964 -13.083
  792   1HB   SER 128          1HB       SER 128  12.222  -2.612 -10.685
  793   2HB   SER 128          2HB       SER 128  13.382  -3.746 -11.415
  794    HG   SER 128           HG       SER 128  14.301  -1.672 -10.967
  795    H    HIS 129           H        HIS 129  12.261  -5.466 -13.347
  796    HA   HIS 129           HA       HIS 129  14.363  -5.122 -15.379
  797   1HB   HIS 129          1HB       HIS 129  12.728  -7.568 -14.567
  798   2HB   HIS 129          2HB       HIS 129  14.053  -7.545 -15.703
  799    HD1  HIS 129           HD1      HIS 129  16.578  -7.111 -14.622
  800    HD2  HIS 129           HD2      HIS 129  13.375  -8.406 -12.260
  801    HE1  HIS 129           HE1      HIS 129  17.581  -8.281 -12.567
  802    H    THR 130           H        THR 130  10.853  -5.792 -15.300
  803    HA   THR 130           HA       THR 130  10.672  -6.301 -18.174
  804    HB   THR 130           HB       THR 130   8.253  -6.353 -17.786
  805    HG1  THR 130           HG1      THR 130   8.962  -5.015 -15.482
  806   1HG2  THR 130          1HG2      THR 130   9.780  -8.309 -16.822
  807   2HG2  THR 130          2HG2      THR 130   9.251  -7.699 -15.239
  808   3HG2  THR 130          3HG2      THR 130   8.052  -8.218 -16.410
  809    H    GLN 131           H        GLN 131  10.604  -3.471 -16.145
  810    HA   GLN 131           HA       GLN 131  10.110  -1.261 -16.463
  811   1HB   GLN 131          1HB       GLN 131  11.041  -2.046 -19.250
  812   2HB   GLN 131          2HB       GLN 131  10.514  -0.383 -18.913
  813   1HG   GLN 131          1HG       GLN 131  12.374  -1.837 -17.025
  814   2HG   GLN 131          2HG       GLN 131  13.017  -0.946 -18.420
  815   1HE2  GLN 131          1HE2      GLN 131  12.968  -0.777 -15.280
  816   2HE2  GLN 131          2HE2      GLN 131  12.648   0.942 -15.020
  817    H    GLN 132           H        GLN 132   7.912  -3.200 -16.567
  818    HA   GLN 132           HA       GLN 132   5.930  -1.294 -17.727
  819   1HB   GLN 132          1HB       GLN 132   4.381  -3.075 -18.197
  820   2HB   GLN 132          2HB       GLN 132   5.847  -3.244 -19.129
  821   1HG   GLN 132          1HG       GLN 132   5.045  -5.400 -18.629
  822   2HG   GLN 132          2HG       GLN 132   6.519  -5.150 -17.728
  823   1HE2  GLN 132          1HE2      GLN 132   6.431  -5.433 -15.539
  824   2HE2  GLN 132          2HE2      GLN 132   4.941  -5.652 -14.603
  825    H    LEU 133           H        LEU 133   4.112  -0.950 -16.379
  826    HA   LEU 133           HA       LEU 133   4.893  -1.280 -13.579
  827   1HB   LEU 133          1HB       LEU 133   2.971   0.536 -15.033
  828   2HB   LEU 133          2HB       LEU 133   2.976   0.475 -13.262
  829    HG   LEU 133           HG       LEU 133   5.600   0.869 -14.863
  830   1HD1  LEU 133          1HD1      LEU 133   4.026   2.706 -15.432
  831   2HD1  LEU 133          2HD1      LEU 133   3.771   3.017 -13.698
  832   3HD1  LEU 133          3HD1      LEU 133   5.373   3.268 -14.427
  833   1HD2  LEU 133          1HD2      LEU 133   4.969   1.650 -12.040
  834   2HD2  LEU 133          2HD2      LEU 133   5.817   0.148 -12.497
  835   3HD2  LEU 133          3HD2      LEU 133   6.526   1.706 -12.891
  836    HA   PRO 134           HA       PRO 134   2.044  -4.542 -12.986
  837   1HB   PRO 134          1HB       PRO 134   2.253  -4.565 -10.163
  838   2HB   PRO 134          2HB       PRO 134   3.310  -5.436 -11.317
  839   1HG   PRO 134          1HG       PRO 134   3.894  -3.089  -9.648
  840   2HG   PRO 134          2HG       PRO 134   5.007  -4.134 -10.544
  841   1HD   PRO 134          1HD       PRO 134   4.145  -1.493 -11.235
  842   2HD   PRO 134          2HD       PRO 134   5.113  -2.636 -12.186
  843    H    TYR 135           H        TYR 135   1.641  -1.614 -10.985
  844    HA   TYR 135           HA       TYR 135  -1.076  -2.480 -10.194
  845   1HB   TYR 135          1HB       TYR 135   0.592  -0.100  -9.246
  846   2HB   TYR 135          2HB       TYR 135  -0.907  -0.650  -8.547
  847    HD1  TYR 135           HD1      TYR 135   2.715  -1.211  -8.664
  848    HD2  TYR 135           HD2      TYR 135  -1.078  -2.866  -7.435
  849    HE1  TYR 135           HE1      TYR 135   3.921  -2.823  -7.216
  850    HE2  TYR 135           HE2      TYR 135   0.148  -4.597  -6.080
  851    HH   TYR 135           HH       TYR 135   3.703  -4.775  -5.943
  852    H    GLU 136           H        GLU 136  -2.348  -2.113 -12.005
  853    HA   GLU 136           HA       GLU 136  -2.240   0.583 -13.278
  854   1HB   GLU 136          1HB       GLU 136  -3.848  -1.881 -14.089
  855   2HB   GLU 136          2HB       GLU 136  -3.615  -0.407 -15.025
  856   1HG   GLU 136          1HG       GLU 136  -1.200  -0.956 -15.263
  857   2HG   GLU 136          2HG       GLU 136  -1.438  -2.429 -14.328
  858    H    CYS 137           H        CYS 137  -3.969   2.003 -13.209
  859    HA   CYS 137           HA       CYS 137  -6.021   1.634 -11.189
  860   1HB   CYS 137          1HB       CYS 137  -5.156   3.836 -11.601
  861   2HB   CYS 137          2HB       CYS 137  -5.519   3.738 -13.314
  862    HA   PRO 138           HA       PRO 138  -8.593  -0.524 -14.136
  863   1HB   PRO 138          1HB       PRO 138 -10.223  -1.825 -12.413
  864   2HB   PRO 138          2HB       PRO 138  -8.456  -2.100 -12.371
  865   1HG   PRO 138          1HG       PRO 138 -10.079  -0.192 -10.631
  866   2HG   PRO 138          2HG       PRO 138  -8.910  -1.438 -10.094
  867   1HD   PRO 138          1HD       PRO 138  -8.231   1.222 -10.464
  868   2HD   PRO 138          2HD       PRO 138  -7.086  -0.132 -10.700
  869    H    HIS 139           H        HIS 139  -9.443   2.353 -12.728
  870    HA   HIS 139           HA       HIS 139 -12.350   2.187 -12.726
  871   1HB   HIS 139          1HB       HIS 139 -10.359   4.481 -12.555
  872   2HB   HIS 139          2HB       HIS 139 -12.096   4.754 -12.616
  873    HD2  HIS 139           HD2      HIS 139  -9.470   3.101 -10.287
  874    HE1  HIS 139           HE1      HIS 139 -13.087   3.379  -8.057
  875    HE2  HIS 139           HE2      HIS 139 -10.633   2.692  -7.955
  876    H    GLU 140           H        GLU 140 -13.830   3.096 -14.180
  877    HA   GLU 140           HA       GLU 140 -13.199   2.792 -16.952
  878   1HB   GLU 140          1HB       GLU 140 -15.561   4.146 -15.565
  879   2HB   GLU 140          2HB       GLU 140 -15.463   3.826 -17.301
  880   1HG   GLU 140          1HG       GLU 140 -15.235   1.392 -16.845
  881   2HG   GLU 140          2HG       GLU 140 -15.395   1.702 -15.114
  882    H    GLY 141           H        GLY 141 -12.313   4.148 -18.403
  883   1HA   GLY 141          1HA       GLY 141 -12.007   6.208 -19.514
  884   2HA   GLY 141          2HA       GLY 141 -12.681   7.066 -18.117
  885    H    CYS 142           H        CYS 142 -10.451   4.946 -16.828
  886    HA   CYS 142           HA       CYS 142  -8.251   6.967 -16.970
  887   1HB   CYS 142          1HB       CYS 142  -9.526   6.502 -14.759
  888   2HB   CYS 142          2HB       CYS 142  -8.695   4.959 -14.719
  889    H    ASP 143           H        ASP 143  -6.079   6.189 -17.008
  890    HA   ASP 143           HA       ASP 143  -5.653   3.299 -17.592
  891   1HB   ASP 143          1HB       ASP 143  -6.083   4.608 -19.751
  892   2HB   ASP 143          2HB       ASP 143  -4.603   5.504 -19.421
  893    H    LYS 144           H        LYS 144  -4.952   5.510 -15.491
  894    HA   LYS 144           HA       LYS 144  -2.104   5.963 -15.580
  895   1HB   LYS 144          1HB       LYS 144  -4.322   6.583 -13.853
  896   2HB   LYS 144          2HB       LYS 144  -3.162   5.767 -12.880
  897   1HG   LYS 144          1HG       LYS 144  -2.843   8.117 -12.678
  898   2HG   LYS 144          2HG       LYS 144  -1.432   7.437 -13.487
  899   1HD   LYS 144          1HD       LYS 144  -2.165   9.630 -14.392
  900   2HD   LYS 144          2HD       LYS 144  -2.132   8.364 -15.613
  901   1HE   LYS 144          1HE       LYS 144  -4.082   9.900 -15.799
  902   2HE   LYS 144          2HE       LYS 144  -4.528   8.199 -15.652
  903   1HZ   LYS 144          1HZ       LYS 144  -5.157   8.527 -13.417
  904   2HZ   LYS 144          2HZ       LYS 144  -4.563  10.076 -13.335
  905   3HZ   LYS 144          3HZ       LYS 144  -5.871   9.700 -14.260
  906    H    ARG 145           H        ARG 145  -0.375   4.856 -14.593
  907    HA   ARG 145           HA       ARG 145  -0.981   2.267 -13.197
  908   1HB   ARG 145          1HB       ARG 145   1.314   2.509 -15.176
  909   2HB   ARG 145          2HB       ARG 145   0.592   1.069 -14.399
  910   1HG   ARG 145          1HG       ARG 145  -1.444   1.351 -15.722
  911   2HG   ARG 145          2HG       ARG 145  -0.737   2.747 -16.552
  912   1HD   ARG 145          1HD       ARG 145   0.909   1.426 -17.658
  913   2HD   ARG 145          2HD       ARG 145   0.656   0.057 -16.567
  914    HE   ARG 145           HE       ARG 145  -1.218  -0.620 -17.732
  915   1HH1  ARG 145          1HH1      ARG 145  -0.493   2.569 -19.028
  916   2HH1  ARG 145          2HH1      ARG 145  -2.029   2.618 -19.870
  917   1HH2  ARG 145          1HH2      ARG 145  -2.985  -0.492 -18.728
  918   2HH2  ARG 145          2HH2      ARG 145  -3.461   0.958 -19.630
  919    H    PHE 146           H        PHE 146   0.544   1.609 -11.689
  920    HA   PHE 146           HA       PHE 146   2.455   3.755 -10.843
  921   1HB   PHE 146          1HB       PHE 146   0.576   2.194  -9.002
  922   2HB   PHE 146          2HB       PHE 146   1.631   3.493  -8.561
  923    HD1  PHE 146           HD1      PHE 146   1.247   5.838  -9.267
  924    HD2  PHE 146           HD2      PHE 146  -1.536   2.697 -10.283
  925    HE1  PHE 146           HE1      PHE 146  -0.433   7.531  -9.962
  926    HE2  PHE 146           HE2      PHE 146  -3.194   4.367 -10.950
  927    HZ   PHE 146           HZ       PHE 146  -2.624   6.802 -10.835
  928    H    SER 147           H        SER 147   4.087   3.097  -9.343
  929    HA   SER 147           HA       SER 147   5.187   0.499 -10.116
  930   1HB   SER 147          1HB       SER 147   7.102   1.385  -8.567
  931   2HB   SER 147          2HB       SER 147   6.753   2.267 -10.066
  932    HG   SER 147           HG       SER 147   6.581   3.919  -8.808
  933    H    LEU 148           H        LEU 148   3.499   1.857  -7.336
  934    HA   LEU 148           HA       LEU 148   3.871  -0.739  -5.890
  935   1HB   LEU 148          1HB       LEU 148   4.407   2.044  -4.892
  936   2HB   LEU 148          2HB       LEU 148   3.662   0.955  -3.781
  937    HG   LEU 148           HG       LEU 148   6.113   1.221  -3.509
  938   1HD1  LEU 148          1HD1      LEU 148   5.055  -1.576  -3.985
  939   2HD1  LEU 148          2HD1      LEU 148   6.579  -1.231  -3.144
  940   3HD1  LEU 148          3HD1      LEU 148   5.043  -0.669  -2.460
  941   1HD2  LEU 148          1HD2      LEU 148   6.385  -0.657  -5.843
  942   2HD2  LEU 148          2HD2      LEU 148   6.706   1.078  -5.979
  943   3HD2  LEU 148          3HD2      LEU 148   7.678   0.071  -4.881
  944    HA   PRO 149           HA       PRO 149  -0.520  -0.580  -5.420
  945   1HB   PRO 149          1HB       PRO 149  -0.882  -1.734  -2.907
  946   2HB   PRO 149          2HB       PRO 149  -0.498  -2.622  -4.397
  947   1HG   PRO 149          1HG       PRO 149   1.353  -1.830  -2.167
  948   2HG   PRO 149          2HG       PRO 149   1.319  -3.341  -3.149
  949   1HD   PRO 149          1HD       PRO 149   3.090  -1.292  -3.614
  950   2HD   PRO 149          2HD       PRO 149   2.511  -2.361  -4.851
  951    H    SER 150           H        SER 150   1.492   0.796  -2.841
  952    HA   SER 150           HA       SER 150  -0.519   2.250  -1.416
  953   1HB   SER 150          1HB       SER 150   1.442   3.745  -0.787
  954   2HB   SER 150          2HB       SER 150   1.662   2.020  -0.441
  955    HG   SER 150           HG       SER 150   3.301   3.491  -1.781
  956    H    ARG 151           H        ARG 151   1.434   3.057  -4.316
  957    HA   ARG 151           HA       ARG 151   0.516   5.810  -4.501
  958   1HB   ARG 151          1HB       ARG 151   2.100   3.921  -6.256
  959   2HB   ARG 151          2HB       ARG 151   1.282   5.284  -7.015
  960   1HG   ARG 151          1HG       ARG 151   3.328   6.221  -6.580
  961   2HG   ARG 151          2HG       ARG 151   2.349   6.789  -5.243
  962   1HD   ARG 151          1HD       ARG 151   4.228   6.149  -4.104
  963   2HD   ARG 151          2HD       ARG 151   3.321   4.634  -4.010
  964    HE   ARG 151           HE       ARG 151   4.905   4.617  -6.396
  965   1HH1  ARG 151          1HH1      ARG 151   5.399   4.431  -2.923
  966   2HH1  ARG 151          2HH1      ARG 151   6.974   3.689  -3.119
  967   1HH2  ARG 151          1HH2      ARG 151   6.838   3.601  -6.554
  968   2HH2  ARG 151          2HH2      ARG 151   7.813   3.325  -5.130
  969    H    LEU 152           H        LEU 152  -0.545   2.685  -5.910
  970    HA   LEU 152           HA       LEU 152  -2.544   3.823  -7.657
  971   1HB   LEU 152          1HB       LEU 152  -1.674   1.586  -8.015
  972   2HB   LEU 152          2HB       LEU 152  -2.178   1.077  -6.402
  973    HG   LEU 152           HG       LEU 152  -4.522   1.184  -7.009
  974   1HD1  LEU 152          1HD1      LEU 152  -4.453   3.109  -8.639
  975   2HD1  LEU 152          2HD1      LEU 152  -3.625   2.042  -9.791
  976   3HD1  LEU 152          3HD1      LEU 152  -5.284   1.688  -9.248
  977   1HD2  LEU 152          1HD2      LEU 152  -4.580  -0.643  -8.599
  978   2HD2  LEU 152          2HD2      LEU 152  -2.980  -0.214  -9.226
  979   3HD2  LEU 152          3HD2      LEU 152  -3.136  -0.861  -7.581
  980    H    LYS 153           H        LYS 153  -2.675   2.346  -4.354
  981    HA   LYS 153           HA       LYS 153  -5.462   2.620  -3.922
  982   1HB   LYS 153          1HB       LYS 153  -3.072   2.584  -2.041
  983   2HB   LYS 153          2HB       LYS 153  -4.721   2.750  -1.427
  984   1HG   LYS 153          1HG       LYS 153  -5.422   0.662  -2.379
  985   2HG   LYS 153          2HG       LYS 153  -3.910   0.463  -3.269
  986   1HD   LYS 153          1HD       LYS 153  -2.657   0.350  -1.122
  987   2HD   LYS 153          2HD       LYS 153  -4.173   0.477  -0.223
  988   1HE   LYS 153          1HE       LYS 153  -3.485  -1.740  -2.213
  989   2HE   LYS 153          2HE       LYS 153  -3.264  -1.863  -0.465
  990   1HZ   LYS 153          1HZ       LYS 153  -5.360  -2.857  -1.127
  991   2HZ   LYS 153          2HZ       LYS 153  -5.667  -1.552  -0.196
  992   3HZ   LYS 153          3HZ       LYS 153  -5.882  -1.475  -1.817
  993    H    ARG 154           H        ARG 154  -2.811   4.987  -3.409
  994    HA   ARG 154           HA       ARG 154  -4.547   7.027  -2.273
  995   1HB   ARG 154          1HB       ARG 154  -1.934   6.784  -2.187
  996   2HB   ARG 154          2HB       ARG 154  -1.960   7.613  -3.748
  997   1HG   ARG 154          1HG       ARG 154  -3.320   9.459  -2.603
  998   2HG   ARG 154          2HG       ARG 154  -3.121   8.579  -1.082
  999   1HD   ARG 154          1HD       ARG 154  -1.434  10.277  -1.106
 1000   2HD   ARG 154          2HD       ARG 154  -0.634   8.730  -1.393
 1001    HE   ARG 154           HE       ARG 154  -1.350  10.689  -3.560
 1002   1HH1  ARG 154          1HH1      ARG 154   1.036   8.355  -2.453
 1003   2HH1  ARG 154          2HH1      ARG 154   2.123   8.802  -3.745
 1004   1HH2  ARG 154          1HH2      ARG 154  -0.107  11.080  -5.079
 1005   2HH2  ARG 154          2HH2      ARG 154   1.500  10.367  -5.241
 1006    H    HIS 155           H        HIS 155  -3.422   6.241  -5.585
 1007    HA   HIS 155           HA       HIS 155  -4.493   8.552  -6.889
 1008   1HB   HIS 155          1HB       HIS 155  -2.924   7.142  -8.047
 1009   2HB   HIS 155          2HB       HIS 155  -3.967   5.720  -7.893
 1010    HD1  HIS 155           HD1      HIS 155  -3.943   9.107  -9.759
 1011    HD2  HIS 155           HD2      HIS 155  -5.907   5.384  -9.649
 1012    HE1  HIS 155           HE1      HIS 155  -5.780   9.240 -11.484
 1013    H    GLU 156           H        GLU 156  -5.989   5.428  -5.958
 1014    HA   GLU 156           HA       GLU 156  -8.410   5.659  -7.383
 1015   1HB   GLU 156          1HB       GLU 156  -7.789   4.386  -4.674
 1016   2HB   GLU 156          2HB       GLU 156  -9.383   4.352  -5.413
 1017   1HG   GLU 156          1HG       GLU 156  -8.166   3.427  -7.537
 1018   2HG   GLU 156          2HG       GLU 156  -6.863   3.031  -6.424
 1019    H    LYS 157           H        LYS 157  -7.320   7.389  -4.484
 1020    HA   LYS 157           HA       LYS 157  -9.860   8.294  -3.496
 1021   1HB   LYS 157          1HB       LYS 157  -7.656   8.430  -2.312
 1022   2HB   LYS 157          2HB       LYS 157  -7.178   9.720  -3.432
 1023   1HG   LYS 157          1HG       LYS 157  -8.764  11.246  -2.543
 1024   2HG   LYS 157          2HG       LYS 157  -9.605   9.982  -1.644
 1025   1HD   LYS 157          1HD       LYS 157  -8.104  11.479  -0.238
 1026   2HD   LYS 157          2HD       LYS 157  -7.860   9.746  -0.071
 1027   1HE   LYS 157          1HE       LYS 157  -5.686  10.695  -0.093
 1028   2HE   LYS 157          2HE       LYS 157  -5.906   9.880  -1.638
 1029   1HZ   LYS 157          1HZ       LYS 157  -6.549  12.197  -2.497
 1030   2HZ   LYS 157          2HZ       LYS 157  -5.823  12.783  -1.121
 1031   3HZ   LYS 157          3HZ       LYS 157  -5.004  11.895  -2.236
 1032    H    VAL 158           H        VAL 158  -7.890   9.298  -6.281
 1033    HA   VAL 158           HA       VAL 158  -9.096  11.864  -6.773
 1034    HB   VAL 158           HB       VAL 158  -8.017   9.849  -8.826
 1035   1HG1  VAL 158          1HG1      VAL 158  -9.329  11.696  -9.873
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.368  12.858  -8.916
 1037   3HG1  VAL 158          3HG1      VAL 158  -7.594  11.892 -10.181
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.765  12.224  -7.430
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.226  10.542  -7.196
 1040   3HG2  VAL 158          3HG2      VAL 158  -5.979  11.368  -8.764
 1041    H    HIS 159           H        HIS 159 -10.047   8.534  -7.727
 1042    HA   HIS 159           HA       HIS 159 -12.369   9.451  -9.249
 1043   1HB   HIS 159          1HB       HIS 159 -11.481   6.694  -8.277
 1044   2HB   HIS 159          2HB       HIS 159 -12.916   6.984  -9.273
 1045    HD1  HIS 159           HD1      HIS 159 -12.147   8.659 -11.600
 1046    HD2  HIS 159           HD2      HIS 159  -9.363   6.133  -9.702
 1047    HE1  HIS 159           HE1      HIS 159 -10.175   8.415 -13.204
 1048    H    ALA 160           H        ALA 160 -11.698   8.457  -5.910
 1049    HA   ALA 160           HA       ALA 160 -14.466   8.123  -5.112
 1050   1HB   ALA 160          1HB       ALA 160 -12.493   7.186  -3.862
 1051   2HB   ALA 160          2HB       ALA 160 -12.047   8.846  -3.394
 1052   3HB   ALA 160          3HB       ALA 160 -13.579   8.150  -2.842
 1053    H    GLY 161           H        GLY 161 -12.258  10.892  -5.444
 1054   1HA   GLY 161          1HA       GLY 161 -12.951  13.131  -5.711
 1055   2HA   GLY 161          2HA       GLY 161 -14.534  12.719  -5.087
 1056    H    TYR 162           H        TYR 162 -13.561  15.015  -4.218
 1057    HA   TYR 162           HA       TYR 162 -12.543  14.437  -1.458
 1058   1HB   TYR 162          1HB       TYR 162 -11.976  16.784  -3.295
 1059   2HB   TYR 162          2HB       TYR 162 -11.453  16.686  -1.596
 1060    HD1  TYR 162           HD1      TYR 162  -9.542  15.349  -0.991
 1061    HD2  TYR 162           HD2      TYR 162 -11.134  15.200  -5.002
 1062    HE1  TYR 162           HE1      TYR 162  -7.579  14.041  -1.737
 1063    HE2  TYR 162           HE2      TYR 162  -9.396  13.626  -5.655
 1064    HH   TYR 162           HH       TYR 162  -7.114  13.001  -5.100
 1065    HA   PRO 163           HA       PRO 163 -16.572  16.440  -1.056
 1066   1HB   PRO 163          1HB       PRO 163 -17.465  15.117   1.171
 1067   2HB   PRO 163          2HB       PRO 163 -17.401  14.336  -0.434
 1068   1HG   PRO 163          1HG       PRO 163 -15.384  14.118   1.817
 1069   2HG   PRO 163          2HG       PRO 163 -16.100  12.802   0.837
 1070   1HD   PRO 163          1HD       PRO 163 -13.650  13.927   0.293
 1071   2HD   PRO 163          2HD       PRO 163 -14.725  13.292  -0.996
 1072    H    CYS 164           H        CYS 164 -17.161  18.241   0.061
 1073    HA   CYS 164           HA       CYS 164 -15.232  19.470   1.821
 1074   1HB   CYS 164          1HB       CYS 164 -16.985  20.533   0.168
 1075   2HB   CYS 164          2HB       CYS 164 -18.094  20.420   1.558
 1076    H    LYS 165           H        LYS 165 -15.251  19.828   3.975
 1077    HA   LYS 165           HA       LYS 165 -17.560  18.949   5.600
 1078   1HB   LYS 165          1HB       LYS 165 -15.709  17.078   5.343
 1079   2HB   LYS 165          2HB       LYS 165 -14.783  18.067   6.472
 1080   1HG   LYS 165          1HG       LYS 165 -16.676  17.869   8.117
 1081   2HG   LYS 165          2HG       LYS 165 -17.586  16.919   6.931
 1082   1HD   LYS 165          1HD       LYS 165 -15.781  15.210   6.931
 1083   2HD   LYS 165          2HD       LYS 165 -14.891  16.134   8.145
 1084   1HE   LYS 165          1HE       LYS 165 -17.707  15.004   8.514
 1085   2HE   LYS 165          2HE       LYS 165 -16.231  14.192   9.037
 1086   1HZ   LYS 165          1HZ       LYS 165 -15.776  16.082  10.505
 1087   2HZ   LYS 165          2HZ       LYS 165 -17.157  16.828  10.045
 1088   3HZ   LYS 165          3HZ       LYS 165 -17.222  15.418  10.862
 1089    H    LYS 166           H        LYS 166 -15.740  21.395   4.687
 1090    HA   LYS 166           HA       LYS 166 -14.654  22.500   7.151
 1091   1HB   LYS 166          1HB       LYS 166 -15.547  23.769   4.552
 1092   2HB   LYS 166          2HB       LYS 166 -14.738  24.670   5.831
 1093   1HG   LYS 166          1HG       LYS 166 -13.500  22.256   4.433
 1094   2HG   LYS 166          2HG       LYS 166 -13.292  23.928   3.906
 1095   1HD   LYS 166          1HD       LYS 166 -12.175  24.563   5.920
 1096   2HD   LYS 166          2HD       LYS 166 -12.507  22.989   6.685
 1097   1HE   LYS 166          1HE       LYS 166 -11.160  21.859   4.934
 1098   2HE   LYS 166          2HE       LYS 166 -10.814  23.420   4.186
 1099   1HZ   LYS 166          1HZ       LYS 166 -10.010  22.623   6.937
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.013  22.701   5.650
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.678  24.070   6.251
 1102    H    ASP 167           H        ASP 167 -17.880  22.280   5.798
 1103    HA   ASP 167           HA       ASP 167 -18.951  23.532   8.251
 1104   1HB   ASP 167          1HB       ASP 167 -18.718  25.373   6.477
 1105   2HB   ASP 167          2HB       ASP 167 -19.917  24.500   5.523
 1106    H    ASP 168           H        ASP 168 -20.975  22.730   8.829
 1107    HA   ASP 168           HA       ASP 168 -21.656  20.150   7.862
 1108   1HB   ASP 168          1HB       ASP 168 -22.146  21.032  10.144
 1109   2HB   ASP 168          2HB       ASP 168 -23.362  22.110   9.461
 1110    H    SER 169           H        SER 169 -22.788  23.372   6.878
 1111    HA   SER 169           HA       SER 169 -25.072  22.242   5.362
 1112   1HB   SER 169          1HB       SER 169 -25.704  24.543   4.983
 1113   2HB   SER 169          2HB       SER 169 -25.300  24.345   6.688
 1114    HG   SER 169           HG       SER 169 -23.216  25.268   6.213
 1115    H    CYS 170           H        CYS 170 -22.018  21.946   4.664
 1116    HA   CYS 170           HA       CYS 170 -22.127  23.009   1.866
 1117   1HB   CYS 170          1HB       CYS 170 -20.049  23.209   3.583
 1118   2HB   CYS 170          2HB       CYS 170 -19.700  21.600   2.973
 1119    H    SER 171           H        SER 171 -21.547  21.479   0.121
 1120    HA   SER 171           HA       SER 171 -21.867  18.586   0.709
 1121   1HB   SER 171          1HB       SER 171 -23.814  18.367  -0.809
 1122   2HB   SER 171          2HB       SER 171 -24.184  19.375   0.594
 1123    HG   SER 171           HG       SER 171 -24.949  20.310  -1.362
 1124    H    PHE 172           H        PHE 172 -20.186  20.896  -0.861
 1125    HA   PHE 172           HA       PHE 172 -20.067  20.003  -3.587
 1126   1HB   PHE 172          1HB       PHE 172 -19.229  22.176  -3.075
 1127   2HB   PHE 172          2HB       PHE 172 -18.225  21.578  -1.767
 1128    HD1  PHE 172           HD1      PHE 172 -16.107  20.409  -2.158
 1129    HD2  PHE 172           HD2      PHE 172 -18.426  21.940  -5.442
 1130    HE1  PHE 172           HE1      PHE 172 -14.177  20.081  -3.667
 1131    HE2  PHE 172           HE2      PHE 172 -16.424  21.790  -6.919
 1132    HZ   PHE 172           HZ       PHE 172 -14.280  20.902  -6.017
 1133    H    VAL 173           H        VAL 173 -18.789  18.496  -4.617
 1134    HA   VAL 173           HA       VAL 173 -16.685  17.116  -3.007
 1135    HB   VAL 173           HB       VAL 173 -18.521  15.770  -5.024
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.365  13.676  -4.287
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.167  14.772  -4.965
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.319  14.611  -3.210
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.445  15.716  -1.981
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.813  16.069  -3.041
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.203  14.415  -2.941
 1142    H    GLY 174           H        GLY 174 -14.752  17.442  -3.858
 1143   1HA   GLY 174          1HA       GLY 174 -14.545  18.538  -6.592
 1144   2HA   GLY 174          2HA       GLY 174 -13.225  18.322  -5.426
 1145    H    LYS 175           H        LYS 175 -13.985  17.487  -8.424
 1146    HA   LYS 175           HA       LYS 175 -13.672  14.648  -8.504
 1147   1HB   LYS 175          1HB       LYS 175 -14.481  16.121 -10.374
 1148   2HB   LYS 175          2HB       LYS 175 -12.838  16.704 -10.602
 1149   1HG   LYS 175          1HG       LYS 175 -13.472  15.050 -12.265
 1150   2HG   LYS 175          2HG       LYS 175 -12.091  14.498 -11.330
 1151   1HD   LYS 175          1HD       LYS 175 -13.538  13.005 -10.003
 1152   2HD   LYS 175          2HD       LYS 175 -14.978  13.601 -10.838
 1153   1HE   LYS 175          1HE       LYS 175 -12.623  12.183 -12.173
 1154   2HE   LYS 175          2HE       LYS 175 -14.092  11.370 -11.619
 1155   1HZ   LYS 175          1HZ       LYS 175 -15.373  12.753 -13.169
 1156   2HZ   LYS 175          2HZ       LYS 175 -14.010  13.477 -13.713
 1157   3HZ   LYS 175          3HZ       LYS 175 -14.249  11.887 -13.970
 1158    H    THR 176           H        THR 176 -11.385  17.127  -7.738
 1159    HA   THR 176           HA       THR 176  -9.261  15.103  -7.481
 1160    HB   THR 176           HB       THR 176  -7.727  17.121  -8.527
 1161    HG1  THR 176           HG1      THR 176  -8.961  18.335  -9.639
 1162   1HG2  THR 176          1HG2      THR 176  -7.412  14.773  -9.015
 1163   2HG2  THR 176          2HG2      THR 176  -8.882  14.765 -10.036
 1164   3HG2  THR 176          3HG2      THR 176  -7.484  15.705 -10.528
 1165    H    TRP 177           H        TRP 177  -7.394  15.931  -6.259
 1166    HA   TRP 177           HA       TRP 177  -8.222  17.175  -3.896
 1167   1HB   TRP 177          1HB       TRP 177  -6.269  15.788  -3.976
 1168   2HB   TRP 177          2HB       TRP 177  -5.488  16.822  -5.150
 1169    HD1  TRP 177           HD1      TRP 177  -3.520  17.792  -4.145
 1170    HE1  TRP 177           HE1      TRP 177  -2.827  18.966  -1.963
 1171    HE3  TRP 177           HE3      TRP 177  -7.778  16.991  -1.491
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.688  18.681   0.777
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.730  17.228   0.976
 1174    HH2  TRP 177           HH2      TRP 177  -5.672  18.000   2.121
 1175    H    THR 178           H        THR 178  -6.541  18.669  -6.725
 1176    HA   THR 178           HA       THR 178  -6.146  21.256  -5.653
 1177    HB   THR 178           HB       THR 178  -6.480  22.020  -8.087
 1178    HG1  THR 178           HG1      THR 178  -6.200  19.442  -8.971
 1179   1HG2  THR 178          1HG2      THR 178  -4.391  19.881  -7.636
 1180   2HG2  THR 178          2HG2      THR 178  -4.403  21.107  -8.914
 1181   3HG2  THR 178          3HG2      THR 178  -4.254  21.598  -7.218
 1182    H    LEU 179           H        LEU 179  -9.004  19.993  -7.462
 1183    HA   LEU 179           HA       LEU 179 -10.455  22.402  -7.489
 1184   1HB   LEU 179          1HB       LEU 179 -11.530  19.545  -7.382
 1185   2HB   LEU 179          2HB       LEU 179 -12.459  20.974  -7.834
 1186    HG   LEU 179           HG       LEU 179 -10.106  19.790  -9.330
 1187   1HD1  LEU 179          1HD1      LEU 179 -13.048  20.067 -10.065
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.773  19.327 -11.064
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.230  18.582  -9.527
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.648  21.460 -11.119
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.748  22.276  -9.986
 1192   3HD2  LEU 179          3HD2      LEU 179  -9.998  22.208  -9.663
 1193    H    TYR 180           H        TYR 180 -10.238  19.924  -4.930
 1194    HA   TYR 180           HA       TYR 180 -12.375  21.052  -3.307
 1195   1HB   TYR 180          1HB       TYR 180 -11.900  18.848  -2.859
 1196   2HB   TYR 180          2HB       TYR 180 -10.150  19.055  -2.863
 1197    HD1  TYR 180           HD1      TYR 180 -13.203  20.210  -0.960
 1198    HD2  TYR 180           HD2      TYR 180  -9.022  19.151  -0.807
 1199    HE1  TYR 180           HE1      TYR 180 -13.196  20.569   1.496
 1200    HE2  TYR 180           HE2      TYR 180  -9.051  19.407   1.673
 1201    HH   TYR 180           HH       TYR 180 -12.037  20.302   3.441
 1202    H    LEU 181           H        LEU 181  -8.776  21.186  -3.186
 1203    HA   LEU 181           HA       LEU 181  -8.570  22.982  -1.025
 1204   1HB   LEU 181          1HB       LEU 181  -6.834  22.541  -3.488
 1205   2HB   LEU 181          2HB       LEU 181  -6.406  23.678  -2.244
 1206    HG   LEU 181           HG       LEU 181  -6.775  20.648  -1.909
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.720  20.980  -2.999
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.360  22.473  -2.077
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.282  20.896  -1.291
 1210   1HD2  LEU 181          1HD2      LEU 181  -7.457  21.537   0.179
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.800  21.000   0.404
 1212   3HD2  LEU 181          3HD2      LEU 181  -6.155  22.741   0.181
 1213    H    LYS 182           H        LYS 182  -8.980  23.702  -4.527
 1214    HA   LYS 182           HA       LYS 182  -8.848  26.577  -4.288
 1215   1HB   LYS 182          1HB       LYS 182  -9.943  24.643  -6.344
 1216   2HB   LYS 182          2HB       LYS 182 -10.315  26.348  -6.496
 1217   1HG   LYS 182          1HG       LYS 182  -7.490  25.239  -6.247
 1218   2HG   LYS 182          2HG       LYS 182  -8.285  25.592  -7.779
 1219   1HD   LYS 182          1HD       LYS 182  -7.450  27.572  -5.625
 1220   2HD   LYS 182          2HD       LYS 182  -6.763  27.399  -7.226
 1221   1HE   LYS 182          1HE       LYS 182  -9.627  28.302  -6.660
 1222   2HE   LYS 182          2HE       LYS 182  -8.266  29.392  -6.912
 1223   1HZ   LYS 182          1HZ       LYS 182  -9.127  27.421  -8.959
 1224   2HZ   LYS 182          2HZ       LYS 182  -9.570  28.996  -8.951
 1225   3HZ   LYS 182          3HZ       LYS 182  -8.004  28.610  -9.140
 1226    H    HIS 183           H        HIS 183 -11.601  24.259  -4.197
 1227    HA   HIS 183           HA       HIS 183 -13.679  26.211  -3.924
 1228   1HB   HIS 183          1HB       HIS 183 -14.292  23.960  -4.449
 1229   2HB   HIS 183          2HB       HIS 183 -13.420  23.293  -3.082
 1230    HD1  HIS 183           HD1      HIS 183 -16.727  25.147  -3.783
 1231    HD2  HIS 183           HD2      HIS 183 -14.566  23.299  -0.679
 1232    HE1  HIS 183           HE1      HIS 183 -18.298  25.038  -1.771
 1233    H    VAL 184           H        VAL 184 -11.617  24.532  -1.512
 1234    HA   VAL 184           HA       VAL 184 -12.862  25.611   0.831
 1235    HB   VAL 184           HB       VAL 184 -10.152  24.427   0.208
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.616  26.098   1.916
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.954  25.492   2.937
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.543  24.458   2.557
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.611  23.658   1.825
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.964  22.889   0.367
 1241   3HG2  VAL 184          3HG2      VAL 184 -11.055  22.742   1.857
 1242    H    ALA 185           H        ALA 185 -10.095  26.723  -1.152
 1243    HA   ALA 185           HA       ALA 185  -9.368  28.869   0.533
 1244   1HB   ALA 185          1HB       ALA 185  -7.912  27.976  -1.253
 1245   2HB   ALA 185          2HB       ALA 185  -9.038  28.556  -2.493
 1246   3HB   ALA 185          3HB       ALA 185  -8.165  29.717  -1.469
 1247    H    GLU 186           H        GLU 186 -11.786  28.633  -2.075
 1248    HA   GLU 186           HA       GLU 186 -12.239  31.549  -2.108
 1249   1HB   GLU 186          1HB       GLU 186 -13.431  29.214  -3.654
 1250   2HB   GLU 186          2HB       GLU 186 -13.969  30.876  -3.871
 1251   1HG   GLU 186          1HG       GLU 186 -11.084  29.977  -4.289
 1252   2HG   GLU 186          2HG       GLU 186 -12.290  30.070  -5.563
 1253    H    CYS 187           H        CYS 187 -13.701  28.708  -0.602
 1254    HA   CYS 187           HA       CYS 187 -16.220  30.252  -0.085
 1255   1HB   CYS 187          1HB       CYS 187 -16.181  28.054  -1.451
 1256   2HB   CYS 187          2HB       CYS 187 -15.907  27.232   0.091
 1257    HG   CYS 187           HG       CYS 187 -17.995  28.354   1.303
 1258    H    HIS 188           H        HIS 188 -13.509  28.713   1.571
 1259    HA   HIS 188           HA       HIS 188 -14.911  29.172   4.190
 1260   1HB   HIS 188          1HB       HIS 188 -13.125  26.802   3.500
 1261   2HB   HIS 188          2HB       HIS 188 -13.870  27.121   5.071
 1262    HD1  HIS 188           HD1      HIS 188 -16.751  27.157   4.942
 1263    HD2  HIS 188           HD2      HIS 188 -14.490  25.380   1.883
 1264    HE1  HIS 188           HE1      HIS 188 -18.344  25.577   3.710
 1265    H    GLN 189           H        GLN 189 -12.458  30.262   2.301
 1266    HA   GLN 189           HA       GLN 189 -10.904  31.143   4.696
 1267   1HB   GLN 189          1HB       GLN 189  -9.624  30.176   2.110
 1268   2HB   GLN 189          2HB       GLN 189  -8.776  30.848   3.496
 1269   1HG   GLN 189          1HG       GLN 189  -9.579  28.952   4.900
 1270   2HG   GLN 189          2HG       GLN 189 -10.272  28.197   3.465
 1271   1HE2  GLN 189          1HE2      GLN 189  -7.986  27.357   5.336
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.660  27.012   4.231
 1273    H    ASP 190           H        ASP 190 -12.937  32.202   2.532
 1274    HA   ASP 190           HA       ASP 190 -11.685  34.853   2.322
 1275   1HB   ASP 190          1HB       ASP 190 -10.895  33.696   0.250
 1276   2HB   ASP 190          2HB       ASP 190 -12.571  33.364  -0.194
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  -7.132  31.056 -13.597
    2   2H5*    G   1          2H5*        G   1  -8.175  29.634 -13.466
    3    H4*    G   1           H4*        G   1  -7.195  29.695 -15.646
    4    H3*    G   1           H3*        G   1  -5.892  27.543 -13.960
    5    H2*    G   1           H2*        G   1  -4.911  26.804 -16.072
    6   2HO*    G   1          2HO*        G   1  -6.912  27.528 -17.333
    7    H1*    G   1           H1*        G   1  -4.104  29.306 -16.727
    8    H8     G   1           H8         G   1  -3.809  29.377 -12.977
    9    H1     G   1           H1         G   1   0.989  26.270 -15.921
   10   1H2     G   1          1H2         G   1   0.369  25.633 -17.905
   11   2H2     G   1          2H2         G   1  -1.126  26.221 -18.625
   12   1H5*    G   2          1H5*        G   2  -7.204  25.534 -17.391
   13   2H5*    G   2          2H5*        G   2  -7.986  24.009 -16.973
   14    H4*    G   2           H4*        G   2  -6.247  23.669 -18.638
   15    H3*    G   2           H3*        G   2  -5.540  22.518 -15.921
   16    H2*    G   2           H2*        G   2  -3.721  21.411 -17.093
   17   2HO*    G   2          2HO*        G   2  -5.096  21.185 -19.139
   18    H1*    G   2           H1*        G   2  -2.956  23.682 -18.373
   19    H8     G   2           H8         G   2  -4.222  24.950 -15.041
   20    H1     G   2           H1         G   2   1.585  22.199 -14.717
   21   1H2     G   2          1H2         G   2   1.909  20.948 -16.444
   22   2H2     G   2          2H2         G   2   0.798  20.932 -17.801
   23   1H5*    G   3          1H5*        G   3  -5.153  19.242 -18.508
   24   2H5*    G   3          2H5*        G   3  -5.950  17.813 -17.839
   25    H4*    G   3           H4*        G   3  -3.631  17.316 -18.428
   26    H3*    G   3           H3*        G   3  -4.172  17.382 -15.442
   27    H2*    G   3           H2*        G   3  -1.987  16.371 -15.224
   28   2HO*    G   3          2HO*        G   3  -2.299  15.069 -17.282
   29    H1*    G   3           H1*        G   3  -0.828  18.080 -17.023
   30    H8     G   3           H8         G   3  -3.386  20.149 -15.111
   31    H1     G   3           H1         G   3   2.178  19.254 -12.001
   32   1H2     G   3          1H2         G   3   3.240  17.574 -12.848
   33   2H2     G   3          2H2         G   3   2.705  16.792 -14.324
   34   1H5*    C   4          1H5*        C   4  -2.734  13.486 -15.897
   35   2H5*    C   4          2H5*        C   4  -3.697  12.342 -14.960
   36    H4*    C   4           H4*        C   4  -1.332  12.218 -14.338
   37    H3*    C   4           H3*        C   4  -3.133  13.319 -12.168
   38    H2*    C   4           H2*        C   4  -1.206  13.468 -10.768
   39   2HO*    C   4          2HO*        C   4  -0.449  11.288 -11.702
   40    H1*    C   4           H1*        C   4   0.595  14.231 -12.752
   41   1H4     C   4          1H4         C   4  -1.253  19.221  -9.226
   42   2H4     C   4          2H4         C   4  -2.744  19.354 -10.127
   43    H5     C   4           H5         C   4  -3.347  17.846 -11.895
   44    H6     C   4           H6         C   4  -2.659  15.850 -13.122
   45   1H5*    C   5          1H5*        C   5  -1.824  11.715  -9.188
   46   2H5*    C   5          2H5*        C   5  -2.935  10.554  -8.452
   47    H4*    C   5           H4*        C   5  -2.340  12.458  -7.003
   48    H3*    C   5           H3*        C   5  -4.854  11.345  -7.015
   49    H2*    C   5           H2*        C   5  -5.659  12.920  -8.666
   50   2HO*    C   5          2HO*        C   5  -6.937  13.143  -6.548
   51    H1*    C   5           H1*        C   5  -4.422  15.108  -7.058
   52   1H4     C   5          1H4         C   5  -6.291  18.528 -12.040
   53   2H4     C   5          2H4         C   5  -6.053  17.188 -13.143
   54    H5     C   5           H5         C   5  -5.266  15.061 -12.423
   55    H6     C   5           H6         C   5  -4.745  13.682 -10.478
   56   1H5*    A   6          1H5*        A   6  -2.561  14.337  -4.765
   57   2H5*    A   6          2H5*        A   6  -1.433  12.993  -4.626
   58    H4*    A   6           H4*        A   6  -0.566  14.921  -3.687
   59    H3*    A   6           H3*        A   6  -1.095  12.762  -1.697
   60    H2*    A   6           H2*        A   6  -0.510  14.217   0.151
   61   2HO*    A   6          2HO*        A   6   1.259  15.356  -0.458
   62    H1*    A   6           H1*        A   6  -1.722  16.470  -0.702
   63    H8     A   6           H8         A   6  -4.376  14.497  -2.050
   64   1H6     A   6          1H6         A   6  -6.288  13.195   3.712
   65   2H6     A   6          2H6         A   6  -6.658  13.038   2.013
   66    H2     A   6           H2         A   6  -2.317  15.155   4.019
   67   1H5*    U   7          1H5*        U   7   2.468  11.771   0.670
   68   2H5*    U   7          2H5*        U   7   1.641  13.197   0.070
   69    H4*    U   7           H4*        U   7   3.450  13.826   1.501
   70    H3*    U   7           H3*        U   7   3.015  15.038  -0.964
   71    H2*    U   7           H2*        U   7   4.684  13.740  -2.043
   72   2HO*    U   7          2HO*        U   7   5.724  16.198  -1.115
   73    H1*    U   7           H1*        U   7   6.493  14.133   0.377
   74    H3     U   7           H3         U   7   9.884  11.992  -1.636
   75    H5     U   7           H5         U   7   6.772   9.197  -1.630
   76    H6     U   7           H6         U   7   5.224  10.995  -1.009
   77   1H5*    A   8          1H5*        A   8   4.110  18.720  -1.052
   78   2H5*    A   8          2H5*        A   8   3.487  19.570   0.363
   79    H4*    A   8           H4*        A   8   2.819  20.815  -1.505
   80    H3*    A   8           H3*        A   8   0.924  19.988   0.260
   81    H2*    A   8           H2*        A   8   0.310  18.097  -1.120
   82   2HO*    A   8          2HO*        A   8  -1.666  19.205  -0.558
   83    H1*    A   8           H1*        A   8   0.250  20.110  -3.366
   84    H8     A   8           H8         A   8   2.127  16.765  -3.379
   85   1H6     A   8          1H6         A   8  -1.738  15.282  -7.988
   86   2H6     A   8          2H6         A   8  -0.192  14.938  -7.254
   87    H2     A   8           H2         A   8  -3.331  18.921  -5.991
   88   1H5*    C   9          1H5*        C   9  -2.245  21.631  -0.601
   89   2H5*    C   9          2H5*        C   9  -2.467  23.138   0.297
   90    H4*    C   9           H4*        C   9  -4.157  21.604   0.957
   91    H3*    C   9           H3*        C   9  -2.113  22.070   3.113
   92    H2*    C   9           H2*        C   9  -3.390  20.575   4.523
   93   2HO*    C   9          2HO*        C   9  -5.465  21.422   3.281
   94    H1*    C   9           H1*        C   9  -3.801  18.649   2.679
   95   1H4     C   9          1H4         C   9   1.861  17.302   5.392
   96   2H4     C   9          2H4         C   9   2.617  17.749   3.871
   97    H5     C   9           H5         C   9   1.465  19.004   2.199
   98    H6     C   9           H6         C   9  -0.712  19.802   1.462
   99   1H5*    C  10          1H5*        C  10  -5.537  22.143   5.173
  100   2H5*    C  10          2H5*        C  10  -5.749  23.536   6.226
  101    H4*    C  10           H4*        C  10  -5.871  21.419   7.486
  102    H3*    C  10           H3*        C  10  -3.438  23.137   8.099
  103    H2*    C  10           H2*        C  10  -2.997  21.601   9.892
  104   2HO*    C  10          2HO*        C  10  -5.335  21.254  10.388
  105    H1*    C  10           H1*        C  10  -3.388  19.363   8.325
  106   1H4     C  10          1H4         C  10   2.768  20.117   7.471
  107   2H4     C  10          2H4         C  10   2.436  20.856   5.920
  108    H5     C  10           H5         C  10   0.244  21.564   5.243
  109    H6     C  10           H6         C  10  -2.112  21.628   5.902
  110   1H5*    U  11          1H5*        U  11  -4.331  23.649  11.939
  111   2H5*    U  11          2H5*        U  11  -3.950  25.339  12.310
  112    H4*    U  11           H4*        U  11  -2.341  23.596  13.196
  113    H3*    U  11           H3*        U  11  -1.273  25.719  11.342
  114    H2*    U  11           H2*        U  11   0.900  24.955  12.002
  115   2HO*    U  11          2HO*        U  11   0.079  24.556  14.314
  116    H1*    U  11           H1*        U  11   0.224  22.288  11.854
  117    H3     U  11           H3         U  11   3.099  23.189   8.394
  118    H5     U  11           H5         U  11  -0.542  24.793   7.091
  119    H6     U  11           H6         U  11  -1.497  24.272   9.291
  120   1H5*    C  12          1H5*        C  12   1.232  26.825  14.854
  121   2H5*    C  12          2H5*        C  12   1.993  28.275  14.198
  122    H4*    C  12           H4*        C  12   2.657  25.365  13.813
  123    H3*    C  12           H3*        C  12   3.932  27.410  15.107
  124    H2*    C  12           H2*        C  12   4.082  28.784  13.140
  125   2HO*    C  12          2HO*        C  12   6.425  27.592  13.941
  126    H1*    C  12           H1*        C  12   5.100  26.336  11.659
  127   1H4     C  12          1H4         C  12   4.907  30.689   7.011
  128   2H4     C  12          2H4         C  12   3.259  31.115   7.398
  129    H5     C  12           H5         C  12   2.046  30.137   9.224
  130    H6     C  12           H6         C  12   2.175  28.527  11.071
  131   1H5*    U  13          1H5*        U  13   4.821  22.931  15.404
  132   2H5*    U  13          2H5*        U  13   5.655  22.913  16.959
  133    H4*    U  13           H4*        U  13   6.408  20.923  16.197
  134    H3*    U  13           H3*        U  13   8.469  22.755  15.965
  135    H2*    U  13           H2*        U  13   7.972  23.337  13.710
  136   2HO*    U  13          2HO*        U  13   9.944  21.319  13.854
  137    H1*    U  13           H1*        U  13   7.616  20.413  13.008
  138    H3     U  13           H3         U  13   6.901  21.751   8.734
  139    H5     U  13           H5         U  13   4.371  24.256  10.924
  140    H6     U  13           H6         U  13   5.308  23.314  12.990
  141   1H5*    U  14          1H5*        U  14  10.061  17.648  16.722
  142   2H5*    U  14          2H5*        U  14  11.785  17.938  16.485
  143    H4*    U  14           H4*        U  14   9.554  18.537  14.490
  144    H3*    U  14           H3*        U  14  11.905  16.590  14.559
  145    H2*    U  14           H2*        U  14  12.025  16.766  12.214
  146   2HO*    U  14          2HO*        U  14   9.612  16.650  12.015
  147    H1*    U  14           H1*        U  14  11.352  19.485  12.073
  148    H3     U  14           H3         U  14  15.614  19.293  10.434
  149    H5     U  14           H5         U  14  16.121  18.511  14.513
  150    H6     U  14           H6         U  14  13.678  18.530  14.769
  151   1H5*    G  15          1H5*        G  15   6.980  14.039  14.930
  152   2H5*    G  15          2H5*        G  15   7.359  15.446  13.934
  153    H4*    G  15           H4*        G  15   5.773  15.643  16.528
  154    H3*    G  15           H3*        G  15   4.944  15.110  13.661
  155    H2*    G  15           H2*        G  15   2.878  16.275  14.156
  156   2HO*    G  15          2HO*        G  15   2.870  15.504  16.486
  157    H1*    G  15           H1*        G  15   4.156  18.398  15.215
  158    H8     G  15           H8         G  15   6.805  17.493  12.782
  159    H1     G  15           H1         G  15   1.548  19.806   9.897
  160   1H2     G  15          1H2         G  15  -0.143  19.672  11.234
  161   2H2     G  15          2H2         G  15   0.050  19.318  12.938
  162   1H5*    G  16          1H5*        G  16   1.356  14.151  15.603
  163   2H5*    G  16          2H5*        G  16   0.791  12.550  15.106
  164    H4*    G  16           H4*        G  16  -0.965  14.199  14.804
  165    H3*    G  16           H3*        G  16   0.191  13.162  12.202
  166    H2*    G  16           H2*        G  16  -1.655  14.306  11.135
  167   2HO*    G  16          2HO*        G  16  -3.175  13.829  12.985
  168    H1*    G  16           H1*        G  16  -1.285  16.612  12.515
  169    H8     G  16           H8         G  16   2.269  15.547  12.249
  170    H1     G  16           H1         G  16  -0.164  16.954   6.497
  171   1H2     G  16          1H2         G  16  -2.307  17.293   6.625
  172   2H2     G  16          2H2         G  16  -3.190  16.959   8.102
  173   1H5*    G  17          1H5*        G  17  -3.680  12.281  11.288
  174   2H5*    G  17          2H5*        G  17  -3.797  10.665  10.574
  175    H4*    G  17           H4*        G  17  -4.570  12.424   9.040
  176    H3*    G  17           H3*        G  17  -2.049  11.007   8.132
  177    H2*    G  17           H2*        G  17  -2.345  12.248   6.046
  178   2HO*    G  17          2HO*        G  17  -4.759  12.182   6.210
  179    H1*    G  17           H1*        G  17  -2.586  14.602   7.261
  180    H8     G  17           H8         G  17  -0.421  13.002   9.815
  181    H1     G  17           H1         G  17   2.699  14.724   4.472
  182   1H2     G  17          1H2         G  17   1.277  15.139   2.877
  183   2H2     G  17          2H2         G  17  -0.442  14.854   3.077
  184   1H5*    C  18          1H5*        C  18  -3.865  10.473   4.682
  185   2H5*    C  18          2H5*        C  18  -3.767   8.806   4.088
  186    H4*    C  18           H4*        C  18  -2.654  10.257   2.518
  187    H3*    C  18           H3*        C  18  -0.585   8.729   4.149
  188    H2*    C  18           H2*        C  18   0.989   9.584   2.471
  189   2HO*    C  18          2HO*        C  18  -0.137   9.872   0.524
  190    H1*    C  18           H1*        C  18   0.186  12.087   2.876
  191   1H4     C  18          1H4         C  18   4.251  10.929   7.633
  192   2H4     C  18          2H4         C  18   2.901  10.626   8.698
  193    H5     C  18           H5         C  18   0.617  10.600   7.957
  194    H6     C  18           H6         C  18  -0.827  10.756   6.000
  195   1H5*    C  19          1H5*        C  19   0.742   7.944   0.516
  196   2H5*    C  19          2H5*        C  19   1.103   6.227   0.274
  197    H4*    C  19           H4*        C  19   2.999   7.587  -0.333
  198    H3*    C  19           H3*        C  19   3.546   6.077   2.227
  199    H2*    C  19           H2*        C  19   5.853   6.696   1.737
  200   2HO*    C  19          2HO*        C  19   5.602   6.557  -0.647
  201    H1*    C  19           H1*        C  19   5.192   9.316   1.341
  202   1H4     C  19          1H4         C  19   6.189   8.315   7.596
  203   2H4     C  19          2H4         C  19   4.501   7.920   7.824
  204    H5     C  19           H5         C  19   2.928   7.766   6.020
  205    H6     C  19           H6         C  19   2.642   8.025   3.601
  206   1H5*    U  20          1H5*        U  20   6.390   4.734  -0.501
  207   2H5*    U  20          2H5*        U  20   6.524   2.971  -0.494
  208    H4*    U  20           H4*        U  20   8.708   4.009  -0.265
  209    H3*    U  20           H3*        U  20   7.767   2.643   2.266
  210    H2*    U  20           H2*        U  20  10.082   2.887   2.991
  211   2HO*    U  20          2HO*        U  20  10.973   2.684   0.720
  212    H1*    U  20           H1*        U  20  10.106   5.510   2.378
  213    H3     U  20           H3         U  20   9.379   5.078   6.912
  214    H5     U  20           H5         U  20   5.562   5.200   5.215
  215    H6     U  20           H6         U  20   6.599   5.005   3.000
  216   1H5*    G  21          1H5*        G  21  11.316   0.865   1.104
  217   2H5*    G  21          2H5*        G  21  11.344  -0.884   1.316
  218    H4*    G  21           H4*        G  21  13.284   0.166   2.368
  219    H3*    G  21           H3*        G  21  11.289  -1.018   4.319
  220    H2*    G  21           H2*        G  21  12.989  -0.619   6.013
  221   2HO*    G  21          2HO*        G  21  14.790  -1.024   4.331
  222    H1*    G  21           H1*        G  21  13.427   1.936   5.211
  223    H8     G  21           H8         G  21   9.748   1.388   4.465
  224    H1     G  21           H1         G  21  10.993   2.253  10.714
  225   1H2     G  21          1H2         G  21  13.094   1.956  11.099
  226   2H2     G  21          2H2         G  21  14.254   1.722   9.807
  227   1H5*    G  22          1H5*        G  22  14.852  -2.746   5.338
  228   2H5*    G  22          2H5*        G  22  14.730  -4.490   5.557
  229    H4*    G  22           H4*        G  22  15.739  -3.441   7.504
  230    H3*    G  22           H3*        G  22  12.966  -4.579   8.011
  231    H2*    G  22           H2*        G  22  13.328  -4.076  10.309
  232   2HO*    G  22          2HO*        G  22  15.605  -4.767  10.310
  233    H1*    G  22           H1*        G  22  14.509  -1.626   9.886
  234    H8     G  22           H8         G  22  11.672  -1.840   7.385
  235    H1     G  22           H1         G  22   9.689  -0.697  13.395
  236   1H2     G  22          1H2         G  22  11.259  -1.152  14.797
  237   2H2     G  22          2H2         G  22  12.869  -1.619  14.278
  238   1H5*    U  23          1H5*        U  23  12.708  -8.473  10.801
  239   2H5*    U  23          2H5*        U  23  11.765  -7.119  10.147
  240    H4*    U  23           H4*        U  23  13.232  -7.098  12.801
  241    H3*    U  23           H3*        U  23  10.301  -7.147  11.979
  242    H2*    U  23           H2*        U  23   9.859  -6.419  14.212
  243   2HO*    U  23          2HO*        U  23  11.697  -7.587  15.234
  244    H1*    U  23           H1*        U  23  11.715  -4.422  13.933
  245    H3     U  23           H3         U  23   7.244  -3.077  13.414
  246    H5     U  23           H5         U  23   8.660  -3.821   9.550
  247    H6     U  23           H6         U  23  10.742  -4.692  10.532
  248   1H5*    U  24          1H5*        U  24   9.811  -9.160  15.032
  249   2H5*    U  24          2H5*        U  24   9.072 -10.761  14.939
  250    H4*    U  24           H4*        U  24   7.761  -9.406  16.416
  251    H3*    U  24           H3*        U  24   6.434  -9.630  13.712
  252    H2*    U  24           H2*        U  24   4.467  -8.846  14.734
  253   2HO*    U  24          2HO*        U  24   4.725  -9.974  16.818
  254    H1*    U  24           H1*        U  24   5.864  -6.862  16.080
  255    H3     U  24           H3         U  24   3.304  -5.115  12.616
  256    H5     U  24           H5         U  24   6.891  -6.301  10.805
  257    H6     U  24           H6         U  24   7.613  -7.245  12.954
  258   1H5*    A  25          1H5*        A  25   4.978 -13.487  11.978
  259   2H5*    A  25          2H5*        A  25   6.690 -13.767  11.726
  260    H4*    A  25           H4*        A  25   5.765 -13.107   9.629
  261    H3*    A  25           H3*        A  25   7.905 -11.617  10.593
  262    H2*    A  25           H2*        A  25   6.407  -9.879  11.437
  263   2HO*    A  25          2HO*        A  25   8.067  -8.924  10.183
  264    H1*    A  25           H1*        A  25   5.120 -10.313   8.673
  265    H8     A  25           H8         A  25   3.595  -9.650  12.233
  266   1H6     A  25          1H6         A  25   0.669  -4.958   9.337
  267   2H6     A  25          2H6         A  25   0.657  -5.982  10.761
  268    H2     A  25           H2         A  25   3.697  -6.654   6.554
  269   1H5*    G  26          1H5*        G  26   7.974 -14.031   5.261
  270   2H5*    G  26          2H5*        G  26   7.898 -12.279   5.178
  271    H4*    G  26           H4*        G  26   5.954 -13.185   7.150
  272    H3*    G  26           H3*        G  26   6.226 -15.269   5.323
  273    H2*    G  26           H2*        G  26   6.068 -13.602   3.572
  274   2HO*    G  26          2HO*        G  26   3.617 -15.075   3.766
  275    H1*    G  26           H1*        G  26   3.549 -12.837   5.099
  276    H8     G  26           H8         G  26   5.494 -12.274   1.891
  277    H1     G  26           H1         G  26   0.737  -8.126   2.923
  278   1H2     G  26          1H2         G  26   0.481  -7.856   5.049
  279   2H2     G  26          2H2         G  26   1.162  -8.970   6.222
  280   1H5*    U  27          1H5*        U  27   4.852 -16.065   8.422
  281   2H5*    U  27          2H5*        U  27   4.121 -17.679   8.585
  282    H4*    U  27           H4*        U  27   3.806 -16.832  10.709
  283    H3*    U  27           H3*        U  27   1.294 -15.923   9.235
  284    H2*    U  27           H2*        U  27   0.638 -14.803  11.254
  285   2HO*    U  27          2HO*        U  27   1.756 -16.629  12.573
  286    H1*    U  27           H1*        U  27   3.005 -13.629  11.751
  287    H3     U  27           H3         U  27   0.371 -10.406   9.843
  288    H5     U  27           H5         U  27   3.075 -11.688   6.940
  289    H6     U  27           H6         U  27   3.459 -13.718   8.265
  290   1H5*    A  28          1H5*        A  28  -0.370 -16.463  12.863
  291   2H5*    A  28          2H5*        A  28  -1.655 -17.662  12.742
  292    H4*    A  28           H4*        A  28  -2.545 -15.648  13.733
  293    H3*    A  28           H3*        A  28  -3.509 -16.056  10.875
  294    H2*    A  28           H2*        A  28  -4.917 -14.120  11.242
  295   2HO*    A  28          2HO*        A  28  -5.261 -14.754  13.601
  296    H1*    A  28           H1*        A  28  -2.953 -12.632  12.385
  297    H8     A  28           H8         A  28  -0.859 -14.343   9.863
  298   1H6     A  28          1H6         A  28  -3.143 -10.286   5.731
  299   2H6     A  28          2H6         A  28  -1.905 -11.499   6.007
  300    H2     A  28           H2         A  28  -6.004 -10.574   9.105
  301   1H5*    C  29          1H5*        C  29  -7.037 -15.363  12.194
  302   2H5*    C  29          2H5*        C  29  -8.268 -16.527  11.689
  303    H4*    C  29           H4*        C  29  -8.747 -14.354  10.731
  304    H3*    C  29           H3*        C  29  -7.765 -16.338   8.667
  305    H2*    C  29           H2*        C  29  -8.289 -14.626   7.014
  306   2HO*    C  29          2HO*        C  29 -10.240 -13.866   8.276
  307    H1*    C  29           H1*        C  29  -7.089 -12.636   8.330
  308   1H4     C  29          1H4         C  29  -2.429 -15.233   4.850
  309   2H4     C  29          2H4         C  29  -1.918 -16.156   6.242
  310    H5     C  29           H5         C  29  -3.179 -16.286   8.269
  311    H6     C  29           H6         C  29  -5.176 -15.472   9.416
  312   1H5*    C  30          1H5*        C  30 -11.380 -15.213   6.974
  313   2H5*    C  30          2H5*        C  30 -12.260 -16.596   6.307
  314    H4*    C  30           H4*        C  30 -11.741 -14.935   4.578
  315    H3*    C  30           H3*        C  30 -10.143 -17.492   4.260
  316    H2*    C  30           H2*        C  30  -9.520 -16.578   2.096
  317   2HO*    C  30          2HO*        C  30 -11.741 -15.461   1.902
  318    H1*    C  30           H1*        C  30  -8.958 -14.112   3.147
  319   1H4     C  30          1H4         C  30  -3.707 -17.762   3.131
  320   2H4     C  30          2H4         C  30  -4.077 -18.344   4.740
  321    H5     C  30           H5         C  30  -6.086 -17.759   5.921
  322    H6     C  30           H6         C  30  -8.193 -16.520   5.757
  323   1H5*    U  31          1H5*        U  31 -12.245 -16.791   0.562
  324   2H5*    U  31          2H5*        U  31 -13.198 -18.198   0.094
  325    H4*    U  31           H4*        U  31 -12.099 -17.253  -1.839
  326    H3*    U  31           H3*        U  31 -10.891 -19.908  -1.039
  327    H2*    U  31           H2*        U  31  -9.679 -19.808  -3.103
  328   2HO*    U  31          2HO*        U  31 -11.551 -18.771  -4.278
  329    H1*    U  31           H1*        U  31  -8.956 -17.185  -2.806
  330    H3     U  31           H3         U  31  -5.173 -19.688  -1.945
  331    H5     U  31           H5         U  31  -7.139 -19.334   1.742
  332    H6     U  31           H6         U  31  -9.099 -18.454   0.561
  333   1H5*    C  32          1H5*        C  32 -12.053 -20.934  -4.685
  334   2H5*    C  32          2H5*        C  32 -12.818 -22.524  -4.800
  335    H4*    C  32           H4*        C  32 -10.763 -22.489  -6.096
  336    H3*    C  32           H3*        C  32 -10.433 -24.127  -3.561
  337    H2*    C  32           H2*        C  32  -8.250 -24.700  -4.416
  338   2HO*    C  32          2HO*        C  32  -9.189 -24.701  -6.741
  339    H1*    C  32           H1*        C  32  -7.660 -22.146  -5.271
  340   1H4     C  32          1H4         C  32  -5.236 -23.078   0.558
  341   2H4     C  32          2H4         C  32  -6.778 -22.728   1.302
  342    H5     C  32           H5         C  32  -8.763 -22.237   0.046
  343    H6     C  32           H6         C  32  -9.684 -22.051  -2.218
  344   1H5*    U  33          1H5*        U  33  -8.611 -26.609  -5.821
  345   2H5*    U  33          2H5*        U  33  -9.340 -28.215  -5.866
  346    H4*    U  33           H4*        U  33  -7.022 -28.479  -5.236
  347    H3*    U  33           H3*        U  33  -8.873 -28.736  -2.845
  348    H2*    U  33           H2*        U  33  -7.080 -29.255  -1.546
  349   2HO*    U  33          2HO*        U  33  -5.125 -29.654  -3.611
  350    H1*    U  33           H1*        U  33  -5.243 -27.601  -2.925
  351    H3     U  33           H3         U  33  -5.188 -26.289   1.454
  352    H5     U  33           H5         U  33  -9.095 -25.407   0.251
  353    H6     U  33           H6         U  33  -8.570 -26.330  -1.963
  354   1H5*    U  34          1H5*        U  34  -9.124 -34.384  -2.593
  355   2H5*    U  34          2H5*        U  34  -8.374 -33.550  -1.229
  356    H4*    U  34           H4*        U  34  -7.270 -35.675  -1.695
  357    H3*    U  34           H3*        U  34  -5.829 -33.404  -1.165
  358    H2*    U  34           H2*        U  34  -5.526 -32.832  -3.479
  359   2HO*    U  34          2HO*        U  34  -3.301 -34.399  -2.607
  360    H1*    U  34           H1*        U  34  -4.870 -35.766  -3.959
  361    H3     U  34           H3         U  34  -3.876 -34.941  -8.286
  362    H5     U  34           H5         U  34  -7.190 -32.466  -7.654
  363    H6     U  34           H6         U  34  -7.246 -33.227  -5.319
  364   1H5*    C  35          1H5*        C  35  -2.368 -33.730  -0.479
  365   2H5*    C  35          2H5*        C  35  -2.028 -34.742   0.926
  366    H4*    C  35           H4*        C  35  -0.964 -32.566   1.103
  367    H3*    C  35           H3*        C  35  -2.191 -33.755   3.237
  368    H2*    C  35           H2*        C  35  -4.302 -32.695   2.842
  369   2HO*    C  35          2HO*        C  35  -2.798 -31.158   4.709
  370    H1*    C  35           H1*        C  35  -2.889 -30.040   2.426
  371   1H4     C  35          1H4         C  35  -9.057 -28.913   1.207
  372   2H4     C  35          2H4         C  35  -9.064 -30.120  -0.067
  373    H5     C  35           H5         C  35  -7.202 -31.544  -0.500
  374    H6     C  35           H6         C  35  -4.848 -31.948  -0.004
  375   1H5*    G  36          1H5*        G  36   2.367 -30.603   3.467
  376   2H5*    G  36          2H5*        G  36   0.814 -30.553   2.617
  377    H4*    G  36           H4*        G  36   3.327 -31.926   1.588
  378    H3*    G  36           H3*        G  36   1.895 -29.364   0.785
  379    H2*    G  36           H2*        G  36   2.687 -29.756  -1.416
  380   2HO*    G  36          2HO*        G  36   4.903 -30.409  -0.389
  381    H1*    G  36           H1*        G  36   2.655 -32.587  -1.144
  382    H8     G  36           H8         G  36   1.337 -32.828  -3.405
  383    H1     G  36           H1         G  36  -3.190 -28.637  -1.553
  384   1H2     G  36          1H2         G  36  -2.727 -27.818   0.364
  385   2H2     G  36          2H2         G  36  -1.266 -28.228   1.234
  386   1H5*    G  37          1H5*        G  37   4.482 -28.252  -1.138
  387   2H5*    G  37          2H5*        G  37   4.990 -26.566  -1.050
  388    H4*    G  37           H4*        G  37   3.656 -27.297  -3.110
  389    H3*    G  37           H3*        G  37   2.604 -24.970  -1.459
  390    H2*    G  37           H2*        G  37   1.071 -24.695  -3.371
  391   2HO*    G  37          2HO*        G  37   2.814 -25.594  -4.938
  392    H1*    G  37           H1*        G  37   0.364 -27.291  -3.381
  393    H8     G  37           H8         G  37   1.154 -26.320   0.248
  394    H1     G  37           H1         G  37  -4.363 -23.879  -1.960
  395   1H2     G  37          1H2         G  37  -4.533 -24.248  -4.079
  396   2H2     G  37          2H2         G  37  -3.401 -25.268  -4.942
  397   1H5*    U  38          1H5*        U  38   2.130 -23.666  -5.210
  398   2H5*    U  38          2H5*        U  38   2.856 -22.112  -5.592
  399    H4*    U  38           H4*        U  38   0.534 -22.190  -6.282
  400    H3*    U  38           H3*        U  38   0.970 -20.324  -3.969
  401    H2*    U  38           H2*        U  38  -1.229 -19.467  -4.440
  402   2HO*    U  38          2HO*        U  38  -1.183 -19.656  -6.778
  403    H1*    U  38           H1*        U  38  -2.315 -21.963  -4.532
  404    H3     U  38           H3         U  38  -3.400 -20.462  -0.329
  405    H5     U  38           H5         U  38   0.452 -22.030   0.083
  406    H6     U  38           H6         U  38   0.564 -22.262  -2.350
  407   1H5*    G  39          1H5*        G  39   0.017 -17.746  -7.049
  408   2H5*    G  39          2H5*        G  39   0.912 -16.234  -6.918
  409    H4*    G  39           H4*        G  39  -1.441 -15.816  -6.989
  410    H3*    G  39           H3*        G  39  -0.445 -15.310  -4.180
  411    H2*    G  39           H2*        G  39  -2.679 -14.360  -3.844
  412   2HO*    G  39          2HO*        G  39  -2.832 -13.604  -6.190
  413    H1*    G  39           H1*        G  39  -3.873 -16.555  -4.849
  414    H8     G  39           H8         G  39  -0.554 -17.698  -3.303
  415    H1     G  39           H1         G  39  -5.157 -16.453   1.001
  416   1H2     G  39          1H2         G  39  -6.773 -15.378   0.054
  417   2H2     G  39          2H2         G  39  -6.845 -15.145  -1.680
  418   1H5*    G  40          1H5*        G  40  -2.417 -11.896  -5.317
  419   2H5*    G  40          2H5*        G  40  -1.621 -10.414  -4.762
  420    H4*    G  40           H4*        G  40  -3.989 -10.431  -4.182
  421    H3*    G  40           H3*        G  40  -2.011 -10.480  -1.876
  422    H2*    G  40           H2*        G  40  -3.955 -10.266  -0.428
  423   2HO*    G  40          2HO*        G  40  -5.080  -8.837  -2.142
  424    H1*    G  40           H1*        G  40  -5.427 -12.143  -1.673
  425    H8     G  40           H8         G  40  -1.954 -13.553  -1.992
  426    H1     G  40           H1         G  40  -4.172 -13.749   4.033
  427   1H2     G  40          1H2         G  40  -5.965 -12.567   4.212
  428   2H2     G  40          2H2         G  40  -6.635 -11.685   2.853
  429   1H5*    G  41          1H5*        G  41  -4.258  -8.097  -0.128
  430   2H5*    G  41          2H5*        G  41  -3.477  -6.617   0.418
  431    H4*    G  41           H4*        G  41  -4.280  -7.782   2.361
  432    H3*    G  41           H3*        G  41  -1.281  -8.066   2.056
  433    H2*    G  41           H2*        G  41  -1.316  -9.074   4.281
  434   2HO*    G  41          2HO*        G  41  -3.094  -7.852   5.212
  435    H1*    G  41           H1*        G  41  -3.283 -10.793   3.611
  436    H8     G  41           H8         G  41  -1.494 -10.241   0.310
  437    H1     G  41           H1         G  41   1.535 -14.346   4.215
  438   1H2     G  41          1H2         G  41   0.769 -14.210   6.205
  439   2H2     G  41          2H2         G  41  -0.533 -13.128   6.657
  440   1H5*    A  42          1H5*        A  42  -0.470  -4.478   6.068
  441   2H5*    A  42          2H5*        A  42  -0.222  -5.905   7.073
  442    H4*    A  42           H4*        A  42  -2.873  -4.974   5.904
  443    H3*    A  42           H3*        A  42  -1.739  -5.305   8.701
  444    H2*    A  42           H2*        A  42  -3.990  -5.733   9.485
  445   2HO*    A  42          2HO*        A  42  -4.967  -4.222   7.787
  446    H1*    A  42           H1*        A  42  -4.456  -7.612   7.623
  447    H8     A  42           H8         A  42  -0.904  -8.341   7.698
  448   1H6     A  42          1H6         A  42  -1.597 -10.793  13.371
  449   2H6     A  42          2H6         A  42  -0.611 -10.803  11.925
  450    H2     A  42           H2         A  42  -5.202  -8.363  12.492
  451   1H5*    A  43          1H5*        A  43  -4.497  -2.871   9.311
  452   2H5*    A  43          2H5*        A  43  -4.517  -1.331  10.137
  453    H4*    A  43           H4*        A  43  -5.838  -2.897  11.410
  454    H3*    A  43           H3*        A  43  -3.136  -2.432  12.741
  455    H2*    A  43           H2*        A  43  -3.837  -3.951  14.477
  456   2HO*    A  43          2HO*        A  43  -6.152  -3.065  14.301
  457    H1*    A  43           H1*        A  43  -4.967  -5.805  12.734
  458    H8     A  43           H8         A  43  -1.964  -4.888  10.817
  459   1H6     A  43          1H6         A  43   1.268  -8.701  14.478
  460   2H6     A  43          2H6         A  43   1.231  -7.904  12.916
  461    H2     A  43           H2         A  43  -2.552  -7.750  16.538
  462   1H5*    U  44          1H5*        U  44  -5.028  -1.893  16.037
  463   2H5*    U  44          2H5*        U  44  -4.568  -0.387  16.851
  464    H4*    U  44           H4*        U  44  -3.796  -2.240  18.187
  465    H3*    U  44           H3*        U  44  -1.510  -0.942  16.668
  466    H2*    U  44           H2*        U  44  -0.060  -2.312  18.008
  467   2HO*    U  44          2HO*        U  44  -1.577  -2.118  19.956
  468    H1*    U  44           H1*        U  44  -1.563  -4.569  17.659
  469    H3     U  44           H3         U  44   2.141  -5.099  14.979
  470    H5     U  44           H5         U  44  -0.375  -2.615  12.747
  471    H6     U  44           H6         U  44  -1.831  -2.420  14.707
  472   1H5*    A  45          1H5*        A  45  -0.165  -0.734  20.523
  473   2H5*    A  45          2H5*        A  45   0.648   0.794  20.873
  474    H4*    A  45           H4*        A  45   2.120  -1.097  21.268
  475    H3*    A  45           H3*        A  45   2.996   0.513  18.836
  476    H2*    A  45           H2*        A  45   5.014  -0.796  18.985
  477   2HO*    A  45          2HO*        A  45   4.901  -0.923  21.438
  478    H1*    A  45           H1*        A  45   3.658  -3.139  19.187
  479    H8     A  45           H8         A  45   1.485  -0.831  17.062
  480   1H6     A  45          1H6         A  45   5.070  -2.498  12.253
  481   2H6     A  45          2H6         A  45   3.553  -1.752  12.719
  482    H2     A  45           H2         A  45   6.934  -4.051  15.956
  483   1H5*    C  46          1H5*        C  46   6.199   0.541  21.466
  484   2H5*    C  46          2H5*        C  46   6.930   2.142  21.592
  485    H4*    C  46           H4*        C  46   8.597   0.463  21.047
  486    H3*    C  46           H3*        C  46   8.042   2.340  18.716
  487    H2*    C  46           H2*        C  46  10.053   1.380  17.782
  488   2HO*    C  46          2HO*        C  46  11.091   1.144  19.998
  489    H1*    C  46           H1*        C  46   9.286  -1.181  18.386
  490   1H4     C  46          1H4         C  46   7.129   0.063  12.514
  491   2H4     C  46          2H4         C  46   5.600   0.599  13.174
  492    H5     C  46           H5         C  46   5.198   0.855  15.528
  493    H6     C  46           H6         C  46   6.191   0.604  17.756
  494   1H5*    C  47          1H5*        C  47  12.107   2.799  19.543
  495   2H5*    C  47          2H5*        C  47  12.603   4.491  19.446
  496    H4*    C  47           H4*        C  47  13.960   3.095  17.987
  497    H3*    C  47           H3*        C  47  12.085   4.902  16.438
  498    H2*    C  47           H2*        C  47  13.457   4.283  14.526
  499   2HO*    C  47          2HO*        C  47  15.496   4.147  15.875
  500    H1*    C  47           H1*        C  47  13.385   1.626  15.185
  501   1H4     C  47          1H4         C  47   8.422   2.686  11.327
  502   2H4     C  47          2H4         C  47   7.426   3.150  12.688
  503    H5     C  47           H5         C  47   8.263   3.347  14.930
  504    H6     C  47           H6         C  47  10.257   3.111  16.335
  505   1H5*    A  48          1H5*        A  48  15.989   5.948  15.189
  506   2H5*    A  48          2H5*        A  48  16.147   7.691  14.959
  507    H4*    A  48           H4*        A  48  16.854   6.472  12.980
  508    H3*    A  48           H3*        A  48  14.267   7.980  12.522
  509    H2*    A  48           H2*        A  48  14.674   7.469  10.168
  510   2HO*    A  48          2HO*        A  48  17.138   7.543  10.503
  511    H1*    A  48           H1*        A  48  15.094   4.847  10.690
  512    H8     A  48           H8         A  48  12.641   5.961  13.360
  513   1H6     A  48          1H6         A  48   8.198   5.505   9.032
  514   2H6     A  48          2H6         A  48   8.527   5.716  10.740
  515    H2     A  48           H2         A  48  12.128   5.122   7.000
  516   1H5*    G  49          1H5*        G  49  16.830   9.257   9.605
  517   2H5*    G  49          2H5*        G  49  16.797  10.992   9.311
  518    H4*    G  49           H4*        G  49  16.503   9.728   7.256
  519    H3*    G  49           H3*        G  49  13.964  11.202   8.058
  520    H2*    G  49           H2*        G  49  13.208  10.578   5.816
  521   2HO*    G  49          2HO*        G  49  15.568  10.682   4.972
  522    H1*    G  49           H1*        G  49  13.926   7.994   6.140
  523    H8     G  49           H8         G  49  12.979   9.003   9.655
  524    H1     G  49           H1         G  49   7.911   8.443   5.736
  525   1H2     G  49          1H2         G  49   8.568   8.484   3.682
  526   2H2     G  49          2H2         G  49  10.261   8.376   3.246
  527   1H5*    G  50          1H5*        G  50  14.534  12.195   4.174
  528   2H5*    G  50          2H5*        G  50  14.485  13.925   3.855
  529    H4*    G  50           H4*        G  50  13.023  12.682   2.336
  530    H3*    G  50           H3*        G  50  11.516  14.420   4.321
  531    H2*    G  50           H2*        G  50   9.563  13.924   2.929
  532   2HO*    G  50          2HO*        G  50  10.979  13.844   0.893
  533    H1*    G  50           H1*        G  50  10.131  11.256   2.815
  534    H8     G  50           H8         G  50  11.216  11.878   6.315
  535    H1     G  50           H1         G  50   4.811  11.955   5.599
  536   1H2     G  50          1H2         G  50   4.314  12.039   3.512
  537   2H2     G  50          2H2         G  50   5.521  12.315   2.274
  538   1H5*    U  51          1H5*        U  51  10.011  15.533   0.690
  539   2H5*    U  51          2H5*        U  51  10.340  17.218   0.281
  540    H4*    U  51           H4*        U  51   8.017  16.687  -0.189
  541    H3*    U  51           H3*        U  51   8.857  18.866   1.310
  542    H2*    U  51           H2*        U  51   8.291  18.020   3.351
  543   2HO*    U  51          2HO*        U  51   6.400  19.729   2.502
  544    H1*    U  51           H1*        U  51   5.771  16.750   2.257
  545    H3     U  51           H3         U  51   4.680  15.242   6.300
  546    H5     U  51           H5         U  51   8.853  15.442   6.540
  547    H6     U  51           H6         U  51   8.916  15.936   4.138
  548   1H5*    G  52          1H5*        G  52   7.570  21.250  -2.465
  549   2H5*    G  52          2H5*        G  52   5.921  21.531  -2.999
  550    H4*    G  52           H4*        G  52   7.196  18.778  -2.718
  551    H3*    G  52           H3*        G  52   6.518  20.593  -5.066
  552    H2*    G  52           H2*        G  52   6.334  18.583  -6.388
  553   2HO*    G  52          2HO*        G  52   8.155  17.495  -5.153
  554    H1*    G  52           H1*        G  52   4.858  17.287  -4.477
  555    H8     G  52           H8         G  52   3.747  20.923  -4.362
  556    H1     G  52           H1         G  52   1.004  17.430  -9.015
  557   1H2     G  52          1H2         G  52   2.205  15.691  -9.441
  558   2H2     G  52          2H2         G  52   3.606  15.266  -8.479
  559   1H5*    C  53          1H5*        C  53   9.298  18.036  -6.857
  560   2H5*    C  53          2H5*        C  53  10.377  18.922  -7.943
  561    H4*    C  53           H4*        C  53   9.216  17.144  -9.125
  562    H3*    C  53           H3*        C  53   8.218  19.884  -9.973
  563    H2*    C  53           H2*        C  53   7.116  18.672 -11.761
  564   2HO*    C  53          2HO*        C  53   8.955  17.038 -11.895
  565    H1*    C  53           H1*        C  53   6.140  16.754 -10.070
  566   1H4     C  53          1H4         C  53   1.635  21.227 -10.154
  567   2H4     C  53          2H4         C  53   2.420  22.069  -8.838
  568    H5     C  53           H5         C  53   4.622  21.532  -8.057
  569    H6     C  53           H6         C  53   6.429  19.887  -8.217
  570   1H5*    C  54          1H5*        C  54   9.434  18.107 -13.541
  571   2H5*    C  54          2H5*        C  54  10.277  19.256 -14.586
  572    H4*    C  54           H4*        C  54   8.403  18.238 -15.745
  573    H3*    C  54           H3*        C  54   7.914  21.175 -15.127
  574    H2*    C  54           H2*        C  54   6.046  20.946 -16.653
  575   2HO*    C  54          2HO*        C  54   7.293  19.320 -18.041
  576    H1*    C  54           H1*        C  54   5.205  18.599 -15.516
  577   1H4     C  54          1H4         C  54   2.164  23.254 -12.415
  578   2H4     C  54          2H4         C  54   3.483  23.391 -11.279
  579    H5     C  54           H5         C  54   5.556  22.210 -11.520
  580    H6     C  54           H6         C  54   6.767  20.577 -12.887
  581   1H5*    C  55          1H5*        C  55   7.406  20.944 -19.243
  582   2H5*    C  55          2H5*        C  55   8.239  22.263 -20.069
  583    H4*    C  55           H4*        C  55   5.890  22.202 -20.713
  584    H3*    C  55           H3*        C  55   6.576  24.583 -18.949
  585    H2*    C  55           H2*        C  55   4.401  25.397 -19.463
  586   2HO*    C  55          2HO*        C  55   4.553  24.636 -21.769
  587    H1*    C  55           H1*        C  55   3.177  22.919 -19.232
  588   1H4     C  55          1H4         C  55   2.501  26.137 -13.756
  589   2H4     C  55          2H4         C  55   4.076  25.606 -13.213
  590    H5     C  55           H5         C  55   5.565  24.294 -14.562
  591    H6     C  55           H6         C  55   5.845  23.225 -16.751
  592   1H    MET 104          1H        MET 104  10.654 -15.355   3.351
  593    HA   MET 104           HA       MET 104  11.328 -12.504   2.938
  594   1HB   MET 104          1HB       MET 104  13.250 -13.609   4.184
  595   2HB   MET 104          2HB       MET 104  13.469 -14.677   2.807
  596   1HG   MET 104          1HG       MET 104  14.766 -13.163   1.842
  597   2HG   MET 104          2HG       MET 104  13.448 -12.006   1.761
  598   1HE   MET 104          1HE       MET 104  12.718 -10.893   4.343
  599   2HE   MET 104          2HE       MET 104  13.962  -9.776   4.929
  600   3HE   MET 104          3HE       MET 104  13.454  -9.703   3.234
  601    H    TYR 105           H        TYR 105  11.064 -11.939   0.853
  602    HA   TYR 105           HA       TYR 105  10.617 -14.140  -1.139
  603   1HB   TYR 105          1HB       TYR 105   9.392 -11.392  -0.758
  604   2HB   TYR 105          2HB       TYR 105   9.320 -12.199  -2.314
  605    HD1  TYR 105           HD1      TYR 105   8.536 -12.984   1.389
  606    HD2  TYR 105           HD2      TYR 105   7.656 -13.737  -2.799
  607    HE1  TYR 105           HE1      TYR 105   6.829 -14.630   2.028
  608    HE2  TYR 105           HE2      TYR 105   5.794 -15.233  -2.106
  609    HH   TYR 105           HH       TYR 105   5.024 -15.840   1.337
  610    H    VAL 106           H        VAL 106  12.028 -14.362  -2.748
  611    HA   VAL 106           HA       VAL 106  14.086 -12.208  -3.071
  612    HB   VAL 106           HB       VAL 106  14.234 -15.198  -3.616
  613   1HG1  VAL 106          1HG1      VAL 106  16.467 -13.117  -3.572
  614   2HG1  VAL 106          2HG1      VAL 106  16.699 -14.873  -3.679
  615   3HG1  VAL 106          3HG1      VAL 106  15.895 -14.026  -4.990
  616   1HG2  VAL 106          1HG2      VAL 106  15.365 -13.566  -1.325
  617   2HG2  VAL 106          2HG2      VAL 106  14.032 -14.755  -1.219
  618   3HG2  VAL 106          3HG2      VAL 106  15.661 -15.308  -1.646
  619    H    CYS 107           H        CYS 107  14.649 -11.395  -5.023
  620    HA   CYS 107           HA       CYS 107  13.033 -12.002  -7.386
  621   1HB   CYS 107          1HB       CYS 107  13.788  -9.686  -6.874
  622   2HB   CYS 107          2HB       CYS 107  15.468 -10.218  -6.973
  623    H    HIS 108           H        HIS 108  13.529 -13.431  -8.929
  624    HA   HIS 108           HA       HIS 108  16.207 -14.746  -8.800
  625   1HB   HIS 108          1HB       HIS 108  13.540 -15.805  -9.846
  626   2HB   HIS 108          2HB       HIS 108  15.066 -16.699  -9.843
  627    HD2  HIS 108           HD2      HIS 108  12.091 -16.871  -7.959
  628    HE1  HIS 108           HE1      HIS 108  14.948 -16.964  -4.784
  629    HE2  HIS 108           HE2      HIS 108  12.516 -17.403  -5.415
  630    H    PHE 109           H        PHE 109  15.388 -12.208 -10.297
  631    HA   PHE 109           HA       PHE 109  15.521 -12.777 -13.129
  632   1HB   PHE 109          1HB       PHE 109  14.990 -10.524 -11.833
  633   2HB   PHE 109          2HB       PHE 109  16.728 -10.282 -11.865
  634    HD1  PHE 109           HD1      PHE 109  17.884  -9.870 -13.989
  635    HD2  PHE 109           HD2      PHE 109  13.614 -10.360 -13.724
  636    HE1  PHE 109           HE1      PHE 109  17.618  -9.021 -16.349
  637    HE2  PHE 109           HE2      PHE 109  13.340  -9.555 -16.065
  638    HZ   PHE 109           HZ       PHE 109  15.331  -8.857 -17.368
  639    H    GLU 110           H        GLU 110  17.395 -12.575 -14.523
  640    HA   GLU 110           HA       GLU 110  19.449 -14.298 -13.770
  641   1HB   GLU 110          1HB       GLU 110  18.812 -13.695 -16.103
  642   2HB   GLU 110          2HB       GLU 110  19.598 -12.125 -15.918
  643   1HG   GLU 110          1HG       GLU 110  21.779 -13.263 -15.551
  644   2HG   GLU 110          2HG       GLU 110  20.982 -14.833 -15.645
  645    H    ASN 111           H        ASN 111  20.903 -14.066 -12.172
  646    HA   ASN 111           HA       ASN 111  22.820 -13.329 -11.113
  647   1HB   ASN 111          1HB       ASN 111  23.455 -12.600 -13.537
  648   2HB   ASN 111          2HB       ASN 111  23.012 -10.968 -13.033
  649   1HD2  ASN 111          1HD2      ASN 111  25.068 -10.043 -13.093
  650   2HD2  ASN 111          2HD2      ASN 111  26.370 -10.590 -12.046
  651    H    CYS 112           H        CYS 112  19.928 -12.066 -10.783
  652    HA   CYS 112           HA       CYS 112  20.554  -9.468  -9.560
  653   1HB   CYS 112          1HB       CYS 112  18.480  -9.817 -10.819
  654   2HB   CYS 112          2HB       CYS 112  17.927 -11.032  -9.642
  655    H    GLY 113           H        GLY 113  18.522 -12.115  -8.184
  656   1HA   GLY 113          1HA       GLY 113  18.609 -13.242  -6.166
  657   2HA   GLY 113          2HA       GLY 113  20.311 -12.757  -6.042
  658    H    LYS 114           H        LYS 114  18.069 -10.083  -6.339
  659    HA   LYS 114           HA       LYS 114  18.705  -9.100  -3.674
  660   1HB   LYS 114          1HB       LYS 114  18.063  -7.842  -5.872
  661   2HB   LYS 114          2HB       LYS 114  16.392  -8.079  -5.344
  662   1HG   LYS 114          1HG       LYS 114  16.805  -6.772  -3.327
  663   2HG   LYS 114          2HG       LYS 114  18.567  -6.806  -3.599
  664   1HD   LYS 114          1HD       LYS 114  18.310  -5.499  -5.670
  665   2HD   LYS 114          2HD       LYS 114  16.562  -5.544  -5.467
  666   1HE   LYS 114          1HE       LYS 114  17.317  -3.397  -4.911
  667   2HE   LYS 114          2HE       LYS 114  16.678  -4.184  -3.458
  668   1HZ   LYS 114          1HZ       LYS 114  18.785  -3.026  -3.010
  669   2HZ   LYS 114          2HZ       LYS 114  18.983  -4.625  -2.768
  670   3HZ   LYS 114          3HZ       LYS 114  19.572  -3.922  -4.123
  671    H    ALA 115           H        ALA 115  17.453  -9.020  -1.807
  672    HA   ALA 115           HA       ALA 115  15.052 -10.818  -1.802
  673   1HB   ALA 115          1HB       ALA 115  17.178 -10.452   0.353
  674   2HB   ALA 115          2HB       ALA 115  15.759 -11.529   0.426
  675   3HB   ALA 115          3HB       ALA 115  17.026 -11.832  -0.769
  676    H    PHE 116           H        PHE 116  13.220 -10.174  -0.810
  677    HA   PHE 116           HA       PHE 116  13.242  -7.523   0.586
  678   1HB   PHE 116          1HB       PHE 116  10.983  -8.633  -1.122
  679   2HB   PHE 116          2HB       PHE 116  11.160  -7.035  -0.452
  680    HD1  PHE 116           HD1      PHE 116  12.483  -9.407  -2.996
  681    HD2  PHE 116           HD2      PHE 116  12.419  -5.315  -1.643
  682    HE1  PHE 116           HE1      PHE 116  13.910  -8.785  -4.897
  683    HE2  PHE 116           HE2      PHE 116  13.880  -4.685  -3.577
  684    HZ   PHE 116           HZ       PHE 116  14.658  -6.477  -5.157
  685    H    LYS 117           H        LYS 117  11.627  -7.174   2.177
  686    HA   LYS 117           HA       LYS 117  11.142  -9.339   3.914
  687   1HB   LYS 117          1HB       LYS 117  11.135  -6.866   4.452
  688   2HB   LYS 117          2HB       LYS 117   9.501  -6.752   3.780
  689   1HG   LYS 117          1HG       LYS 117   8.614  -8.236   5.443
  690   2HG   LYS 117          2HG       LYS 117  10.247  -8.765   5.884
  691   1HD   LYS 117          1HD       LYS 117  10.619  -6.300   6.638
  692   2HD   LYS 117          2HD       LYS 117   8.864  -6.124   6.497
  693   1HE   LYS 117          1HE       LYS 117   9.725  -6.637   8.810
  694   2HE   LYS 117          2HE       LYS 117   8.474  -7.741   8.223
  695   1HZ   LYS 117          1HZ       LYS 117  11.359  -8.319   8.162
  696   2HZ   LYS 117          2HZ       LYS 117  10.302  -8.892   9.320
  697   3HZ   LYS 117          3HZ       LYS 117  10.117  -9.372   7.771
  698    H    LYS 118           H        LYS 118   8.994  -7.820   1.448
  699    HA   LYS 118           HA       LYS 118   7.117 -10.151   1.738
  700   1HB   LYS 118          1HB       LYS 118   6.281  -7.189   1.774
  701   2HB   LYS 118          2HB       LYS 118   5.185  -8.584   1.822
  702   1HG   LYS 118          1HG       LYS 118   6.747  -9.361   3.785
  703   2HG   LYS 118          2HG       LYS 118   7.205  -7.662   3.883
  704   1HD   LYS 118          1HD       LYS 118   5.208  -7.129   4.963
  705   2HD   LYS 118          2HD       LYS 118   4.325  -8.410   4.125
  706   1HE   LYS 118          1HE       LYS 118   4.570  -9.384   6.355
  707   2HE   LYS 118          2HE       LYS 118   5.825 -10.078   5.355
  708   1HZ   LYS 118          1HZ       LYS 118   7.077  -9.517   7.088
  709   2HZ   LYS 118          2HZ       LYS 118   7.143  -8.049   6.360
  710   3HZ   LYS 118          3HZ       LYS 118   6.070  -8.309   7.588
  711    H    HIS 119           H        HIS 119   5.608 -10.428  -0.064
  712    HA   HIS 119           HA       HIS 119   7.108 -10.453  -2.483
  713   1HB   HIS 119          1HB       HIS 119   5.055 -11.332  -3.543
  714   2HB   HIS 119          2HB       HIS 119   5.519 -12.150  -2.084
  715    HD1  HIS 119           HD1      HIS 119   2.801  -9.373  -2.819
  716    HD2  HIS 119           HD2      HIS 119   3.641 -12.973  -0.769
  717    HE1  HIS 119           HE1      HIS 119   0.645 -10.031  -1.529
  718    HE2  HIS 119           HE2      HIS 119   1.157 -12.231  -0.385
  719    H    ASN 120           H        ASN 120   4.748  -8.086  -1.305
  720    HA   ASN 120           HA       ASN 120   4.110  -6.908  -3.841
  721   1HB   ASN 120          1HB       ASN 120   4.210  -4.964  -1.625
  722   2HB   ASN 120          2HB       ASN 120   2.859  -5.482  -2.599
  723   1HD2  ASN 120          1HD2      ASN 120   1.225  -6.649  -1.473
  724   2HD2  ASN 120          2HD2      ASN 120   1.541  -7.377   0.095
  725    H    GLN 121           H        GLN 121   6.851  -6.449  -1.601
  726    HA   GLN 121           HA       GLN 121   7.934  -4.133  -3.045
  727   1HB   GLN 121          1HB       GLN 121   9.558  -5.916  -1.264
  728   2HB   GLN 121          2HB       GLN 121   9.675  -4.166  -1.572
  729   1HG   GLN 121          1HG       GLN 121   7.710  -3.770  -0.186
  730   2HG   GLN 121          2HG       GLN 121   7.556  -5.524   0.114
  731   1HE2  GLN 121          1HE2      GLN 121   9.128  -2.625   1.254
  732   2HE2  GLN 121          2HE2      GLN 121  10.119  -3.493   2.449
  733    H    LEU 122           H        LEU 122   8.437  -7.702  -2.966
  734    HA   LEU 122           HA       LEU 122  10.619  -7.814  -4.769
  735   1HB   LEU 122          1HB       LEU 122   9.945  -9.758  -3.501
  736   2HB   LEU 122          2HB       LEU 122   8.332  -9.739  -4.185
  737    HG   LEU 122           HG       LEU 122   9.139 -10.423  -6.365
  738   1HD1  LEU 122          1HD1      LEU 122  11.396  -9.334  -6.262
  739   2HD1  LEU 122          2HD1      LEU 122  11.867 -10.553  -5.050
  740   3HD1  LEU 122          3HD1      LEU 122  11.419 -11.029  -6.715
  741   1HD2  LEU 122          1HD2      LEU 122   8.639 -12.204  -4.684
  742   2HD2  LEU 122          2HD2      LEU 122   9.906 -12.676  -5.833
  743   3HD2  LEU 122          3HD2      LEU 122  10.349 -12.208  -4.191
  744    H    LYS 123           H        LYS 123   7.064  -8.054  -5.448
  745    HA   LYS 123           HA       LYS 123   7.235  -8.049  -8.266
  746   1HB   LYS 123          1HB       LYS 123   5.096  -7.092  -6.317
  747   2HB   LYS 123          2HB       LYS 123   4.897  -6.889  -8.068
  748   1HG   LYS 123          1HG       LYS 123   5.341  -9.299  -8.420
  749   2HG   LYS 123          2HG       LYS 123   5.442  -9.548  -6.671
  750   1HD   LYS 123          1HD       LYS 123   3.104  -9.003  -6.380
  751   2HD   LYS 123          2HD       LYS 123   2.977  -8.404  -8.053
  752   1HE   LYS 123          1HE       LYS 123   3.513 -10.655  -8.921
  753   2HE   LYS 123          2HE       LYS 123   3.635 -11.283  -7.273
  754   1HZ   LYS 123          1HZ       LYS 123   1.146 -10.080  -8.364
  755   2HZ   LYS 123          2HZ       LYS 123   1.452 -11.687  -8.360
  756   3HZ   LYS 123          3HZ       LYS 123   1.316 -10.903  -6.945
  757    H    VAL 124           H        VAL 124   7.198  -5.280  -5.984
  758    HA   VAL 124           HA       VAL 124   7.159  -3.174  -7.915
  759    HB   VAL 124           HB       VAL 124   8.221  -3.444  -5.107
  760   1HG1  VAL 124          1HG1      VAL 124   8.462  -0.920  -6.777
  761   2HG1  VAL 124          2HG1      VAL 124   8.564  -0.989  -5.004
  762   3HG1  VAL 124          3HG1      VAL 124   9.786  -1.803  -5.979
  763   1HG2  VAL 124          1HG2      VAL 124   6.319  -2.325  -4.549
  764   2HG2  VAL 124          2HG2      VAL 124   6.249  -1.483  -6.148
  765   3HG2  VAL 124          3HG2      VAL 124   5.748  -3.182  -5.958
  766    H    HIS 125           H        HIS 125   9.895  -5.059  -6.528
  767    HA   HIS 125           HA       HIS 125  11.935  -3.519  -7.788
  768   1HB   HIS 125          1HB       HIS 125  12.416  -4.886  -5.881
  769   2HB   HIS 125          2HB       HIS 125  11.865  -6.356  -6.684
  770    HD1  HIS 125           HD1      HIS 125  14.790  -3.849  -6.908
  771    HD2  HIS 125           HD2      HIS 125  13.517  -7.651  -8.203
  772    HE1  HIS 125           HE1      HIS 125  16.821  -4.954  -7.963
  773    H    GLN 126           H        GLN 126  10.324  -6.613  -8.747
  774    HA   GLN 126           HA       GLN 126  11.962  -7.068 -11.040
  775   1HB   GLN 126          1HB       GLN 126   9.161  -8.047 -10.325
  776   2HB   GLN 126          2HB       GLN 126  10.059  -8.548 -11.792
  777   1HG   GLN 126          1HG       GLN 126  12.035  -9.071 -10.263
  778   2HG   GLN 126          2HG       GLN 126  10.990  -8.856  -8.871
  779   1HE2  GLN 126          1HE2      GLN 126  12.516 -11.126  -9.521
  780   2HE2  GLN 126          2HE2      GLN 126  11.376 -12.470  -9.807
  781    H    PHE 127           H        PHE 127   9.025  -5.127 -10.604
  782    HA   PHE 127           HA       PHE 127   8.321  -4.699 -13.299
  783   1HB   PHE 127          1HB       PHE 127   6.826  -3.469 -12.391
  784   2HB   PHE 127          2HB       PHE 127   7.512  -3.765 -10.849
  785    HD1  PHE 127           HD1      PHE 127   7.342  -2.009  -9.527
  786    HD2  PHE 127           HD2      PHE 127   8.183  -1.190 -13.656
  787    HE1  PHE 127           HE1      PHE 127   7.684   0.273  -8.911
  788    HE2  PHE 127           HE2      PHE 127   8.436   1.183 -13.140
  789    HZ   PHE 127           HZ       PHE 127   8.312   1.974 -10.744
  790    H    SER 128           H        SER 128  11.080  -3.432 -11.457
  791    HA   SER 128           HA       SER 128  11.759  -1.305 -13.328
  792   1HB   SER 128          1HB       SER 128  13.751  -1.061 -12.106
  793   2HB   SER 128          2HB       SER 128  12.544  -1.503 -10.904
  794    HG   SER 128           HG       SER 128  13.415  -3.559 -10.818
  795    H    HIS 129           H        HIS 129  12.768  -4.769 -12.985
  796    HA   HIS 129           HA       HIS 129  14.712  -4.698 -15.138
  797   1HB   HIS 129          1HB       HIS 129  13.112  -7.020 -13.978
  798   2HB   HIS 129          2HB       HIS 129  14.418  -7.143 -15.129
  799    HD1  HIS 129           HD1      HIS 129  16.960  -6.516 -14.151
  800    HD2  HIS 129           HD2      HIS 129  13.805  -7.655 -11.661
  801    HE1  HIS 129           HE1      HIS 129  18.003  -7.515 -12.028
  802    H    THR 130           H        THR 130  11.220  -5.415 -14.942
  803    HA   THR 130           HA       THR 130  11.026  -6.205 -17.763
  804    HB   THR 130           HB       THR 130   8.586  -6.238 -17.317
  805    HG1  THR 130           HG1      THR 130   9.361  -5.069 -14.903
  806   1HG2  THR 130          1HG2      THR 130   9.910  -7.477 -14.835
  807   2HG2  THR 130          2HG2      THR 130   8.469  -8.001 -15.705
  808   3HG2  THR 130          3HG2      THR 130  10.070  -8.193 -16.454
  809    H    GLN 131           H        GLN 131  10.956  -3.238 -15.977
  810    HA   GLN 131           HA       GLN 131  10.509  -1.060 -16.490
  811   1HB   GLN 131          1HB       GLN 131  12.041  -1.885 -18.548
  812   2HB   GLN 131          2HB       GLN 131  10.569  -1.559 -19.464
  813   1HG   GLN 131          1HG       GLN 131  11.336   0.597 -19.469
  814   2HG   GLN 131          2HG       GLN 131  10.677   0.694 -17.836
  815   1HE2  GLN 131          1HE2      GLN 131  12.597  -0.558 -16.175
  816   2HE2  GLN 131          2HE2      GLN 131  14.118   0.264 -16.424
  817    H    GLN 132           H        GLN 132   8.240  -3.000 -16.278
  818    HA   GLN 132           HA       GLN 132   6.220  -1.127 -17.463
  819   1HB   GLN 132          1HB       GLN 132   4.654  -2.942 -17.794
  820   2HB   GLN 132          2HB       GLN 132   6.100  -3.133 -18.773
  821   1HG   GLN 132          1HG       GLN 132   5.432  -5.300 -18.075
  822   2HG   GLN 132          2HG       GLN 132   6.900  -4.880 -17.215
  823   1HE2  GLN 132          1HE2      GLN 132   6.854  -5.256 -15.047
  824   2HE2  GLN 132          2HE2      GLN 132   5.387  -5.363 -14.061
  825    H    LEU 133           H        LEU 133   4.209  -1.003 -16.190
  826    HA   LEU 133           HA       LEU 133   4.980  -0.995 -13.349
  827   1HB   LEU 133          1HB       LEU 133   2.911   0.471 -14.983
  828   2HB   LEU 133          2HB       LEU 133   2.863   0.553 -13.215
  829    HG   LEU 133           HG       LEU 133   5.457   1.136 -14.791
  830   1HD1  LEU 133          1HD1      LEU 133   3.686   2.711 -15.540
  831   2HD1  LEU 133          2HD1      LEU 133   3.372   3.144 -13.843
  832   3HD1  LEU 133          3HD1      LEU 133   4.945   3.511 -14.583
  833   1HD2  LEU 133          1HD2      LEU 133   4.608   2.012 -12.045
  834   2HD2  LEU 133          2HD2      LEU 133   5.677   0.632 -12.371
  835   3HD2  LEU 133          3HD2      LEU 133   6.165   2.265 -12.830
  836    HA   PRO 134           HA       PRO 134   2.457  -4.489 -12.575
  837   1HB   PRO 134          1HB       PRO 134   2.620  -4.345  -9.754
  838   2HB   PRO 134          2HB       PRO 134   3.789  -5.136 -10.849
  839   1HG   PRO 134          1HG       PRO 134   4.077  -2.654  -9.298
  840   2HG   PRO 134          2HG       PRO 134   5.313  -3.612 -10.127
  841   1HD   PRO 134          1HD       PRO 134   4.167  -1.127 -10.976
  842   2HD   PRO 134          2HD       PRO 134   5.288  -2.183 -11.836
  843    H    TYR 135           H        TYR 135   1.710  -1.533 -10.693
  844    HA   TYR 135           HA       TYR 135  -0.904  -2.655  -9.891
  845   1HB   TYR 135          1HB       TYR 135   0.467  -0.043  -9.081
  846   2HB   TYR 135          2HB       TYR 135  -0.969  -0.724  -8.355
  847    HD1  TYR 135           HD1      TYR 135  -0.915  -2.861  -7.127
  848    HD2  TYR 135           HD2      TYR 135   2.689  -0.868  -8.424
  849    HE1  TYR 135           HE1      TYR 135   0.474  -4.381  -5.672
  850    HE2  TYR 135           HE2      TYR 135   4.047  -2.275  -6.867
  851    HH   TYR 135           HH       TYR 135   4.024  -4.169  -5.492
  852    H    GLU 136           H        GLU 136  -2.305  -2.514 -11.621
  853    HA   GLU 136           HA       GLU 136  -2.457   0.081 -13.088
  854   1HB   GLU 136          1HB       GLU 136  -3.715  -1.158 -14.775
  855   2HB   GLU 136          2HB       GLU 136  -2.167  -1.931 -14.453
  856   1HG   GLU 136          1HG       GLU 136  -3.354  -3.630 -13.021
  857   2HG   GLU 136          2HG       GLU 136  -4.891  -2.896 -13.493
  858    H    CYS 137           H        CYS 137  -4.346   1.283 -13.194
  859    HA   CYS 137           HA       CYS 137  -6.335   0.886 -11.095
  860   1HB   CYS 137          1HB       CYS 137  -5.648   3.118 -11.657
  861   2HB   CYS 137          2HB       CYS 137  -6.028   2.894 -13.346
  862    HA   PRO 138           HA       PRO 138  -8.802  -1.620 -13.863
  863   1HB   PRO 138          1HB       PRO 138 -10.386  -2.846 -12.041
  864   2HB   PRO 138          2HB       PRO 138  -8.610  -3.064 -11.995
  865   1HG   PRO 138          1HG       PRO 138 -10.282  -1.104 -10.369
  866   2HG   PRO 138          2HG       PRO 138  -9.056  -2.263  -9.770
  867   1HD   PRO 138          1HD       PRO 138  -8.507   0.400 -10.331
  868   2HD   PRO 138          2HD       PRO 138  -7.296  -0.913 -10.477
  869    H    HIS 139           H        HIS 139  -9.762   1.301 -12.605
  870    HA   HIS 139           HA       HIS 139 -12.618   1.148 -12.498
  871   1HB   HIS 139          1HB       HIS 139 -11.144   2.997 -11.594
  872   2HB   HIS 139          2HB       HIS 139 -10.940   3.577 -13.251
  873    HD2  HIS 139           HD2      HIS 139 -13.606   3.181 -10.476
  874    HE1  HIS 139           HE1      HIS 139 -15.280   5.810 -13.388
  875    HE2  HIS 139           HE2      HIS 139 -15.620   4.769 -11.087
  876    H    GLU 140           H        GLU 140 -14.242   1.600 -13.990
  877    HA   GLU 140           HA       GLU 140 -13.729   0.869 -16.727
  878   1HB   GLU 140          1HB       GLU 140 -15.864   0.455 -15.503
  879   2HB   GLU 140          2HB       GLU 140 -16.209   2.186 -15.507
  880   1HG   GLU 140          1HG       GLU 140 -16.239   2.161 -18.001
  881   2HG   GLU 140          2HG       GLU 140 -15.816   0.450 -17.992
  882    H    GLY 141           H        GLY 141 -12.569   2.159 -18.061
  883   1HA   GLY 141          1HA       GLY 141 -12.718   4.042 -19.611
  884   2HA   GLY 141          2HA       GLY 141 -13.432   5.020 -18.317
  885    H    CYS 142           H        CYS 142 -11.017   3.291 -16.828
  886    HA   CYS 142           HA       CYS 142  -8.988   5.445 -17.291
  887   1HB   CYS 142          1HB       CYS 142 -10.152   5.108 -14.981
  888   2HB   CYS 142          2HB       CYS 142  -9.171   3.658 -14.850
  889    H    ASP 143           H        ASP 143  -6.719   4.785 -17.190
  890    HA   ASP 143           HA       ASP 143  -6.136   1.902 -17.598
  891   1HB   ASP 143          1HB       ASP 143  -5.243   2.137 -19.761
  892   2HB   ASP 143          2HB       ASP 143  -6.796   2.944 -19.842
  893    H    LYS 144           H        LYS 144  -5.399   4.464 -15.838
  894    HA   LYS 144           HA       LYS 144  -2.559   4.882 -16.231
  895   1HB   LYS 144          1HB       LYS 144  -4.285   5.256 -13.732
  896   2HB   LYS 144          2HB       LYS 144  -2.628   5.812 -13.950
  897   1HG   LYS 144          1HG       LYS 144  -3.836   6.993 -16.120
  898   2HG   LYS 144          2HG       LYS 144  -5.161   6.999 -14.931
  899   1HD   LYS 144          1HD       LYS 144  -3.698   8.156 -13.297
  900   2HD   LYS 144          2HD       LYS 144  -2.366   8.101 -14.457
  901   1HE   LYS 144          1HE       LYS 144  -3.201  10.265 -14.693
  902   2HE   LYS 144          2HE       LYS 144  -3.854   9.387 -16.083
  903   1HZ   LYS 144          1HZ       LYS 144  -5.934   9.126 -14.700
  904   2HZ   LYS 144          2HZ       LYS 144  -5.268  10.151 -13.586
  905   3HZ   LYS 144          3HZ       LYS 144  -5.601  10.681 -15.091
  906    H    ARG 145           H        ARG 145  -0.787   4.053 -15.066
  907    HA   ARG 145           HA       ARG 145  -1.302   1.745 -13.239
  908   1HB   ARG 145          1HB       ARG 145   0.927   1.710 -15.318
  909   2HB   ARG 145          2HB       ARG 145   0.427   0.451 -14.147
  910   1HG   ARG 145          1HG       ARG 145  -1.806   0.382 -15.350
  911   2HG   ARG 145          2HG       ARG 145  -1.055   1.303 -16.653
  912   1HD   ARG 145          1HD       ARG 145   0.079  -1.310 -15.552
  913   2HD   ARG 145          2HD       ARG 145  -1.099  -1.255 -16.862
  914    HE   ARG 145           HE       ARG 145   0.728   0.360 -17.926
  915   1HH1  ARG 145          1HH1      ARG 145   1.527  -2.593 -16.206
  916   2HH1  ARG 145          2HH1      ARG 145   2.465  -3.220 -17.522
  917   1HH2  ARG 145          1HH2      ARG 145   2.151  -0.376 -19.456
  918   2HH2  ARG 145          2HH2      ARG 145   2.913  -1.924 -19.272
  919    H    PHE 146           H        PHE 146   0.285   1.411 -11.668
  920    HA   PHE 146           HA       PHE 146   2.042   3.784 -11.199
  921   1HB   PHE 146          1HB       PHE 146   0.276   2.407  -9.116
  922   2HB   PHE 146          2HB       PHE 146   1.241   3.852  -8.934
  923    HD1  PHE 146           HD1      PHE 146   0.643   5.997  -9.992
  924    HD2  PHE 146           HD2      PHE 146  -1.871   2.505 -10.367
  925    HE1  PHE 146           HE1      PHE 146  -1.173   7.388 -10.970
  926    HE2  PHE 146           HE2      PHE 146  -3.693   3.892 -11.198
  927    HZ   PHE 146           HZ       PHE 146  -3.305   6.330 -11.644
  928    H    SER 147           H        SER 147   3.599   3.478  -9.433
  929    HA   SER 147           HA       SER 147   5.045   0.997  -9.961
  930   1HB   SER 147          1HB       SER 147   5.743   3.339  -8.127
  931   2HB   SER 147          2HB       SER 147   6.879   2.156  -8.745
  932    HG   SER 147           HG       SER 147   6.872   4.161  -9.922
  933    H    LEU 148           H        LEU 148   3.086   2.301  -7.329
  934    HA   LEU 148           HA       LEU 148   3.738  -0.120  -5.707
  935   1HB   LEU 148          1HB       LEU 148   3.894   2.791  -4.917
  936   2HB   LEU 148          2HB       LEU 148   3.420   1.626  -3.696
  937    HG   LEU 148           HG       LEU 148   5.994   1.383  -5.308
  938   1HD1  LEU 148          1HD1      LEU 148   5.527   2.480  -2.511
  939   2HD1  LEU 148          2HD1      LEU 148   7.117   2.145  -3.236
  940   3HD1  LEU 148          3HD1      LEU 148   6.074   3.405  -3.928
  941   1HD2  LEU 148          1HD2      LEU 148   5.140   0.046  -2.694
  942   2HD2  LEU 148          2HD2      LEU 148   5.056  -0.721  -4.297
  943   3HD2  LEU 148          3HD2      LEU 148   6.628  -0.258  -3.597
  944    HA   PRO 149           HA       PRO 149  -0.596  -0.587  -5.229
  945   1HB   PRO 149          1HB       PRO 149  -0.781  -1.570  -2.612
  946   2HB   PRO 149          2HB       PRO 149  -0.311  -2.510  -4.041
  947   1HG   PRO 149          1HG       PRO 149   1.451  -1.347  -1.908
  948   2HG   PRO 149          2HG       PRO 149   1.617  -2.890  -2.826
  949   1HD   PRO 149          1HD       PRO 149   3.085  -0.635  -3.406
  950   2HD   PRO 149          2HD       PRO 149   2.655  -1.838  -4.574
  951    H    SER 150           H        SER 150   1.067   1.091  -2.534
  952    HA   SER 150           HA       SER 150  -1.221   2.463  -1.487
  953   1HB   SER 150          1HB       SER 150   0.398   3.925  -0.406
  954   2HB   SER 150          2HB       SER 150   1.012   2.260  -0.358
  955    HG   SER 150           HG       SER 150   2.703   3.257  -1.154
  956    H    ARG 151           H        ARG 151   0.962   3.141  -4.218
  957    HA   ARG 151           HA       ARG 151   0.061   5.877  -4.629
  958   1HB   ARG 151          1HB       ARG 151   2.159   4.277  -5.571
  959   2HB   ARG 151          2HB       ARG 151   1.144   4.463  -6.976
  960   1HG   ARG 151          1HG       ARG 151   2.422   6.653  -5.308
  961   2HG   ARG 151          2HG       ARG 151   2.886   6.148  -6.919
  962   1HD   ARG 151          1HD       ARG 151   1.571   7.700  -7.806
  963   2HD   ARG 151          2HD       ARG 151   0.156   6.897  -7.155
  964    HE   ARG 151           HE       ARG 151   1.758   8.923  -5.599
  965   1HH1  ARG 151          1HH1      ARG 151  -1.472   7.891  -6.632
  966   2HH1  ARG 151          2HH1      ARG 151  -2.163   9.340  -5.873
  967   1HH2  ARG 151          1HH2      ARG 151   0.652  10.601  -4.582
  968   2HH2  ARG 151          2HH2      ARG 151  -1.107  10.647  -4.805
  969    H    LEU 152           H        LEU 152  -0.811   2.668  -5.977
  970    HA   LEU 152           HA       LEU 152  -2.784   3.648  -7.866
  971   1HB   LEU 152          1HB       LEU 152  -1.855   1.432  -8.090
  972   2HB   LEU 152          2HB       LEU 152  -2.309   1.008  -6.436
  973    HG   LEU 152           HG       LEU 152  -4.665   0.952  -7.008
  974   1HD1  LEU 152          1HD1      LEU 152  -4.658   2.731  -8.812
  975   2HD1  LEU 152          2HD1      LEU 152  -3.834   1.574  -9.872
  976   3HD1  LEU 152          3HD1      LEU 152  -5.472   1.239  -9.257
  977   1HD2  LEU 152          1HD2      LEU 152  -3.164  -1.061  -7.399
  978   2HD2  LEU 152          2HD2      LEU 152  -4.635  -1.021  -8.400
  979   3HD2  LEU 152          3HD2      LEU 152  -3.072  -0.572  -9.098
  980    H    LYS 153           H        LYS 153  -2.940   2.374  -4.472
  981    HA   LYS 153           HA       LYS 153  -5.726   2.612  -4.069
  982   1HB   LYS 153          1HB       LYS 153  -4.114   1.521  -2.515
  983   2HB   LYS 153          2HB       LYS 153  -3.508   3.109  -2.026
  984   1HG   LYS 153          1HG       LYS 153  -5.743   3.689  -1.121
  985   2HG   LYS 153          2HG       LYS 153  -6.377   2.127  -1.680
  986   1HD   LYS 153          1HD       LYS 153  -4.775   0.951  -0.187
  987   2HD   LYS 153          2HD       LYS 153  -4.139   2.519   0.362
  988   1HE   LYS 153          1HE       LYS 153  -6.399   3.133   1.204
  989   2HE   LYS 153          2HE       LYS 153  -7.030   1.574   0.658
  990   1HZ   LYS 153          1HZ       LYS 153  -6.467   1.523   3.020
  991   2HZ   LYS 153          2HZ       LYS 153  -5.497   0.486   2.215
  992   3HZ   LYS 153          3HZ       LYS 153  -4.916   1.928   2.719
  993    H    ARG 154           H        ARG 154  -3.161   5.092  -3.725
  994    HA   ARG 154           HA       ARG 154  -4.931   7.206  -2.833
  995   1HB   ARG 154          1HB       ARG 154  -2.151   7.104  -4.043
  996   2HB   ARG 154          2HB       ARG 154  -2.982   8.644  -3.789
  997   1HG   ARG 154          1HG       ARG 154  -3.193   8.304  -1.442
  998   2HG   ARG 154          2HG       ARG 154  -2.599   6.642  -1.533
  999   1HD   ARG 154          1HD       ARG 154  -0.955   9.038  -2.430
 1000   2HD   ARG 154          2HD       ARG 154  -0.956   8.450  -0.762
 1001    HE   ARG 154           HE       ARG 154  -0.418   6.170  -2.170
 1002   1HH1  ARG 154          1HH1      ARG 154   1.124   9.312  -2.180
 1003   2HH1  ARG 154          2HH1      ARG 154   2.680   8.665  -2.634
 1004   1HH2  ARG 154          1HH2      ARG 154   1.736   5.367  -2.397
 1005   2HH2  ARG 154          2HH2      ARG 154   2.996   6.497  -2.727
 1006    H    HIS 155           H        HIS 155  -3.817   6.070  -6.052
 1007    HA   HIS 155           HA       HIS 155  -5.020   8.174  -7.584
 1008   1HB   HIS 155          1HB       HIS 155  -3.395   6.712  -8.614
 1009   2HB   HIS 155          2HB       HIS 155  -4.387   5.277  -8.318
 1010    HD1  HIS 155           HD1      HIS 155  -4.570   8.522 -10.398
 1011    HD2  HIS 155           HD2      HIS 155  -6.362   4.739  -9.981
 1012    HE1  HIS 155           HE1      HIS 155  -6.426   8.443 -12.120
 1013    H    GLU 156           H        GLU 156  -6.307   4.997  -6.435
 1014    HA   GLU 156           HA       GLU 156  -8.818   5.094  -7.696
 1015   1HB   GLU 156          1HB       GLU 156  -7.949   3.927  -5.013
 1016   2HB   GLU 156          2HB       GLU 156  -9.596   3.787  -5.618
 1017   1HG   GLU 156          1HG       GLU 156  -8.757   2.715  -7.692
 1018   2HG   GLU 156          2HG       GLU 156  -7.117   2.757  -7.053
 1019    H    LYS 157           H        LYS 157  -7.632   6.914  -4.891
 1020    HA   LYS 157           HA       LYS 157 -10.151   7.800  -3.832
 1021   1HB   LYS 157          1HB       LYS 157  -7.715   8.003  -2.877
 1022   2HB   LYS 157          2HB       LYS 157  -7.642   9.518  -3.799
 1023   1HG   LYS 157          1HG       LYS 157  -9.506  10.445  -2.558
 1024   2HG   LYS 157          2HG       LYS 157  -9.912   8.864  -1.898
 1025   1HD   LYS 157          1HD       LYS 157  -8.970   9.759  -0.084
 1026   2HD   LYS 157          2HD       LYS 157  -7.556   8.959  -0.730
 1027   1HE   LYS 157          1HE       LYS 157  -8.150  11.879  -1.368
 1028   2HE   LYS 157          2HE       LYS 157  -7.534  11.432   0.216
 1029   1HZ   LYS 157          1HZ       LYS 157  -5.692  12.006  -1.117
 1030   2HZ   LYS 157          2HZ       LYS 157  -5.606  10.393  -0.906
 1031   3HZ   LYS 157          3HZ       LYS 157  -6.080  11.018  -2.350
 1032    H    VAL 158           H        VAL 158  -8.273   8.745  -6.689
 1033    HA   VAL 158           HA       VAL 158  -9.474  11.283  -7.205
 1034    HB   VAL 158           HB       VAL 158  -8.543   9.225  -9.269
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.676  12.251  -9.432
 1036   2HG1  VAL 158          2HG1      VAL 158  -8.099  11.140 -10.694
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.815  11.133 -10.250
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.682   9.927  -7.648
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.428  10.515  -9.316
 1040   3HG2  VAL 158          3HG2      VAL 158  -7.116  11.596  -8.072
 1041    H    HIS 159           H        HIS 159 -10.475   7.953  -8.051
 1042    HA   HIS 159           HA       HIS 159 -12.852   8.828  -9.502
 1043   1HB   HIS 159          1HB       HIS 159 -11.951   6.106  -8.451
 1044   2HB   HIS 159          2HB       HIS 159 -13.404   6.370  -9.431
 1045    HD1  HIS 159           HD1      HIS 159 -12.660   7.872 -11.879
 1046    HD2  HIS 159           HD2      HIS 159  -9.855   5.479  -9.856
 1047    HE1  HIS 159           HE1      HIS 159 -10.752   7.442 -13.518
 1048    H    ALA 160           H        ALA 160 -12.074   7.858  -6.163
 1049    HA   ALA 160           HA       ALA 160 -14.812   7.552  -5.277
 1050   1HB   ALA 160          1HB       ALA 160 -12.337   8.248  -3.633
 1051   2HB   ALA 160          2HB       ALA 160 -13.853   7.549  -3.038
 1052   3HB   ALA 160          3HB       ALA 160 -12.805   6.593  -4.105
 1053    H    GLY 161           H        GLY 161 -12.606  10.321  -5.634
 1054   1HA   GLY 161          1HA       GLY 161 -13.378  12.564  -5.883
 1055   2HA   GLY 161          2HA       GLY 161 -14.869  12.148  -5.043
 1056    H    TYR 162           H        TYR 162 -13.632  14.457  -4.362
 1057    HA   TYR 162           HA       TYR 162 -12.398  13.837  -1.696
 1058   1HB   TYR 162          1HB       TYR 162 -11.777  16.207  -3.509
 1059   2HB   TYR 162          2HB       TYR 162 -11.056  15.889  -1.925
 1060    HD1  TYR 162           HD1      TYR 162 -11.435  14.642  -5.401
 1061    HD2  TYR 162           HD2      TYR 162  -9.112  14.362  -1.787
 1062    HE1  TYR 162           HE1      TYR 162  -9.997  13.005  -6.480
 1063    HE2  TYR 162           HE2      TYR 162  -7.441  12.954  -3.017
 1064    HH   TYR 162           HH       TYR 162  -6.896  11.911  -5.045
 1065    HA   PRO 163           HA       PRO 163 -16.265  16.083  -1.045
 1066   1HB   PRO 163          1HB       PRO 163 -17.059  14.880   1.279
 1067   2HB   PRO 163          2HB       PRO 163 -17.114  14.032  -0.293
 1068   1HG   PRO 163          1HG       PRO 163 -14.960  13.843   1.828
 1069   2HG   PRO 163          2HG       PRO 163 -15.794  12.510   0.968
 1070   1HD   PRO 163          1HD       PRO 163 -13.354  13.491   0.189
 1071   2HD   PRO 163          2HD       PRO 163 -14.555  12.869  -0.990
 1072    H    CYS 164           H        CYS 164 -16.817  17.885   0.138
 1073    HA   CYS 164           HA       CYS 164 -14.751  19.159   1.712
 1074   1HB   CYS 164          1HB       CYS 164 -16.582  20.234   0.212
 1075   2HB   CYS 164          2HB       CYS 164 -17.656  20.025   1.615
 1076    H    LYS 165           H        LYS 165 -14.570  19.486   3.861
 1077    HA   LYS 165           HA       LYS 165 -16.714  18.509   5.676
 1078   1HB   LYS 165          1HB       LYS 165 -13.763  17.758   5.921
 1079   2HB   LYS 165          2HB       LYS 165 -14.970  17.453   7.164
 1080   1HG   LYS 165          1HG       LYS 165 -15.048  16.227   4.378
 1081   2HG   LYS 165          2HG       LYS 165 -14.375  15.461   5.811
 1082   1HD   LYS 165          1HD       LYS 165 -16.556  15.497   6.933
 1083   2HD   LYS 165          2HD       LYS 165 -17.288  16.332   5.549
 1084   1HE   LYS 165          1HE       LYS 165 -16.693  14.427   4.076
 1085   2HE   LYS 165          2HE       LYS 165 -15.974  13.582   5.457
 1086   1HZ   LYS 165          1HZ       LYS 165 -18.838  14.349   5.234
 1087   2HZ   LYS 165          2HZ       LYS 165 -18.252  12.837   5.051
 1088   3HZ   LYS 165          3HZ       LYS 165 -18.176  13.567   6.506
 1089    H    LYS 166           H        LYS 166 -15.170  21.079   4.601
 1090    HA   LYS 166           HA       LYS 166 -13.993  22.287   6.984
 1091   1HB   LYS 166          1HB       LYS 166 -14.758  23.163   4.229
 1092   2HB   LYS 166          2HB       LYS 166 -14.754  24.414   5.460
 1093   1HG   LYS 166          1HG       LYS 166 -12.649  24.296   4.229
 1094   2HG   LYS 166          2HG       LYS 166 -12.468  24.109   5.979
 1095   1HD   LYS 166          1HD       LYS 166 -12.210  21.642   5.684
 1096   2HD   LYS 166          2HD       LYS 166 -12.360  21.857   3.925
 1097   1HE   LYS 166          1HE       LYS 166 -10.374  23.334   3.944
 1098   2HE   LYS 166          2HE       LYS 166 -10.252  23.188   5.700
 1099   1HZ   LYS 166          1HZ       LYS 166  -8.744  21.654   4.489
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.789  20.844   5.448
 1101   3HZ   LYS 166          3HZ       LYS 166 -10.043  20.888   3.836
 1102    H    ASP 167           H        ASP 167 -17.277  21.823   5.871
 1103    HA   ASP 167           HA       ASP 167 -18.265  23.116   8.336
 1104   1HB   ASP 167          1HB       ASP 167 -18.226  24.895   6.491
 1105   2HB   ASP 167          2HB       ASP 167 -19.427  23.933   5.635
 1106    H    ASP 168           H        ASP 168 -20.182  22.226   9.082
 1107    HA   ASP 168           HA       ASP 168 -20.793  19.586   8.225
 1108   1HB   ASP 168          1HB       ASP 168 -21.131  20.511  10.525
 1109   2HB   ASP 168          2HB       ASP 168 -22.482  21.472   9.924
 1110    H    SER 169           H        SER 169 -22.175  22.719   7.281
 1111    HA   SER 169           HA       SER 169 -24.470  21.392   5.921
 1112   1HB   SER 169          1HB       SER 169 -23.787  24.341   6.313
 1113   2HB   SER 169          2HB       SER 169 -25.269  23.718   5.571
 1114    HG   SER 169           HG       SER 169 -25.531  24.224   7.809
 1115    H    CYS 170           H        CYS 170 -21.485  21.386   5.010
 1116    HA   CYS 170           HA       CYS 170 -21.803  22.591   2.297
 1117   1HB   CYS 170          1HB       CYS 170 -19.597  22.592   3.854
 1118   2HB   CYS 170          2HB       CYS 170 -19.361  21.014   3.122
 1119    H    SER 171           H        SER 171 -21.260  21.132   0.420
 1120    HA   SER 171           HA       SER 171 -21.841  18.247   0.849
 1121   1HB   SER 171          1HB       SER 171 -23.748  18.288  -0.729
 1122   2HB   SER 171          2HB       SER 171 -24.066  19.271   0.707
 1123    HG   SER 171           HG       SER 171 -24.667  20.353  -1.230
 1124    H    PHE 172           H        PHE 172 -20.033  20.586  -0.690
 1125    HA   PHE 172           HA       PHE 172 -19.933  19.696  -3.397
 1126   1HB   PHE 172          1HB       PHE 172 -19.035  21.847  -2.870
 1127   2HB   PHE 172          2HB       PHE 172 -18.010  21.194  -1.596
 1128    HD1  PHE 172           HD1      PHE 172 -15.925  20.012  -2.077
 1129    HD2  PHE 172           HD2      PHE 172 -18.377  21.508  -5.278
 1130    HE1  PHE 172           HE1      PHE 172 -14.100  19.561  -3.687
 1131    HE2  PHE 172           HE2      PHE 172 -16.459  21.271  -6.854
 1132    HZ   PHE 172           HZ       PHE 172 -14.298  20.342  -6.041
 1133    H    VAL 173           H        VAL 173 -18.840  18.094  -4.425
 1134    HA   VAL 173           HA       VAL 173 -16.638  16.712  -2.956
 1135    HB   VAL 173           HB       VAL 173 -18.677  15.356  -4.762
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.526  13.255  -4.051
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.384  14.303  -4.892
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.353  14.204  -3.121
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.213  14.080  -2.597
 1140   2HG2  VAL 173          2HG2      VAL 173 -18.321  15.365  -1.738
 1141   3HG2  VAL 173          3HG2      VAL 173 -19.769  15.754  -2.675
 1142    H    GLY 174           H        GLY 174 -14.773  17.008  -3.986
 1143   1HA   GLY 174          1HA       GLY 174 -14.818  18.026  -6.756
 1144   2HA   GLY 174          2HA       GLY 174 -13.400  17.872  -5.700
 1145    H    LYS 175           H        LYS 175 -14.184  17.007  -8.606
 1146    HA   LYS 175           HA       LYS 175 -13.901  14.171  -8.706
 1147   1HB   LYS 175          1HB       LYS 175 -14.620  15.738 -10.570
 1148   2HB   LYS 175          2HB       LYS 175 -12.922  16.182 -10.778
 1149   1HG   LYS 175          1HG       LYS 175 -12.374  13.837 -11.372
 1150   2HG   LYS 175          2HG       LYS 175 -14.037  13.351 -11.020
 1151   1HD   LYS 175          1HD       LYS 175 -13.745  13.525 -13.407
 1152   2HD   LYS 175          2HD       LYS 175 -14.836  14.813 -12.878
 1153   1HE   LYS 175          1HE       LYS 175 -12.955  16.439 -12.948
 1154   2HE   LYS 175          2HE       LYS 175 -11.844  15.143 -13.408
 1155   1HZ   LYS 175          1HZ       LYS 175 -14.161  16.055 -15.032
 1156   2HZ   LYS 175          2HZ       LYS 175 -12.596  16.391 -15.349
 1157   3HZ   LYS 175          3HZ       LYS 175 -13.135  14.856 -15.458
 1158    H    THR 176           H        THR 176 -11.560  16.678  -8.024
 1159    HA   THR 176           HA       THR 176  -9.454  14.614  -7.733
 1160    HB   THR 176           HB       THR 176  -7.878  16.539  -8.764
 1161    HG1  THR 176           HG1      THR 176  -9.034  17.911  -9.783
 1162   1HG2  THR 176          1HG2      THR 176  -7.848  15.226 -10.867
 1163   2HG2  THR 176          2HG2      THR 176  -7.786  14.206  -9.412
 1164   3HG2  THR 176          3HG2      THR 176  -9.296  14.374 -10.347
 1165    H    TRP 177           H        TRP 177  -7.597  15.375  -6.492
 1166    HA   TRP 177           HA       TRP 177  -8.411  16.586  -4.104
 1167   1HB   TRP 177          1HB       TRP 177  -6.494  15.132  -4.229
 1168   2HB   TRP 177          2HB       TRP 177  -5.683  16.188  -5.350
 1169    HD1  TRP 177           HD1      TRP 177  -3.690  17.007  -4.306
 1170    HE1  TRP 177           HE1      TRP 177  -2.967  18.153  -2.111
 1171    HE3  TRP 177           HE3      TRP 177  -7.970  16.304  -1.673
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.834  17.823   0.624
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.929  16.535   0.803
 1174    HH2  TRP 177           HH2      TRP 177  -5.856  17.241   1.959
 1175    H    THR 178           H        THR 178  -6.709  18.081  -6.906
 1176    HA   THR 178           HA       THR 178  -6.220  20.637  -5.787
 1177    HB   THR 178           HB       THR 178  -6.566  21.452  -8.199
 1178    HG1  THR 178           HG1      THR 178  -6.352  18.896  -9.146
 1179   1HG2  THR 178          1HG2      THR 178  -4.515  20.508  -9.076
 1180   2HG2  THR 178          2HG2      THR 178  -4.339  21.020  -7.389
 1181   3HG2  THR 178          3HG2      THR 178  -4.485  19.301  -7.781
 1182    H    LEU 179           H        LEU 179  -9.142  19.434  -7.525
 1183    HA   LEU 179           HA       LEU 179 -10.522  21.897  -7.550
 1184   1HB   LEU 179          1HB       LEU 179 -11.642  19.056  -7.469
 1185   2HB   LEU 179          2HB       LEU 179 -12.576  20.501  -7.850
 1186    HG   LEU 179           HG       LEU 179 -10.257  19.405  -9.463
 1187   1HD1  LEU 179          1HD1      LEU 179 -11.988  18.936 -11.146
 1188   2HD1  LEU 179          2HD1      LEU 179 -12.331  18.104  -9.627
 1189   3HD1  LEU 179          3HD1      LEU 179 -13.243  19.571 -10.055
 1190   1HD2  LEU 179          1HD2      LEU 179 -12.026  21.836  -9.982
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.264  21.832  -9.734
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.944  21.095 -11.181
 1193    H    TYR 180           H        TYR 180 -10.282  19.446  -4.982
 1194    HA   TYR 180           HA       TYR 180 -12.393  20.613  -3.336
 1195   1HB   TYR 180          1HB       TYR 180 -11.950  18.357  -2.917
 1196   2HB   TYR 180          2HB       TYR 180 -10.207  18.572  -2.912
 1197    HD1  TYR 180           HD1      TYR 180 -13.041  20.213  -0.977
 1198    HD2  TYR 180           HD2      TYR 180  -9.283  18.109  -0.861
 1199    HE1  TYR 180           HE1      TYR 180 -12.980  20.441   1.498
 1200    HE2  TYR 180           HE2      TYR 180  -9.276  18.248   1.621
 1201    HH   TYR 180           HH       TYR 180 -10.510  18.752   3.474
 1202    H    LEU 181           H        LEU 181  -8.787  20.644  -3.249
 1203    HA   LEU 181           HA       LEU 181  -8.518  22.479  -1.109
 1204   1HB   LEU 181          1HB       LEU 181  -6.806  21.952  -3.575
 1205   2HB   LEU 181          2HB       LEU 181  -6.332  23.054  -2.316
 1206    HG   LEU 181           HG       LEU 181  -6.864  20.037  -2.022
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.332  21.688  -2.192
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.358  20.100  -1.427
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.803  20.233  -3.127
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.839  20.272   0.288
 1211   2HD2  LEU 181          2HD2      LEU 181  -6.081  22.037   0.111
 1212   3HD2  LEU 181          3HD2      LEU 181  -7.462  20.920   0.095
 1213    H    LYS 182           H        LYS 182  -8.924  23.100  -4.620
 1214    HA   LYS 182           HA       LYS 182  -8.733  25.970  -4.514
 1215   1HB   LYS 182          1HB       LYS 182  -8.632  24.461  -6.581
 1216   2HB   LYS 182          2HB       LYS 182 -10.371  24.298  -6.467
 1217   1HG   LYS 182          1HG       LYS 182  -9.875  25.952  -8.118
 1218   2HG   LYS 182          2HG       LYS 182 -10.606  26.777  -6.750
 1219   1HD   LYS 182          1HD       LYS 182  -8.744  28.053  -7.720
 1220   2HD   LYS 182          2HD       LYS 182  -8.401  27.625  -6.042
 1221   1HE   LYS 182          1HE       LYS 182  -6.932  25.796  -6.759
 1222   2HE   LYS 182          2HE       LYS 182  -7.381  26.048  -8.452
 1223   1HZ   LYS 182          1HZ       LYS 182  -5.973  28.087  -6.812
 1224   2HZ   LYS 182          2HZ       LYS 182  -5.234  27.074  -7.861
 1225   3HZ   LYS 182          3HZ       LYS 182  -6.290  28.175  -8.423
 1226    H    HIS 183           H        HIS 183 -11.532  23.714  -4.265
 1227    HA   HIS 183           HA       HIS 183 -13.582  25.693  -4.072
 1228   1HB   HIS 183          1HB       HIS 183 -14.240  23.438  -4.461
 1229   2HB   HIS 183          2HB       HIS 183 -13.328  22.814  -3.100
 1230    HD1  HIS 183           HD1      HIS 183 -16.681  24.566  -3.772
 1231    HD2  HIS 183           HD2      HIS 183 -14.380  22.953  -0.638
 1232    HE1  HIS 183           HE1      HIS 183 -18.200  24.487  -1.723
 1233    H    VAL 184           H        VAL 184 -11.475  24.172  -1.604
 1234    HA   VAL 184           HA       VAL 184 -12.732  25.293   0.698
 1235    HB   VAL 184           HB       VAL 184  -9.990  24.198   0.090
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.482  26.007   1.692
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.759  25.394   2.778
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.312  24.406   2.414
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.328  23.468   1.900
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.839  22.677   0.387
 1241   3HG2  VAL 184          3HG2      VAL 184 -10.772  22.545   1.772
 1242    H    ALA 185           H        ALA 185 -10.037  26.487  -1.334
 1243    HA   ALA 185           HA       ALA 185  -9.499  28.775   0.265
 1244   1HB   ALA 185          1HB       ALA 185  -9.053  28.346  -2.730
 1245   2HB   ALA 185          2HB       ALA 185  -8.272  29.584  -1.723
 1246   3HB   ALA 185          3HB       ALA 185  -7.935  27.865  -1.433
 1247    H    GLU 186           H        GLU 186 -11.904  28.155  -2.274
 1248    HA   GLU 186           HA       GLU 186 -12.543  31.008  -2.604
 1249   1HB   GLU 186          1HB       GLU 186 -12.502  29.346  -4.481
 1250   2HB   GLU 186          2HB       GLU 186 -13.907  28.540  -3.776
 1251   1HG   GLU 186          1HG       GLU 186 -15.279  30.538  -4.141
 1252   2HG   GLU 186          2HG       GLU 186 -13.858  31.469  -4.625
 1253    H    CYS 187           H        CYS 187 -13.872  28.198  -0.866
 1254    HA   CYS 187           HA       CYS 187 -16.387  29.726  -0.297
 1255   1HB   CYS 187          1HB       CYS 187 -15.811  26.727  -0.222
 1256   2HB   CYS 187          2HB       CYS 187 -17.369  27.482   0.140
 1257    HG   CYS 187           HG       CYS 187 -15.589  27.546  -2.641
 1258    H    HIS 188           H        HIS 188 -13.527  28.496   1.289
 1259    HA   HIS 188           HA       HIS 188 -14.793  29.047   3.950
 1260   1HB   HIS 188          1HB       HIS 188 -12.948  26.699   3.333
 1261   2HB   HIS 188          2HB       HIS 188 -13.658  27.088   4.907
 1262    HD1  HIS 188           HD1      HIS 188 -16.526  26.892   4.911
 1263    HD2  HIS 188           HD2      HIS 188 -14.265  25.150   1.835
 1264    HE1  HIS 188           HE1      HIS 188 -18.043  25.141   3.814
 1265    H    GLN 189           H        GLN 189 -12.914  30.573   2.092
 1266    HA   GLN 189           HA       GLN 189 -11.075  31.382   4.247
 1267   1HB   GLN 189          1HB       GLN 189  -9.879  29.618   2.830
 1268   2HB   GLN 189          2HB       GLN 189  -9.898  30.749   1.498
 1269   1HG   GLN 189          1HG       GLN 189  -8.620  31.270   4.216
 1270   2HG   GLN 189          2HG       GLN 189  -7.766  30.648   2.805
 1271   1HE2  GLN 189          1HE2      GLN 189  -8.305  32.192   0.685
 1272   2HE2  GLN 189          2HE2      GLN 189  -7.985  33.881   1.051
 1273    H    ASP 190           H        ASP 190 -11.695  31.888   0.705
 1274    HA   ASP 190           HA       ASP 190 -11.229  34.727   0.789
 1275   1HB   ASP 190          1HB       ASP 190 -11.153  33.333  -1.276
 1276   2HB   ASP 190          2HB       ASP 190 -12.898  33.090  -1.177
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  -7.267  30.168 -14.364
    2   2H5*    G   1          2H5*        G   1  -8.201  28.682 -14.108
    3    H4*    G   1           H4*        G   1  -7.412  28.739 -16.382
    4    H3*    G   1           H3*        G   1  -5.887  26.733 -14.706
    5    H2*    G   1           H2*        G   1  -4.947  25.964 -16.818
    6   2HO*    G   1          2HO*        G   1  -7.032  26.521 -18.030
    7    H1*    G   1           H1*        G   1  -4.274  28.454 -17.603
    8    H8     G   1           H8         G   1  -3.937  28.864 -13.892
    9    H1     G   1           H1         G   1   0.957  25.697 -16.602
   10   1H2     G   1          1H2         G   1   0.362  24.874 -18.518
   11   2H2     G   1          2H2         G   1  -1.158  25.338 -19.271
   12   1H5*    G   2          1H5*        G   2  -7.175  24.479 -17.964
   13   2H5*    G   2          2H5*        G   2  -7.878  22.944 -17.439
   14    H4*    G   2           H4*        G   2  -6.128  22.583 -19.101
   15    H3*    G   2           H3*        G   2  -5.367  21.652 -16.322
   16    H2*    G   2           H2*        G   2  -3.474  20.581 -17.410
   17   2HO*    G   2          2HO*        G   2  -4.814  20.153 -19.453
   18    H1*    G   2           H1*        G   2  -2.829  22.812 -18.829
   19    H8     G   2           H8         G   2  -4.197  24.243 -15.612
   20    H1     G   2           H1         G   2   1.723  21.805 -15.017
   21   1H2     G   2          1H2         G   2   2.138  20.455 -16.649
   22   2H2     G   2          2H2         G   2   1.046  20.278 -18.007
   23   1H5*    G   3          1H5*        G   3  -4.722  18.281 -18.660
   24   2H5*    G   3          2H5*        G   3  -5.444  16.842 -17.932
   25    H4*    G   3           H4*        G   3  -3.066  16.476 -18.410
   26    H3*    G   3           H3*        G   3  -3.736  16.670 -15.454
   27    H2*    G   3           H2*        G   3  -1.479  15.888 -15.087
   28   2HO*    G   3          2HO*        G   3  -1.637  14.450 -17.105
   29    H1*    G   3           H1*        G   3  -0.391  17.536 -16.998
   30    H8     G   3           H8         G   3  -3.093  19.576 -15.271
   31    H1     G   3           H1         G   3   2.411  19.137 -11.957
   32   1H2     G   3          1H2         G   3   3.584  17.487 -12.688
   33   2H2     G   3          2H2         G   3   3.126  16.583 -14.118
   34   1H5*    C   4          1H5*        C   4  -1.809  13.035 -15.577
   35   2H5*    C   4          2H5*        C   4  -2.658  11.834 -14.608
   36    H4*    C   4           H4*        C   4  -0.369  12.049 -13.842
   37    H3*    C   4           H3*        C   4  -2.411  13.181 -11.899
   38    H2*    C   4           H2*        C   4  -0.591  13.446 -10.382
   39   2HO*    C   4          2HO*        C   4   0.353  11.286 -11.114
   40    H1*    C   4           H1*        C   4   1.245  14.246 -12.328
   41   1H4     C   4          1H4         C   4  -0.984  19.265  -9.086
   42   2H4     C   4          2H4         C   4  -2.464  19.263 -10.015
   43    H5     C   4           H5         C   4  -2.936  17.653 -11.735
   44    H6     C   4           H6         C   4  -2.101  15.643 -12.855
   45   1H5*    C   5          1H5*        C   5  -1.341  11.777  -8.965
   46   2H5*    C   5          2H5*        C   5  -2.468  10.669  -8.197
   47    H4*    C   5           H4*        C   5  -1.786  12.685  -6.893
   48    H3*    C   5           H3*        C   5  -4.225  11.400  -6.703
   49    H2*    C   5           H2*        C   5  -5.294  12.894  -8.300
   50   2HO*    C   5          2HO*        C   5  -5.614  13.777  -5.625
   51    H1*    C   5           H1*        C   5  -4.027  15.195  -6.878
   52   1H4     C   5          1H4         C   5  -5.992  18.511 -11.870
   53   2H4     C   5          2H4         C   5  -5.711  17.182 -12.964
   54    H5     C   5           H5         C   5  -4.964  15.029 -12.231
   55    H6     C   5           H6         C   5  -4.404  13.673 -10.274
   56   1H5*    A   6          1H5*        A   6  -2.166  14.774  -4.576
   57   2H5*    A   6          2H5*        A   6  -0.807  13.643  -4.575
   58    H4*    A   6           H4*        A   6  -0.165  15.577  -3.529
   59    H3*    A   6           H3*        A   6  -0.451  13.277  -1.657
   60    H2*    A   6           H2*        A   6  -0.076  14.675   0.267
   61   2HO*    A   6          2HO*        A   6   1.621  15.998  -0.229
   62    H1*    A   6           H1*        A   6  -1.407  16.905  -0.550
   63    H8     A   6           H8         A   6  -3.950  14.767  -1.879
   64   1H6     A   6          1H6         A   6  -5.857  13.614   3.902
   65   2H6     A   6          2H6         A   6  -6.191  13.349   2.210
   66    H2     A   6           H2         A   6  -1.967  15.725   4.155
   67   1H5*    U   7          1H5*        U   7   3.316  12.596   0.525
   68   2H5*    U   7          2H5*        U   7   2.296  13.937   0.027
   69    H4*    U   7           H4*        U   7   4.099  14.731   1.392
   70    H3*    U   7           H3*        U   7   3.395  15.961  -0.994
   71    H2*    U   7           H2*        U   7   5.117  14.858  -2.222
   72   2HO*    U   7          2HO*        U   7   5.941  17.397  -1.303
   73    H1*    U   7           H1*        U   7   7.015  15.406   0.095
   74    H3     U   7           H3         U   7  10.519  13.646  -2.079
   75    H5     U   7           H5         U   7   7.639  10.619  -2.221
   76    H6     U   7           H6         U   7   5.974  12.230  -1.424
   77   1H5*    A   8          1H5*        A   8   4.245  19.679  -1.016
   78   2H5*    A   8          2H5*        A   8   3.555  20.492   0.394
   79    H4*    A   8           H4*        A   8   2.759  21.635  -1.484
   80    H3*    A   8           H3*        A   8   0.962  20.649   0.313
   81    H2*    A   8           H2*        A   8   0.528  18.690  -1.046
   82   2HO*    A   8          2HO*        A   8  -1.532  19.641  -0.476
   83    H1*    A   8           H1*        A   8   0.246  20.647  -3.316
   84    H8     A   8           H8         A   8   2.439  17.490  -3.256
   85   1H6     A   8          1H6         A   8  -1.364  15.456  -7.713
   86   2H6     A   8          2H6         A   8   0.209  15.258  -6.979
   87    H2     A   8           H2         A   8  -3.187  19.082  -5.906
   88   1H5*    C   9          1H5*        C   9  -2.279  22.059  -0.462
   89   2H5*    C   9          2H5*        C   9  -2.569  23.560   0.427
   90    H4*    C   9           H4*        C   9  -4.121  21.923   1.166
   91    H3*    C   9           H3*        C   9  -2.042  22.522   3.245
   92    H2*    C   9           H2*        C   9  -3.242  20.998   4.696
   93   2HO*    C   9          2HO*        C   9  -5.371  21.758   3.517
   94    H1*    C   9           H1*        C   9  -3.612  19.041   2.852
   95   1H4     C   9          1H4         C   9   2.050  17.815   5.599
   96   2H4     C   9          2H4         C   9   2.824  18.372   4.129
   97    H5     C   9           H5         C   9   1.648  19.540   2.409
   98    H6     C   9           H6         C   9  -0.538  20.337   1.684
   99   1H5*    C  10          1H5*        C  10  -5.511  22.650   5.288
  100   2H5*    C  10          2H5*        C  10  -5.702  24.029   6.370
  101    H4*    C  10           H4*        C  10  -5.855  21.903   7.593
  102    H3*    C  10           H3*        C  10  -3.364  23.519   8.221
  103    H2*    C  10           H2*        C  10  -2.999  21.946   9.998
  104   2HO*    C  10          2HO*        C  10  -5.363  21.735  10.494
  105    H1*    C  10           H1*        C  10  -3.558  19.741   8.423
  106   1H4     C  10          1H4         C  10   2.716  20.377   7.896
  107   2H4     C  10          2H4         C  10   2.498  21.286   6.417
  108    H5     C  10           H5         C  10   0.356  22.052   5.647
  109    H6     C  10           H6         C  10  -2.043  22.067   6.141
  110   1H5*    U  11          1H5*        U  11  -4.790  23.693  12.152
  111   2H5*    U  11          2H5*        U  11  -4.361  25.275  12.817
  112    H4*    U  11           H4*        U  11  -3.180  23.274  13.820
  113    H3*    U  11           H3*        U  11  -1.529  25.442  12.537
  114    H2*    U  11           H2*        U  11   0.355  24.420  13.611
  115   2HO*    U  11          2HO*        U  11  -0.958  23.896  15.611
  116    H1*    U  11           H1*        U  11  -0.454  21.864  12.978
  117    H3     U  11           H3         U  11   3.216  22.752  10.377
  118    H5     U  11           H5         U  11   0.095  24.738   8.415
  119    H6     U  11           H6         U  11  -1.371  24.194  10.309
  120   1H5*    C  12          1H5*        C  12   0.176  26.341  16.748
  121   2H5*    C  12          2H5*        C  12   1.134  27.702  16.163
  122    H4*    C  12           H4*        C  12   1.700  24.744  16.149
  123    H3*    C  12           H3*        C  12   2.771  26.852  17.519
  124    H2*    C  12           H2*        C  12   3.400  28.053  15.548
  125   2HO*    C  12          2HO*        C  12   5.382  27.139  17.034
  126    H1*    C  12           H1*        C  12   4.598  25.474  14.483
  127   1H4     C  12          1H4         C  12   5.501  29.440   9.581
  128   2H4     C  12          2H4         C  12   3.823  29.920   9.585
  129    H5     C  12           H5         C  12   2.232  29.111  11.190
  130    H6     C  12           H6         C  12   1.931  27.661  13.144
  131   1H5*    U  13          1H5*        U  13   3.913  22.377  18.501
  132   2H5*    U  13          2H5*        U  13   4.722  22.396  20.071
  133    H4*    U  13           H4*        U  13   5.796  20.590  19.169
  134    H3*    U  13           H3*        U  13   7.541  22.775  19.058
  135    H2*    U  13           H2*        U  13   6.906  23.294  16.792
  136   2HO*    U  13          2HO*        U  13   9.234  21.650  16.822
  137    H1*    U  13           H1*        U  13   7.151  20.296  16.271
  138    H3     U  13           H3         U  13   6.838  21.115  11.817
  139    H5     U  13           H5         U  13   3.824  23.535  13.406
  140    H6     U  13           H6         U  13   4.510  22.830  15.657
  141   1H5*    U  14          1H5*        U  14  10.287  17.979  19.636
  142   2H5*    U  14          2H5*        U  14  11.740  18.775  19.035
  143    H4*    U  14           H4*        U  14   9.049  18.556  17.645
  144    H3*    U  14           H3*        U  14  11.438  16.947  17.541
  145    H2*    U  14           H2*        U  14  12.584  18.535  16.268
  146   2HO*    U  14          2HO*        U  14  11.094  16.868  14.519
  147    H1*    U  14           H1*        U  14   9.924  19.225  14.938
  148    H3     U  14           H3         U  14  12.265  21.744  11.935
  149    H5     U  14           H5         U  14  13.776  23.018  15.622
  150    H6     U  14           H6         U  14  12.408  21.297  16.720
  151   1H5*    G  15          1H5*        G  15   6.792  14.296  15.738
  152   2H5*    G  15          2H5*        G  15   7.291  15.830  15.003
  153    H4*    G  15           H4*        G  15   5.091  15.752  17.081
  154    H3*    G  15           H3*        G  15   4.845  15.197  14.117
  155    H2*    G  15           H2*        G  15   2.577  16.041  14.349
  156   2HO*    G  15          2HO*        G  15   2.336  15.193  16.629
  157    H1*    G  15           H1*        G  15   3.432  18.260  15.644
  158    H8     G  15           H8         G  15   6.379  17.705  13.419
  159    H1     G  15           H1         G  15   1.193  19.716  10.194
  160   1H2     G  15          1H2         G  15  -0.584  19.400  11.379
  161   2H2     G  15          2H2         G  15  -0.506  18.904  13.058
  162   1H5*    G  16          1H5*        G  16   1.223  13.708  15.536
  163   2H5*    G  16          2H5*        G  16   0.902  12.102  14.872
  164    H4*    G  16           H4*        G  16  -0.982  13.584  14.505
  165    H3*    G  16           H3*        G  16   0.488  12.897  11.944
  166    H2*    G  16           H2*        G  16  -1.415  13.933  10.836
  167   2HO*    G  16          2HO*        G  16  -2.984  13.141  12.534
  168    H1*    G  16           H1*        G  16  -1.371  16.130  12.422
  169    H8     G  16           H8         G  16   2.289  15.332  12.257
  170    H1     G  16           H1         G  16   0.007  17.195   6.568
  171   1H2     G  16          1H2         G  16  -2.150  17.491   6.663
  172   2H2     G  16          2H2         G  16  -3.071  16.990   8.068
  173   1H5*    G  17          1H5*        G  17  -3.288  11.771  10.770
  174   2H5*    G  17          2H5*        G  17  -3.254  10.249   9.870
  175    H4*    G  17           H4*        G  17  -4.163  12.114   8.552
  176    H3*    G  17           H3*        G  17  -1.552  10.995   7.502
  177    H2*    G  17           H2*        G  17  -1.960  12.468   5.571
  178   2HO*    G  17          2HO*        G  17  -4.359  12.169   5.790
  179    H1*    G  17           H1*        G  17  -2.313  14.650   7.053
  180    H8     G  17           H8         G  17  -0.107  12.887   9.459
  181    H1     G  17           H1         G  17   3.035  15.249   4.379
  182   1H2     G  17          1H2         G  17   1.625  15.825   2.827
  183   2H2     G  17          2H2         G  17  -0.087  15.446   2.953
  184   1H5*    C  18          1H5*        C  18  -3.382  10.778   3.991
  185   2H5*    C  18          2H5*        C  18  -3.198   9.213   3.176
  186    H4*    C  18           H4*        C  18  -2.210  10.949   1.813
  187    H3*    C  18           H3*        C  18  -0.033   9.317   3.156
  188    H2*    C  18           H2*        C  18   1.520  10.594   1.669
  189   2HO*    C  18          2HO*        C  18   0.398  11.169  -0.201
  190    H1*    C  18           H1*        C  18   0.544  12.877   2.467
  191   1H4     C  18          1H4         C  18   4.593  11.355   7.119
  192   2H4     C  18          2H4         C  18   3.246  10.835   8.101
  193    H5     C  18           H5         C  18   0.994  10.723   7.295
  194    H6     C  18           H6         C  18  -0.421  11.057   5.342
  195   1H5*    C  19          1H5*        C  19   1.471   9.262  -0.567
  196   2H5*    C  19          2H5*        C  19   1.885   7.625  -1.104
  197    H4*    C  19           H4*        C  19   3.776   9.129  -1.408
  198    H3*    C  19           H3*        C  19   4.204   7.043   0.787
  199    H2*    C  19           H2*        C  19   6.474   7.802   0.784
  200   2HO*    C  19          2HO*        C  19   6.302   8.128  -1.675
  201    H1*    C  19           H1*        C  19   5.874  10.486   0.678
  202   1H4     C  19          1H4         C  19   6.444   8.799   6.821
  203   2H4     C  19          2H4         C  19   4.752   8.367   6.884
  204    H5     C  19           H5         C  19   3.319   8.368   4.961
  205    H6     C  19           H6         C  19   3.198   8.899   2.575
  206   1H5*    U  20          1H5*        U  20   7.566   6.387  -1.468
  207   2H5*    U  20          2H5*        U  20   7.788   4.655  -1.778
  208    H4*    U  20           H4*        U  20   9.753   5.547  -0.770
  209    H3*    U  20           H3*        U  20   8.257   3.873   1.279
  210    H2*    U  20           H2*        U  20  10.366   3.968   2.460
  211   2HO*    U  20          2HO*        U  20  11.774   3.900   0.535
  212    H1*    U  20           H1*        U  20  10.577   6.665   2.034
  213    H3     U  20           H3         U  20   9.407   5.962   6.422
  214    H5     U  20           H5         U  20   5.769   5.777   4.365
  215    H6     U  20           H6         U  20   7.016   5.911   2.246
  216   1H5*    G  21          1H5*        G  21  11.923   1.957   0.550
  217   2H5*    G  21          2H5*        G  21  11.820   0.201   0.632
  218    H4*    G  21           H4*        G  21  13.584   1.072   2.062
  219    H3*    G  21           H3*        G  21  11.298  -0.093   3.694
  220    H2*    G  21           H2*        G  21  12.833   0.179   5.572
  221   2HO*    G  21          2HO*        G  21  14.786  -0.238   4.057
  222    H1*    G  21           H1*        G  21  13.459   2.733   4.891
  223    H8     G  21           H8         G  21   9.837   2.361   3.805
  224    H1     G  21           H1         G  21  10.568   2.879  10.183
  225   1H2     G  21          1H2         G  21  12.638   2.586  10.718
  226   2H2     G  21          2H2         G  21  13.895   2.411   9.510
  227   1H5*    G  22          1H5*        G  22  14.705  -1.927   5.026
  228   2H5*    G  22          2H5*        G  22  14.573  -3.669   5.212
  229    H4*    G  22           H4*        G  22  15.465  -2.631   7.219
  230    H3*    G  22           H3*        G  22  12.688  -3.804   7.627
  231    H2*    G  22           H2*        G  22  12.961  -3.277   9.935
  232   2HO*    G  22          2HO*        G  22  15.257  -3.915  10.021
  233    H1*    G  22           H1*        G  22  14.090  -0.806   9.521
  234    H8     G  22           H8         G  22  11.408  -1.025   6.879
  235    H1     G  22           H1         G  22   9.060  -0.109  12.802
  236   1H2     G  22          1H2         G  22  10.571  -0.549  14.276
  237   2H2     G  22          2H2         G  22  12.220  -0.947  13.832
  238   1H5*    U  23          1H5*        U  23  12.438  -7.722  10.461
  239   2H5*    U  23          2H5*        U  23  11.473  -6.396   9.777
  240    H4*    U  23           H4*        U  23  12.870  -6.304  12.464
  241    H3*    U  23           H3*        U  23   9.972  -6.560  11.578
  242    H2*    U  23           H2*        U  23   9.400  -5.759  13.745
  243   2HO*    U  23          2HO*        U  23  11.274  -6.798  14.869
  244    H1*    U  23           H1*        U  23  11.163  -3.679  13.492
  245    H3     U  23           H3         U  23   6.670  -2.555  12.748
  246    H5     U  23           H5         U  23   8.309  -3.264   8.968
  247    H6     U  23           H6         U  23  10.374  -4.039  10.061
  248   1H5*    U  24          1H5*        U  24   9.459  -8.345  14.710
  249   2H5*    U  24          2H5*        U  24   8.785  -9.976  14.726
  250    H4*    U  24           H4*        U  24   7.378  -8.549  16.035
  251    H3*    U  24           H3*        U  24   6.130  -9.063  13.339
  252    H2*    U  24           H2*        U  24   4.113  -8.237  14.232
  253   2HO*    U  24          2HO*        U  24   4.348  -9.167  16.417
  254    H1*    U  24           H1*        U  24   5.420  -6.103  15.430
  255    H3     U  24           H3         U  24   2.927  -4.699  11.774
  256    H5     U  24           H5         U  24   6.573  -5.981  10.153
  257    H6     U  24           H6         U  24   7.254  -6.729  12.390
  258   1H5*    A  25          1H5*        A  25   4.725 -13.102  11.964
  259   2H5*    A  25          2H5*        A  25   6.446 -13.395  11.764
  260    H4*    A  25           H4*        A  25   5.550 -12.954   9.603
  261    H3*    A  25           H3*        A  25   7.657 -11.326  10.437
  262    H2*    A  25           H2*        A  25   6.097  -9.534  11.050
  263   2HO*    A  25          2HO*        A  25   7.719  -8.645   9.708
  264    H1*    A  25           H1*        A  25   4.886 -10.351   8.359
  265    H8     A  25           H8         A  25   3.298  -9.223  11.771
  266   1H6     A  25          1H6         A  25   0.496  -4.897   8.260
  267   2H6     A  25          2H6         A  25   0.416  -5.747   9.790
  268    H2     A  25           H2         A  25   3.517  -7.020   5.757
  269   1H5*    G  26          1H5*        G  26   7.730 -14.198   5.255
  270   2H5*    G  26          2H5*        G  26   7.723 -12.454   5.071
  271    H4*    G  26           H4*        G  26   5.687 -13.148   7.009
  272    H3*    G  26           H3*        G  26   5.951 -15.383   5.353
  273    H2*    G  26           H2*        G  26   5.811 -13.919   3.481
  274   2HO*    G  26          2HO*        G  26   3.323 -15.279   3.868
  275    H1*    G  26           H1*        G  26   3.317 -12.899   4.899
  276    H8     G  26           H8         G  26   5.394 -12.710   1.730
  277    H1     G  26           H1         G  26   0.884  -8.178   2.224
  278   1H2     G  26          1H2         G  26   0.231  -8.029   4.277
  279   2H2     G  26          2H2         G  26   0.682  -9.214   5.494
  280   1H5*    U  27          1H5*        U  27   4.555 -15.880   8.543
  281   2H5*    U  27          2H5*        U  27   3.802 -17.461   8.823
  282    H4*    U  27           H4*        U  27   3.511 -16.469  10.888
  283    H3*    U  27           H3*        U  27   0.997 -15.685   9.354
  284    H2*    U  27           H2*        U  27   0.327 -14.385  11.251
  285   2HO*    U  27          2HO*        U  27   1.446 -16.079  12.742
  286    H1*    U  27           H1*        U  27   2.683 -13.143  11.644
  287    H3     U  27           H3         U  27  -0.029 -10.240   9.301
  288    H5     U  27           H5         U  27   2.651 -11.886   6.571
  289    H6     U  27           H6         U  27   3.172 -13.635   8.200
  290   1H5*    A  28          1H5*        A  28  -0.701 -15.906  12.966
  291   2H5*    A  28          2H5*        A  28  -1.958 -17.140  12.945
  292    H4*    A  28           H4*        A  28  -2.918 -15.058  13.699
  293    H3*    A  28           H3*        A  28  -3.784 -15.769  10.868
  294    H2*    A  28           H2*        A  28  -5.267 -13.859  11.028
  295   2HO*    A  28          2HO*        A  28  -5.661 -14.284  13.421
  296    H1*    A  28           H1*        A  28  -3.375 -12.213  12.084
  297    H8     A  28           H8         A  28  -1.177 -14.055   9.750
  298   1H6     A  28          1H6         A  28  -3.478 -10.379   5.282
  299   2H6     A  28          2H6         A  28  -2.214 -11.533   5.671
  300    H2     A  28           H2         A  28  -6.422 -10.533   8.591
  301   1H5*    C  29          1H5*        C  29  -7.378 -15.111  12.014
  302   2H5*    C  29          2H5*        C  29  -8.542 -16.365  11.565
  303    H4*    C  29           H4*        C  29  -9.061 -14.302  10.406
  304    H3*    C  29           H3*        C  29  -7.914 -16.398   8.546
  305    H2*    C  29           H2*        C  29  -8.470 -14.835   6.749
  306   2HO*    C  29          2HO*        C  29 -10.488 -14.073   7.894
  307    H1*    C  29           H1*        C  29  -7.391 -12.710   7.951
  308   1H4     C  29          1H4         C  29  -2.591 -15.438   4.752
  309   2H4     C  29          2H4         C  29  -2.089 -16.254   6.214
  310    H5     C  29           H5         C  29  -3.373 -16.246   8.234
  311    H6     C  29           H6         C  29  -5.405 -15.391   9.286
  312   1H5*    C  30          1H5*        C  30 -11.509 -15.551   6.648
  313   2H5*    C  30          2H5*        C  30 -12.320 -17.014   6.073
  314    H4*    C  30           H4*        C  30 -11.840 -15.465   4.235
  315    H3*    C  30           H3*        C  30 -10.127 -17.966   4.121
  316    H2*    C  30           H2*        C  30  -9.539 -17.183   1.893
  317   2HO*    C  30          2HO*        C  30 -11.800 -16.176   1.613
  318    H1*    C  30           H1*        C  30  -9.076 -14.637   2.777
  319   1H4     C  30          1H4         C  30  -3.690 -18.071   3.053
  320   2H4     C  30          2H4         C  30  -4.044 -18.538   4.701
  321    H5     C  30           H5         C  30  -6.085 -17.946   5.828
  322    H6     C  30           H6         C  30  -8.237 -16.802   5.563
  323   1H5*    U  31          1H5*        U  31 -12.206 -17.629   0.371
  324   2H5*    U  31          2H5*        U  31 -13.083 -19.110  -0.011
  325    H4*    U  31           H4*        U  31 -12.009 -18.242  -1.991
  326    H3*    U  31           H3*        U  31 -10.679 -20.774  -1.012
  327    H2*    U  31           H2*        U  31  -9.455 -20.745  -3.073
  328   2HO*    U  31          2HO*        U  31 -11.364 -19.884  -4.325
  329    H1*    U  31           H1*        U  31  -8.868 -18.076  -2.938
  330    H3     U  31           H3         U  31  -4.981 -20.360  -1.907
  331    H5     U  31           H5         U  31  -6.987 -19.864   1.742
  332    H6     U  31           H6         U  31  -8.974 -19.141   0.502
  333   1H5*    C  32          1H5*        C  32 -11.763 -22.083  -4.588
  334   2H5*    C  32          2H5*        C  32 -12.444 -23.713  -4.608
  335    H4*    C  32           H4*        C  32 -10.388 -23.652  -5.902
  336    H3*    C  32           H3*        C  32  -9.985 -25.116  -3.272
  337    H2*    C  32           H2*        C  32  -7.772 -25.623  -4.089
  338   2HO*    C  32          2HO*        C  32  -8.698 -25.806  -6.411
  339    H1*    C  32           H1*        C  32  -7.309 -23.096  -5.086
  340   1H4     C  32          1H4         C  32  -4.891 -23.574   0.802
  341   2H4     C  32          2H4         C  32  -6.458 -23.267   1.516
  342    H5     C  32           H5         C  32  -8.452 -22.946   0.220
  343    H6     C  32           H6         C  32  -9.360 -22.928  -2.055
  344   1H5*    U  33          1H5*        U  33  -8.016 -27.620  -5.388
  345   2H5*    U  33          2H5*        U  33  -8.657 -29.264  -5.347
  346    H4*    U  33           H4*        U  33  -6.331 -29.367  -4.699
  347    H3*    U  33           H3*        U  33  -8.180 -29.595  -2.304
  348    H2*    U  33           H2*        U  33  -6.371 -29.943  -0.969
  349   2HO*    U  33          2HO*        U  33  -4.383 -30.348  -3.000
  350    H1*    U  33           H1*        U  33  -4.616 -28.270  -2.426
  351    H3     U  33           H3         U  33  -4.672 -26.718   1.874
  352    H5     U  33           H5         U  33  -8.612 -26.124   0.601
  353    H6     U  33           H6         U  33  -8.018 -27.134  -1.556
  354   1H5*    U  34          1H5*        U  34  -8.126 -35.228  -1.748
  355   2H5*    U  34          2H5*        U  34  -7.439 -34.281  -0.424
  356    H4*    U  34           H4*        U  34  -6.214 -36.363  -0.766
  357    H3*    U  34           H3*        U  34  -4.907 -33.989  -0.350
  358    H2*    U  34           H2*        U  34  -4.607 -33.527  -2.687
  359   2HO*    U  34          2HO*        U  34  -2.312 -34.923  -1.713
  360    H1*    U  34           H1*        U  34  -3.788 -36.442  -3.001
  361    H3     U  34           H3         U  34  -2.790 -35.798  -7.358
  362    H5     U  34           H5         U  34  -6.242 -33.480  -6.891
  363    H6     U  34           H6         U  34  -6.283 -34.115  -4.518
  364   1H5*    C  35          1H5*        C  35  -1.444 -34.087   0.384
  365   2H5*    C  35          2H5*        C  35  -1.065 -34.999   1.847
  366    H4*    C  35           H4*        C  35  -0.124 -32.761   1.907
  367    H3*    C  35           H3*        C  35  -1.307 -33.894   4.095
  368    H2*    C  35           H2*        C  35  -3.468 -32.973   3.626
  369   2HO*    C  35          2HO*        C  35  -2.067 -31.254   5.413
  370    H1*    C  35           H1*        C  35  -2.196 -30.273   3.071
  371   1H4     C  35          1H4         C  35  -8.400 -29.553   1.741
  372   2H4     C  35          2H4         C  35  -8.329 -30.829   0.539
  373    H5     C  35           H5         C  35  -6.390 -32.175   0.204
  374    H6     C  35           H6         C  35  -4.022 -32.419   0.739
  375   1H5*    G  36          1H5*        G  36   3.078 -30.499   4.177
  376   2H5*    G  36          2H5*        G  36   1.531 -30.579   3.315
  377    H4*    G  36           H4*        G  36   4.124 -31.875   2.383
  378    H3*    G  36           H3*        G  36   2.568 -29.443   1.425
  379    H2*    G  36           H2*        G  36   3.400 -29.915  -0.744
  380   2HO*    G  36          2HO*        G  36   5.638 -30.390   0.332
  381    H1*    G  36           H1*        G  36   3.514 -32.723  -0.311
  382    H8     G  36           H8         G  36   2.233 -33.163  -2.563
  383    H1     G  36           H1         G  36  -2.524 -29.115  -0.987
  384   1H2     G  36          1H2         G  36  -2.125 -28.169   0.885
  385   2H2     G  36          2H2         G  36  -0.652 -28.451   1.788
  386   1H5*    G  37          1H5*        G  37   5.106 -28.305  -0.538
  387   2H5*    G  37          2H5*        G  37   5.522 -26.591  -0.542
  388    H4*    G  37           H4*        G  37   4.248 -27.510  -2.567
  389    H3*    G  37           H3*        G  37   3.065 -25.149  -1.057
  390    H2*    G  37           H2*        G  37   1.540 -25.060  -2.993
  391   2HO*    G  37          2HO*        G  37   3.340 -25.956  -4.494
  392    H1*    G  37           H1*        G  37   0.963 -27.684  -2.857
  393    H8     G  37           H8         G  37   1.668 -26.474   0.715
  394    H1     G  37           H1         G  37  -3.948 -24.452  -1.661
  395   1H2     G  37          1H2         G  37  -4.078 -24.944  -3.757
  396   2H2     G  37          2H2         G  37  -2.886 -25.947  -4.555
  397   1H5*    U  38          1H5*        U  38   2.571 -24.082  -4.878
  398   2H5*    U  38          2H5*        U  38   3.226 -22.521  -5.343
  399    H4*    U  38           H4*        U  38   0.918 -22.748  -6.049
  400    H3*    U  38           H3*        U  38   1.238 -20.736  -3.843
  401    H2*    U  38           H2*        U  38  -0.996 -20.020  -4.371
  402   2HO*    U  38          2HO*        U  38  -0.927 -20.324  -6.693
  403    H1*    U  38           H1*        U  38  -1.960 -22.569  -4.343
  404    H3     U  38           H3         U  38  -3.171 -20.903  -0.235
  405    H5     U  38           H5         U  38   0.754 -22.239   0.295
  406    H6     U  38           H6         U  38   0.904 -22.600  -2.121
  407   1H5*    G  39          1H5*        G  39   0.204 -18.395  -7.087
  408   2H5*    G  39          2H5*        G  39   1.027 -16.837  -7.044
  409    H4*    G  39           H4*        G  39  -1.350 -16.543  -7.154
  410    H3*    G  39           H3*        G  39  -0.367 -15.788  -4.394
  411    H2*    G  39           H2*        G  39  -2.650 -14.968  -4.084
  412   2HO*    G  39          2HO*        G  39  -2.828 -14.372  -6.493
  413    H1*    G  39           H1*        G  39  -3.746 -17.261  -4.993
  414    H8     G  39           H8         G  39  -0.397 -18.141  -3.331
  415    H1     G  39           H1         G  39  -5.169 -16.971   0.812
  416   1H2     G  39          1H2         G  39  -6.817 -16.032  -0.221
  417   2H2     G  39          2H2         G  39  -6.859 -15.880  -1.963
  418   1H5*    G  40          1H5*        G  40  -2.568 -12.603  -5.683
  419   2H5*    G  40          2H5*        G  40  -1.909 -11.040  -5.172
  420    H4*    G  40           H4*        G  40  -4.246 -11.251  -4.570
  421    H3*    G  40           H3*        G  40  -2.255 -11.078  -2.280
  422    H2*    G  40           H2*        G  40  -4.227 -10.860  -0.859
  423   2HO*    G  40          2HO*        G  40  -5.409  -9.592  -2.645
  424    H1*    G  40           H1*        G  40  -5.572 -12.893  -2.016
  425    H8     G  40           H8         G  40  -2.012 -14.105  -2.181
  426    H1     G  40           H1         G  40  -4.373 -14.091   3.795
  427   1H2     G  40          1H2         G  40  -6.201 -12.950   3.873
  428   2H2     G  40          2H2         G  40  -6.901 -12.216   2.443
  429   1H5*    G  41          1H5*        G  41  -4.620  -8.647  -0.696
  430   2H5*    G  41          2H5*        G  41  -3.864  -7.121  -0.239
  431    H4*    G  41           H4*        G  41  -4.639  -8.173   1.772
  432    H3*    G  41           H3*        G  41  -1.637  -8.489   1.474
  433    H2*    G  41           H2*        G  41  -1.698  -9.254   3.796
  434   2HO*    G  41          2HO*        G  41  -3.496  -7.975   4.571
  435    H1*    G  41           H1*        G  41  -3.600 -11.065   3.239
  436    H8     G  41           H8         G  41  -1.801 -10.685  -0.082
  437    H1     G  41           H1         G  41   1.291 -14.449   4.112
  438   1H2     G  41          1H2         G  41   0.476 -14.231   6.078
  439   2H2     G  41          2H2         G  41  -0.870 -13.169   6.442
  440   1H5*    A  42          1H5*        A  42  -0.598  -4.561   5.031
  441   2H5*    A  42          2H5*        A  42  -0.411  -5.915   6.155
  442    H4*    A  42           H4*        A  42  -3.014  -4.986   4.872
  443    H3*    A  42           H3*        A  42  -1.958  -5.132   7.710
  444    H2*    A  42           H2*        A  42  -4.233  -5.480   8.458
  445   2HO*    A  42          2HO*        A  42  -5.135  -4.070   6.628
  446    H1*    A  42           H1*        A  42  -4.702  -7.472   6.726
  447    H8     A  42           H8         A  42  -1.185  -8.297   6.909
  448   1H6     A  42          1H6         A  42  -2.008 -10.239  12.767
  449   2H6     A  42          2H6         A  42  -0.979 -10.356  11.357
  450    H2     A  42           H2         A  42  -5.564  -7.858  11.613
  451   1H5*    A  43          1H5*        A  43  -4.706  -2.597   8.040
  452   2H5*    A  43          2H5*        A  43  -4.715  -1.011   8.774
  453    H4*    A  43           H4*        A  43  -6.113  -2.466  10.095
  454    H3*    A  43           H3*        A  43  -3.443  -1.992  11.480
  455    H2*    A  43           H2*        A  43  -4.259  -3.381  13.286
  456   2HO*    A  43          2HO*        A  43  -6.544  -2.465  12.955
  457    H1*    A  43           H1*        A  43  -5.325  -5.320  11.636
  458    H8     A  43           H8         A  43  -2.261  -4.537   9.741
  459   1H6     A  43          1H6         A  43   0.855  -8.094  13.749
  460   2H6     A  43          2H6         A  43   0.866  -7.410  12.136
  461    H2     A  43           H2         A  43  -3.028  -7.018  15.616
  462   1H5*    U  44          1H5*        U  44  -5.512  -1.280  14.668
  463   2H5*    U  44          2H5*        U  44  -5.050   0.233  15.466
  464    H4*    U  44           H4*        U  44  -4.453  -1.627  16.897
  465    H3*    U  44           H3*        U  44  -2.029  -0.392  15.552
  466    H2*    U  44           H2*        U  44  -0.713  -1.797  16.995
  467   2HO*    U  44          2HO*        U  44  -2.369  -1.556  18.820
  468    H1*    U  44           H1*        U  44  -2.218  -4.038  16.542
  469    H3     U  44           H3         U  44   1.720  -4.496  14.144
  470    H5     U  44           H5         U  44  -0.795  -2.277  11.642
  471    H6     U  44           H6         U  44  -2.369  -2.057  13.506
  472   1H5*    A  45          1H5*        A  45  -1.017  -0.174  19.518
  473   2H5*    A  45          2H5*        A  45  -0.216   1.348  19.931
  474    H4*    A  45           H4*        A  45   1.215  -0.566  20.414
  475    H3*    A  45           H3*        A  45   2.233   1.070  18.058
  476    H2*    A  45           H2*        A  45   4.239  -0.249  18.290
  477   2HO*    A  45          2HO*        A  45   3.973  -0.410  20.739
  478    H1*    A  45           H1*        A  45   2.869  -2.593  18.392
  479    H8     A  45           H8         A  45   0.816  -0.259  16.179
  480   1H6     A  45          1H6         A  45   4.602  -1.965  11.538
  481   2H6     A  45          2H6         A  45   3.077  -1.196  11.935
  482    H2     A  45           H2         A  45   6.306  -3.489  15.329
  483   1H5*    C  46          1H5*        C  46   5.297   1.039  20.794
  484   2H5*    C  46          2H5*        C  46   6.044   2.626  20.976
  485    H4*    C  46           H4*        C  46   7.705   0.942  20.449
  486    H3*    C  46           H3*        C  46   7.249   2.859  18.128
  487    H2*    C  46           H2*        C  46   9.287   1.906  17.266
  488   2HO*    C  46          2HO*        C  46  10.235   1.627  19.522
  489    H1*    C  46           H1*        C  46   8.479  -0.660  17.803
  490   1H4     C  46          1H4         C  46   6.588   0.671  11.860
  491   2H4     C  46          2H4         C  46   5.043   1.232  12.460
  492    H5     C  46           H5         C  46   4.545   1.473  14.796
  493    H6     C  46           H6         C  46   5.439   1.182  17.063
  494   1H5*    C  47          1H5*        C  47  11.236   3.278  19.121
  495   2H5*    C  47          2H5*        C  47  11.753   4.966  19.090
  496    H4*    C  47           H4*        C  47  13.157   3.594  17.653
  497    H3*    C  47           H3*        C  47  11.358   5.458  16.072
  498    H2*    C  47           H2*        C  47  12.818   4.891  14.218
  499   2HO*    C  47          2HO*        C  47  14.805   4.738  15.600
  500    H1*    C  47           H1*        C  47  12.738   2.213  14.818
  501   1H4     C  47          1H4         C  47   8.025   3.297  10.662
  502   2H4     C  47          2H4         C  47   6.938   3.726  11.964
  503    H5     C  47           H5         C  47   7.625   3.884  14.260
  504    H6     C  47           H6         C  47   9.526   3.642  15.792
  505   1H5*    A  48          1H5*        A  48  15.380   6.577  15.194
  506   2H5*    A  48          2H5*        A  48  15.538   8.327  15.033
  507    H4*    A  48           H4*        A  48  16.421   7.173  13.078
  508    H3*    A  48           H3*        A  48  13.861   8.681  12.475
  509    H2*    A  48           H2*        A  48  14.449   8.263  10.142
  510   2HO*    A  48          2HO*        A  48  16.861   8.378  10.601
  511    H1*    A  48           H1*        A  48  14.879   5.626  10.608
  512    H8     A  48           H8         A  48  12.173   6.630  13.081
  513   1H6     A  48          1H6         A  48   8.142   6.070   8.372
  514   2H6     A  48          2H6         A  48   8.309   6.295  10.101
  515    H2     A  48           H2         A  48  12.249   5.844   6.697
  516   1H5*    G  49          1H5*        G  49  16.757  10.202   9.856
  517   2H5*    G  49          2H5*        G  49  16.666  11.955   9.682
  518    H4*    G  49           H4*        G  49  16.658  10.845   7.516
  519    H3*    G  49           H3*        G  49  13.986  12.135   8.167
  520    H2*    G  49           H2*        G  49  13.466  11.660   5.821
  521   2HO*    G  49          2HO*        G  49  15.879  11.948   5.209
  522    H1*    G  49           H1*        G  49  14.292   9.094   6.010
  523    H8     G  49           H8         G  49  12.966   9.752   9.481
  524    H1     G  49           H1         G  49   8.321   9.265   5.065
  525   1H2     G  49          1H2         G  49   9.152   9.539   3.092
  526   2H2     G  49          2H2         G  49  10.881   9.587   2.812
  527   1H5*    G  50          1H5*        G  50  14.842  13.474   4.426
  528   2H5*    G  50          2H5*        G  50  14.718  15.222   4.245
  529    H4*    G  50           H4*        G  50  13.477  14.040   2.493
  530    H3*    G  50           H3*        G  50  11.712  15.559   4.444
  531    H2*    G  50           H2*        G  50   9.886  15.013   2.920
  532   2HO*    G  50          2HO*        G  50  11.480  15.145   0.991
  533    H1*    G  50           H1*        G  50  10.615  12.400   2.663
  534    H8     G  50           H8         G  50  11.501  12.907   6.249
  535    H1     G  50           H1         G  50   5.155  12.541   5.230
  536   1H2     G  50          1H2         G  50   4.735  12.726   3.136
  537   2H2     G  50          2H2         G  50   5.977  13.121   1.965
  538   1H5*    U  51          1H5*        U  51  10.385  16.772   0.817
  539   2H5*    U  51          2H5*        U  51  10.557  18.495   0.488
  540    H4*    U  51           H4*        U  51   8.309  17.742  -0.070
  541    H3*    U  51           H3*        U  51   8.876  19.934   1.596
  542    H2*    U  51           H2*        U  51   8.198  19.007   3.539
  543   2HO*    U  51          2HO*        U  51   5.494  19.411   2.730
  544    H1*    U  51           H1*        U  51   6.022  17.377   2.232
  545    H3     U  51           H3         U  51   4.952  15.750   6.249
  546    H5     U  51           H5         U  51   9.091  16.293   6.600
  547    H6     U  51           H6         U  51   9.156  16.922   4.229
  548   1H5*    G  52          1H5*        G  52   7.808  22.128  -2.441
  549   2H5*    G  52          2H5*        G  52   6.184  22.344  -3.067
  550    H4*    G  52           H4*        G  52   7.552  19.657  -2.643
  551    H3*    G  52           H3*        G  52   6.750  21.302  -5.081
  552    H2*    G  52           H2*        G  52   6.674  19.219  -6.282
  553   2HO*    G  52          2HO*        G  52   8.574  18.327  -4.986
  554    H1*    G  52           H1*        G  52   5.301  17.953  -4.273
  555    H8     G  52           H8         G  52   3.966  21.510  -4.369
  556    H1     G  52           H1         G  52   1.440  17.588  -8.798
  557   1H2     G  52          1H2         G  52   2.735  15.889  -9.103
  558   2H2     G  52          2H2         G  52   4.152  15.605  -8.114
  559   1H5*    C  53          1H5*        C  53   9.606  18.763  -6.757
  560   2H5*    C  53          2H5*        C  53  10.630  19.625  -7.910
  561    H4*    C  53           H4*        C  53   9.571  17.701  -8.941
  562    H3*    C  53           H3*        C  53   8.415  20.299 -10.008
  563    H2*    C  53           H2*        C  53   7.406  18.876 -11.691
  564   2HO*    C  53          2HO*        C  53   9.344  17.347 -11.670
  565    H1*    C  53           H1*        C  53   6.530  17.055  -9.847
  566   1H4     C  53          1H4         C  53   1.786  21.254 -10.341
  567   2H4     C  53          2H4         C  53   2.505  22.244  -9.090
  568    H5     C  53           H5         C  53   4.716  21.882  -8.234
  569    H6     C  53           H6         C  53   6.615  20.333  -8.241
  570   1H5*    C  54          1H5*        C  54   9.751  18.269 -13.409
  571   2H5*    C  54          2H5*        C  54  10.544  19.361 -14.547
  572    H4*    C  54           H4*        C  54   8.739  18.129 -15.623
  573    H3*    C  54           H3*        C  54   8.091  21.078 -15.293
  574    H2*    C  54           H2*        C  54   6.251  20.608 -16.793
  575   2HO*    C  54          2HO*        C  54   7.598  18.923 -18.012
  576    H1*    C  54           H1*        C  54   5.517  18.345 -15.447
  577   1H4     C  54          1H4         C  54   2.213  23.087 -12.786
  578   2H4     C  54          2H4         C  54   3.503  23.372 -11.641
  579    H5     C  54           H5         C  54   5.640  22.287 -11.767
  580    H6     C  54           H6         C  54   6.950  20.616 -12.987
  581   1H5*    C  55          1H5*        C  55   7.646  20.421 -19.394
  582   2H5*    C  55          2H5*        C  55   8.412  21.716 -20.322
  583    H4*    C  55           H4*        C  55   6.076  21.447 -20.972
  584    H3*    C  55           H3*        C  55   6.633  24.019 -19.457
  585    H2*    C  55           H2*        C  55   4.417  24.677 -20.047
  586   2HO*    C  55          2HO*        C  55   4.584  23.711 -22.273
  587    H1*    C  55           H1*        C  55   3.306  22.186 -19.570
  588   1H4     C  55          1H4         C  55   2.483  25.840 -14.395
  589   2H4     C  55          2H4         C  55   4.079  25.427 -13.811
  590    H5     C  55           H5         C  55   5.621  24.069 -15.048
  591    H6     C  55           H6         C  55   5.954  22.836 -17.139
  592   1H    MET 104          1H        MET 104  10.377 -15.705   3.244
  593    HA   MET 104           HA       MET 104  11.117 -12.882   2.720
  594   1HB   MET 104          1HB       MET 104  13.016 -14.017   3.987
  595   2HB   MET 104          2HB       MET 104  13.189 -15.121   2.631
  596   1HG   MET 104          1HG       MET 104  14.528 -13.666   1.634
  597   2HG   MET 104          2HG       MET 104  13.231 -12.488   1.510
  598   1HE   MET 104          1HE       MET 104  13.785 -10.165   4.606
  599   2HE   MET 104          2HE       MET 104  13.266 -10.146   2.914
  600   3HE   MET 104          3HE       MET 104  12.521 -11.284   4.069
  601    H    TYR 105           H        TYR 105  10.784 -12.389   0.637
  602    HA   TYR 105           HA       TYR 105  10.288 -14.641  -1.285
  603   1HB   TYR 105          1HB       TYR 105   9.079 -11.881  -0.947
  604   2HB   TYR 105          2HB       TYR 105   8.970 -12.726  -2.483
  605    HD1  TYR 105           HD1      TYR 105   7.347 -14.339  -2.881
  606    HD2  TYR 105           HD2      TYR 105   8.251 -13.379   1.260
  607    HE1  TYR 105           HE1      TYR 105   5.571 -15.887  -2.105
  608    HE2  TYR 105           HE2      TYR 105   6.615 -15.077   1.998
  609    HH   TYR 105           HH       TYR 105   4.608 -16.931  -0.327
  610    H    VAL 106           H        VAL 106  11.654 -14.930  -2.915
  611    HA   VAL 106           HA       VAL 106  13.738 -12.823  -3.344
  612    HB   VAL 106           HB       VAL 106  13.805 -15.819  -3.844
  613   1HG1  VAL 106          1HG1      VAL 106  16.271 -15.564  -3.978
  614   2HG1  VAL 106          2HG1      VAL 106  15.458 -14.708  -5.278
  615   3HG1  VAL 106          3HG1      VAL 106  16.091 -13.802  -3.885
  616   1HG2  VAL 106          1HG2      VAL 106  13.678 -15.343  -1.450
  617   2HG2  VAL 106          2HG2      VAL 106  15.279 -15.943  -1.914
  618   3HG2  VAL 106          3HG2      VAL 106  15.035 -14.191  -1.608
  619    H    CYS 107           H        CYS 107  14.268 -12.052  -5.322
  620    HA   CYS 107           HA       CYS 107  12.579 -12.660  -7.633
  621   1HB   CYS 107          1HB       CYS 107  13.409 -10.354  -7.166
  622   2HB   CYS 107          2HB       CYS 107  15.069 -10.933  -7.330
  623    H    HIS 108           H        HIS 108  13.004 -14.111  -9.176
  624    HA   HIS 108           HA       HIS 108  15.652 -15.490  -9.095
  625   1HB   HIS 108          1HB       HIS 108  12.937 -16.504 -10.059
  626   2HB   HIS 108          2HB       HIS 108  14.444 -17.430 -10.080
  627    HD2  HIS 108           HD2      HIS 108  11.512 -17.510  -8.125
  628    HE1  HIS 108           HE1      HIS 108  14.437 -17.614  -5.013
  629    HE2  HIS 108           HE2      HIS 108  11.980 -18.009  -5.582
  630    H    PHE 109           H        PHE 109  14.843 -12.952 -10.598
  631    HA   PHE 109           HA       PHE 109  14.894 -13.548 -13.428
  632   1HB   PHE 109          1HB       PHE 109  14.448 -11.271 -12.132
  633   2HB   PHE 109          2HB       PHE 109  16.188 -11.071 -12.222
  634    HD1  PHE 109           HD1      PHE 109  13.018 -11.068 -13.973
  635    HD2  PHE 109           HD2      PHE 109  17.288 -10.705 -14.380
  636    HE1  PHE 109           HE1      PHE 109  12.687 -10.261 -16.306
  637    HE2  PHE 109           HE2      PHE 109  16.969  -9.859 -16.736
  638    HZ   PHE 109           HZ       PHE 109  14.657  -9.634 -17.680
  639    H    GLU 110           H        GLU 110  16.748 -13.369 -14.866
  640    HA   GLU 110           HA       GLU 110  18.774 -15.151 -14.152
  641   1HB   GLU 110          1HB       GLU 110  18.779 -13.009 -16.332
  642   2HB   GLU 110          2HB       GLU 110  19.964 -14.319 -16.204
  643   1HG   GLU 110          1HG       GLU 110  18.110 -15.988 -16.360
  644   2HG   GLU 110          2HG       GLU 110  16.959 -14.670 -16.589
  645    H    ASN 111           H        ASN 111  20.266 -14.945 -12.589
  646    HA   ASN 111           HA       ASN 111  22.225 -14.250 -11.579
  647   1HB   ASN 111          1HB       ASN 111  22.824 -13.545 -14.019
  648   2HB   ASN 111          2HB       ASN 111  22.432 -11.900 -13.512
  649   1HD2  ASN 111          1HD2      ASN 111  24.509 -11.028 -13.623
  650   2HD2  ASN 111          2HD2      ASN 111  25.819 -11.604 -12.602
  651    H    CYS 112           H        CYS 112  19.372 -12.927 -11.184
  652    HA   CYS 112           HA       CYS 112  20.070 -10.323 -10.014
  653   1HB   CYS 112          1HB       CYS 112  17.956 -10.654 -11.201
  654   2HB   CYS 112          2HB       CYS 112  17.422 -11.855  -9.999
  655    H    GLY 113           H        GLY 113  18.057 -12.935  -8.543
  656   1HA   GLY 113          1HA       GLY 113  18.199 -14.038  -6.516
  657   2HA   GLY 113          2HA       GLY 113  19.902 -13.550  -6.442
  658    H    LYS 114           H        LYS 114  17.725 -10.842  -6.721
  659    HA   LYS 114           HA       LYS 114  18.411  -9.857  -4.078
  660   1HB   LYS 114          1HB       LYS 114  17.778  -8.601  -6.269
  661   2HB   LYS 114          2HB       LYS 114  16.105  -8.802  -5.739
  662   1HG   LYS 114          1HG       LYS 114  16.540  -7.477  -3.740
  663   2HG   LYS 114          2HG       LYS 114  18.301  -7.559  -4.000
  664   1HD   LYS 114          1HD       LYS 114  18.089  -6.265  -6.088
  665   2HD   LYS 114          2HD       LYS 114  16.341  -6.267  -5.898
  666   1HE   LYS 114          1HE       LYS 114  17.132  -4.133  -5.351
  667   2HE   LYS 114          2HE       LYS 114  16.481  -4.897  -3.890
  668   1HZ   LYS 114          1HZ       LYS 114  18.778  -5.377  -3.202
  669   2HZ   LYS 114          2HZ       LYS 114  19.378  -4.695  -4.563
  670   3HZ   LYS 114          3HZ       LYS 114  18.610  -3.777  -3.457
  671    H    ALA 115           H        ALA 115  17.183  -9.701  -2.193
  672    HA   ALA 115           HA       ALA 115  14.742 -11.445  -2.114
  673   1HB   ALA 115          1HB       ALA 115  16.718 -12.489  -1.096
  674   2HB   ALA 115          2HB       ALA 115  16.911 -11.097   0.004
  675   3HB   ALA 115          3HB       ALA 115  15.472 -12.142   0.111
  676    H    PHE 116           H        PHE 116  12.944 -10.736  -1.095
  677    HA   PHE 116           HA       PHE 116  13.066  -8.041   0.210
  678   1HB   PHE 116          1HB       PHE 116  10.751  -9.148  -1.425
  679   2HB   PHE 116          2HB       PHE 116  10.985  -7.535  -0.804
  680    HD1  PHE 116           HD1      PHE 116  12.251  -5.875  -2.034
  681    HD2  PHE 116           HD2      PHE 116  12.211  -9.996  -3.304
  682    HE1  PHE 116           HE1      PHE 116  13.695  -5.316  -4.003
  683    HE2  PHE 116           HE2      PHE 116  13.625  -9.443  -5.235
  684    HZ   PHE 116           HZ       PHE 116  14.406  -7.154  -5.559
  685    H    LYS 117           H        LYS 117  11.500  -7.571   1.801
  686    HA   LYS 117           HA       LYS 117  10.931  -9.671   3.627
  687   1HB   LYS 117          1HB       LYS 117  11.148  -7.212   4.136
  688   2HB   LYS 117          2HB       LYS 117   9.540  -6.948   3.438
  689   1HG   LYS 117          1HG       LYS 117   8.542  -8.456   5.100
  690   2HG   LYS 117          2HG       LYS 117  10.168  -8.879   5.670
  691   1HD   LYS 117          1HD       LYS 117  10.394  -6.315   6.205
  692   2HD   LYS 117          2HD       LYS 117   8.639  -6.265   5.984
  693   1HE   LYS 117          1HE       LYS 117   9.092  -6.644   8.340
  694   2HE   LYS 117          2HE       LYS 117   8.429  -8.141   7.641
  695   1HZ   LYS 117          1HZ       LYS 117  10.551  -9.095   7.586
  696   2HZ   LYS 117          2HZ       LYS 117  11.314  -7.681   7.992
  697   3HZ   LYS 117          3HZ       LYS 117  10.346  -8.499   9.092
  698    H    LYS 118           H        LYS 118   8.889  -8.073   1.145
  699    HA   LYS 118           HA       LYS 118   6.785 -10.164   1.627
  700   1HB   LYS 118          1HB       LYS 118   6.333  -7.192   1.102
  701   2HB   LYS 118          2HB       LYS 118   5.073  -8.373   1.358
  702   1HG   LYS 118          1HG       LYS 118   7.186  -7.683   3.464
  703   2HG   LYS 118          2HG       LYS 118   5.660  -6.840   3.327
  704   1HD   LYS 118          1HD       LYS 118   4.382  -8.608   4.040
  705   2HD   LYS 118          2HD       LYS 118   5.542  -9.806   3.490
  706   1HE   LYS 118          1HE       LYS 118   5.072  -9.653   5.970
  707   2HE   LYS 118          2HE       LYS 118   6.741  -9.866   5.400
  708   1HZ   LYS 118          1HZ       LYS 118   5.451  -7.478   6.535
  709   2HZ   LYS 118          2HZ       LYS 118   6.675  -8.310   7.146
  710   3HZ   LYS 118          3HZ       LYS 118   6.919  -7.370   5.785
  711    H    HIS 119           H        HIS 119   5.528 -10.784  -0.173
  712    HA   HIS 119           HA       HIS 119   6.943 -10.897  -2.642
  713   1HB   HIS 119          1HB       HIS 119   4.931 -11.928  -3.565
  714   2HB   HIS 119          2HB       HIS 119   5.396 -12.601  -2.032
  715    HD1  HIS 119           HD1      HIS 119   2.642  -9.905  -2.955
  716    HD2  HIS 119           HD2      HIS 119   3.485 -13.476  -0.859
  717    HE1  HIS 119           HE1      HIS 119   0.417 -10.656  -1.830
  718    HE2  HIS 119           HE2      HIS 119   0.964 -12.799  -0.587
  719    H    ASN 120           H        ASN 120   4.541  -8.579  -1.451
  720    HA   ASN 120           HA       ASN 120   3.894  -7.396  -3.988
  721   1HB   ASN 120          1HB       ASN 120   3.661  -6.585  -1.086
  722   2HB   ASN 120          2HB       ASN 120   3.613  -5.299  -2.289
  723   1HD2  ASN 120          1HD2      ASN 120   1.568  -7.513  -0.686
  724   2HD2  ASN 120          2HD2      ASN 120   0.304  -7.510  -1.918
  725    H    GLN 121           H        GLN 121   6.661  -6.975  -1.754
  726    HA   GLN 121           HA       GLN 121   7.772  -4.667  -3.201
  727   1HB   GLN 121          1HB       GLN 121   9.212  -6.565  -1.345
  728   2HB   GLN 121          2HB       GLN 121   9.675  -4.917  -1.846
  729   1HG   GLN 121          1HG       GLN 121   7.743  -4.033  -0.600
  730   2HG   GLN 121          2HG       GLN 121   7.426  -5.675   0.011
  731   1HE2  GLN 121          1HE2      GLN 121   8.663  -2.871   1.095
  732   2HE2  GLN 121          2HE2      GLN 121   9.925  -3.478   2.153
  733    H    LEU 122           H        LEU 122   8.239  -8.243  -3.141
  734    HA   LEU 122           HA       LEU 122  10.356  -8.383  -5.028
  735   1HB   LEU 122          1HB       LEU 122   9.704 -10.315  -3.733
  736   2HB   LEU 122          2HB       LEU 122   8.065 -10.260  -4.344
  737    HG   LEU 122           HG       LEU 122   8.749 -10.985  -6.549
  738   1HD1  LEU 122          1HD1      LEU 122  11.035  -9.960  -6.540
  739   2HD1  LEU 122          2HD1      LEU 122  11.512 -11.180  -5.330
  740   3HD1  LEU 122          3HD1      LEU 122  10.991 -11.659  -6.977
  741   1HD2  LEU 122          1HD2      LEU 122   8.257 -12.730  -4.828
  742   2HD2  LEU 122          2HD2      LEU 122   9.478 -13.258  -6.002
  743   3HD2  LEU 122          3HD2      LEU 122   9.978 -12.772  -4.380
  744    H    LYS 123           H        LYS 123   6.790  -8.575  -5.557
  745    HA   LYS 123           HA       LYS 123   6.767  -8.585  -8.360
  746   1HB   LYS 123          1HB       LYS 123   4.846  -8.865  -6.754
  747   2HB   LYS 123          2HB       LYS 123   4.772  -7.115  -6.571
  748   1HG   LYS 123          1HG       LYS 123   4.253  -6.863  -8.964
  749   2HG   LYS 123          2HG       LYS 123   4.424  -8.606  -9.214
  750   1HD   LYS 123          1HD       LYS 123   2.353  -7.277  -7.403
  751   2HD   LYS 123          2HD       LYS 123   2.046  -7.876  -9.040
  752   1HE   LYS 123          1HE       LYS 123   2.652 -10.180  -8.324
  753   2HE   LYS 123          2HE       LYS 123   2.964  -9.598  -6.687
  754   1HZ   LYS 123          1HZ       LYS 123   0.615  -8.945  -6.548
  755   2HZ   LYS 123          2HZ       LYS 123   0.328  -9.561  -8.040
  756   3HZ   LYS 123          3HZ       LYS 123   0.777 -10.551  -6.812
  757    H    VAL 124           H        VAL 124   6.928  -5.781  -6.117
  758    HA   VAL 124           HA       VAL 124   6.870  -3.700  -8.063
  759    HB   VAL 124           HB       VAL 124   8.040  -3.971  -5.297
  760   1HG1  VAL 124          1HG1      VAL 124   8.449  -1.530  -5.225
  761   2HG1  VAL 124          2HG1      VAL 124   9.607  -2.383  -6.244
  762   3HG1  VAL 124          3HG1      VAL 124   8.277  -1.467  -6.993
  763   1HG2  VAL 124          1HG2      VAL 124   6.080  -1.967  -6.237
  764   2HG2  VAL 124          2HG2      VAL 124   5.528  -3.642  -6.010
  765   3HG2  VAL 124          3HG2      VAL 124   6.218  -2.789  -4.645
  766    H    HIS 125           H        HIS 125   9.616  -5.639  -6.769
  767    HA   HIS 125           HA       HIS 125  11.641  -4.153  -8.113
  768   1HB   HIS 125          1HB       HIS 125  12.155  -5.520  -6.214
  769   2HB   HIS 125          2HB       HIS 125  11.551  -6.980  -6.992
  770    HD1  HIS 125           HD1      HIS 125  14.523  -4.539  -7.301
  771    HD2  HIS 125           HD2      HIS 125  13.136  -8.326  -8.529
  772    HE1  HIS 125           HE1      HIS 125  16.510  -5.711  -8.372
  773    H    GLN 126           H        GLN 126   9.928  -7.215  -8.996
  774    HA   GLN 126           HA       GLN 126  11.473  -7.720 -11.347
  775   1HB   GLN 126          1HB       GLN 126   8.678  -8.638 -10.526
  776   2HB   GLN 126          2HB       GLN 126   9.521  -9.168 -12.014
  777   1HG   GLN 126          1HG       GLN 126  11.535  -9.712 -10.532
  778   2HG   GLN 126          2HG       GLN 126  10.523  -9.477  -9.118
  779   1HE2  GLN 126          1HE2      GLN 126  12.002 -11.772  -9.794
  780   2HE2  GLN 126          2HE2      GLN 126  10.837 -13.099 -10.054
  781    H    PHE 127           H        PHE 127   8.591  -5.717 -10.811
  782    HA   PHE 127           HA       PHE 127   7.820  -5.258 -13.490
  783   1HB   PHE 127          1HB       PHE 127   6.383  -3.985 -12.528
  784   2HB   PHE 127          2HB       PHE 127   7.108  -4.309 -11.008
  785    HD1  PHE 127           HD1      PHE 127   7.827  -1.742 -13.821
  786    HD2  PHE 127           HD2      PHE 127   7.030  -2.547  -9.681
  787    HE1  PHE 127           HE1      PHE 127   8.234   0.606 -13.291
  788    HE2  PHE 127           HE2      PHE 127   7.549  -0.307  -9.051
  789    HZ   PHE 127           HZ       PHE 127   8.245   1.375 -10.883
  790    H    SER 128           H        SER 128  10.647  -4.103 -11.702
  791    HA   SER 128           HA       SER 128  11.385  -1.976 -13.543
  792   1HB   SER 128          1HB       SER 128  12.203  -2.281 -11.163
  793   2HB   SER 128          2HB       SER 128  13.241  -3.600 -11.754
  794    HG   SER 128           HG       SER 128  14.311  -1.544 -11.709
  795    H    HIS 129           H        HIS 129  12.382  -5.456 -13.208
  796    HA   HIS 129           HA       HIS 129  14.221  -5.449 -15.429
  797   1HB   HIS 129          1HB       HIS 129  12.576  -7.716 -14.223
  798   2HB   HIS 129          2HB       HIS 129  13.833  -7.890 -15.423
  799    HD1  HIS 129           HD1      HIS 129  16.429  -7.332 -14.546
  800    HD2  HIS 129           HD2      HIS 129  13.342  -8.366 -11.922
  801    HE1  HIS 129           HE1      HIS 129  17.528  -8.344 -12.460
  802    H    THR 130           H        THR 130  10.711  -6.060 -15.173
  803    HA   THR 130           HA       THR 130  10.443  -6.838 -17.990
  804    HB   THR 130           HB       THR 130   8.011  -6.787 -17.504
  805    HG1  THR 130           HG1      THR 130   8.868  -5.663 -15.099
  806   1HG2  THR 130          1HG2      THR 130   9.452  -8.797 -16.669
  807   2HG2  THR 130          2HG2      THR 130   9.319  -8.085 -15.046
  808   3HG2  THR 130          3HG2      THR 130   7.858  -8.556 -15.910
  809    H    GLN 131           H        GLN 131  10.509  -3.874 -16.209
  810    HA   GLN 131           HA       GLN 131  10.110  -1.685 -16.706
  811   1HB   GLN 131          1HB       GLN 131  11.573  -2.555 -18.800
  812   2HB   GLN 131          2HB       GLN 131  10.092  -2.170 -19.680
  813   1HG   GLN 131          1HG       GLN 131  10.960  -0.049 -19.691
  814   2HG   GLN 131          2HG       GLN 131  10.294   0.068 -18.062
  815   1HE2  GLN 131          1HE2      GLN 131  12.206  -1.321 -16.428
  816   2HE2  GLN 131          2HE2      GLN 131  13.731  -0.503 -16.653
  817    H    GLN 132           H        GLN 132   7.789  -3.542 -16.436
  818    HA   GLN 132           HA       GLN 132   5.802  -1.608 -17.576
  819   1HB   GLN 132          1HB       GLN 132   4.165  -3.377 -17.871
  820   2HB   GLN 132          2HB       GLN 132   5.574  -3.591 -18.899
  821   1HG   GLN 132          1HG       GLN 132   4.887  -5.748 -18.221
  822   2HG   GLN 132          2HG       GLN 132   6.378  -5.375 -17.379
  823   1HE2  GLN 132          1HE2      GLN 132   6.369  -5.730 -15.206
  824   2HE2  GLN 132          2HE2      GLN 132   4.917  -5.860 -14.199
  825    H    LEU 133           H        LEU 133   3.844  -1.403 -16.252
  826    HA   LEU 133           HA       LEU 133   4.681  -1.456 -13.430
  827   1HB   LEU 133          1HB       LEU 133   2.626   0.111 -14.995
  828   2HB   LEU 133          2HB       LEU 133   2.621   0.171 -13.225
  829    HG   LEU 133           HG       LEU 133   5.203   0.686 -14.840
  830   1HD1  LEU 133          1HD1      LEU 133   4.761   3.080 -14.593
  831   2HD1  LEU 133          2HD1      LEU 133   3.482   2.324 -15.559
  832   3HD1  LEU 133          3HD1      LEU 133   3.178   2.743 -13.857
  833   1HD2  LEU 133          1HD2      LEU 133   4.407   1.571 -12.080
  834   2HD2  LEU 133          2HD2      LEU 133   5.430   0.157 -12.425
  835   3HD2  LEU 133          3HD2      LEU 133   5.971   1.779 -12.877
  836    HA   PRO 134           HA       PRO 134   2.019  -4.843 -12.614
  837   1HB   PRO 134          1HB       PRO 134   2.220  -4.682  -9.794
  838   2HB   PRO 134          2HB       PRO 134   3.331  -5.548 -10.897
  839   1HG   PRO 134          1HG       PRO 134   3.778  -3.083  -9.366
  840   2HG   PRO 134          2HG       PRO 134   4.945  -4.092 -10.233
  841   1HD   PRO 134          1HD       PRO 134   3.842  -1.558 -11.029
  842   2HD   PRO 134          2HD       PRO 134   4.949  -2.616 -11.903
  843    H    TYR 135           H        TYR 135   1.429  -1.835 -10.769
  844    HA   TYR 135           HA       TYR 135  -1.235  -2.827  -9.946
  845   1HB   TYR 135          1HB       TYR 135   0.281  -0.317  -9.083
  846   2HB   TYR 135          2HB       TYR 135  -1.171  -0.956  -8.352
  847    HD1  TYR 135           HD1      TYR 135  -1.171  -3.158  -7.194
  848    HD2  TYR 135           HD2      TYR 135   2.472  -1.228  -8.475
  849    HE1  TYR 135           HE1      TYR 135   0.187  -4.734  -5.780
  850    HE2  TYR 135           HE2      TYR 135   3.808  -2.699  -6.944
  851    HH   TYR 135           HH       TYR 135   2.255  -5.344  -5.082
  852    H    GLU 136           H        GLU 136  -2.598  -2.570 -11.694
  853    HA   GLU 136           HA       GLU 136  -2.616   0.071 -13.093
  854   1HB   GLU 136          1HB       GLU 136  -2.463  -1.844 -14.566
  855   2HB   GLU 136          2HB       GLU 136  -3.800  -2.661 -13.759
  856   1HG   GLU 136          1HG       GLU 136  -5.396  -1.022 -14.616
  857   2HG   GLU 136          2HG       GLU 136  -4.092  -0.074 -15.337
  858    H    CYS 137           H        CYS 137  -4.396   1.413 -13.049
  859    HA   CYS 137           HA       CYS 137  -6.408   1.026 -10.975
  860   1HB   CYS 137          1HB       CYS 137  -5.578   3.246 -11.455
  861   2HB   CYS 137          2HB       CYS 137  -6.042   3.122 -13.140
  862    HA   PRO 138           HA       PRO 138  -8.949  -1.263 -13.837
  863   1HB   PRO 138          1HB       PRO 138 -10.584  -2.507 -12.073
  864   2HB   PRO 138          2HB       PRO 138  -8.815  -2.772 -12.019
  865   1HG   PRO 138          1HG       PRO 138 -10.447  -0.815 -10.348
  866   2HG   PRO 138          2HG       PRO 138  -9.270  -2.034  -9.769
  867   1HD   PRO 138          1HD       PRO 138  -8.609   0.615 -10.227
  868   2HD   PRO 138          2HD       PRO 138  -7.453  -0.739 -10.433
  869    H    HIS 139           H        HIS 139  -9.877   1.639 -12.497
  870    HA   HIS 139           HA       HIS 139 -12.768   1.475 -12.553
  871   1HB   HIS 139          1HB       HIS 139 -10.751   3.739 -12.480
  872   2HB   HIS 139          2HB       HIS 139 -12.451   4.079 -12.759
  873    HD2  HIS 139           HD2      HIS 139 -10.126   2.801  -9.969
  874    HE1  HIS 139           HE1      HIS 139 -13.984   3.320  -8.224
  875    HE2  HIS 139           HE2      HIS 139 -11.538   2.800  -7.742
  876    H    GLU 140           H        GLU 140 -14.248   2.243 -14.085
  877    HA   GLU 140           HA       GLU 140 -13.585   1.772 -16.838
  878   1HB   GLU 140          1HB       GLU 140 -15.848   1.484 -15.818
  879   2HB   GLU 140          2HB       GLU 140 -15.996   3.236 -15.658
  880   1HG   GLU 140          1HG       GLU 140 -15.848   3.476 -18.124
  881   2HG   GLU 140          2HG       GLU 140 -15.603   1.737 -18.289
  882    H    GLY 141           H        GLY 141 -12.749   3.080 -18.370
  883   1HA   GLY 141          1HA       GLY 141 -12.443   5.091 -19.565
  884   2HA   GLY 141          2HA       GLY 141 -13.158   6.001 -18.221
  885    H    CYS 142           H        CYS 142 -10.919   3.969 -16.807
  886    HA   CYS 142           HA       CYS 142  -8.759   6.035 -16.959
  887   1HB   CYS 142          1HB       CYS 142 -10.031   5.537 -14.750
  888   2HB   CYS 142          2HB       CYS 142  -9.160   4.011 -14.723
  889    H    ASP 143           H        ASP 143  -6.581   5.341 -17.080
  890    HA   ASP 143           HA       ASP 143  -6.075   2.456 -17.656
  891   1HB   ASP 143          1HB       ASP 143  -5.355   4.789 -19.490
  892   2HB   ASP 143          2HB       ASP 143  -4.705   3.165 -19.666
  893    H    LYS 144           H        LYS 144  -5.382   4.811 -15.622
  894    HA   LYS 144           HA       LYS 144  -2.532   5.228 -15.798
  895   1HB   LYS 144          1HB       LYS 144  -4.388   5.317 -13.387
  896   2HB   LYS 144          2HB       LYS 144  -2.759   5.978 -13.436
  897   1HG   LYS 144          1HG       LYS 144  -4.862   6.997 -15.374
  898   2HG   LYS 144          2HG       LYS 144  -4.838   7.538 -13.695
  899   1HD   LYS 144          1HD       LYS 144  -2.615   8.455 -13.916
  900   2HD   LYS 144          2HD       LYS 144  -2.431   7.750 -15.528
  901   1HE   LYS 144          1HE       LYS 144  -2.905  10.117 -15.725
  902   2HE   LYS 144          2HE       LYS 144  -4.221   9.175 -16.413
  903   1HZ   LYS 144          1HZ       LYS 144  -4.940  11.078 -15.021
  904   2HZ   LYS 144          2HZ       LYS 144  -5.556   9.650 -14.492
  905   3HZ   LYS 144          3HZ       LYS 144  -4.332  10.368 -13.676
  906    H    ARG 145           H        ARG 145  -0.812   4.217 -14.751
  907    HA   ARG 145           HA       ARG 145  -1.405   1.784 -13.106
  908   1HB   ARG 145          1HB       ARG 145   0.848   1.864 -15.153
  909   2HB   ARG 145          2HB       ARG 145   0.257   0.509 -14.146
  910   1HG   ARG 145          1HG       ARG 145  -1.838   0.455 -15.397
  911   2HG   ARG 145          2HG       ARG 145  -1.259   1.744 -16.471
  912   1HD   ARG 145          1HD       ARG 145   0.557   0.374 -17.270
  913   2HD   ARG 145          2HD       ARG 145   0.212  -0.892 -16.072
  914    HE   ARG 145           HE       ARG 145  -2.143  -0.893 -17.309
  915   1HH1  ARG 145          1HH1      ARG 145   0.975  -0.842 -18.950
  916   2HH1  ARG 145          2HH1      ARG 145   0.316  -1.709 -20.313
  917   1HH2  ARG 145          1HH2      ARG 145  -2.840  -1.925 -18.898
  918   2HH2  ARG 145          2HH2      ARG 145  -1.856  -2.321 -20.314
  919    H    PHE 146           H        PHE 146   0.175   1.262 -11.583
  920    HA   PHE 146           HA       PHE 146   2.020   3.528 -10.922
  921   1HB   PHE 146          1HB       PHE 146   0.228   2.028  -8.946
  922   2HB   PHE 146          2HB       PHE 146   1.235   3.404  -8.617
  923    HD1  PHE 146           HD1      PHE 146  -1.926   2.352 -10.198
  924    HD2  PHE 146           HD2      PHE 146   0.750   5.662  -9.467
  925    HE1  PHE 146           HE1      PHE 146  -3.653   3.907 -10.952
  926    HE2  PHE 146           HE2      PHE 146  -0.973   7.227 -10.342
  927    HZ   PHE 146           HZ       PHE 146  -3.139   6.348 -11.152
  928    H    SER 147           H        SER 147   3.681   3.043  -9.389
  929    HA   SER 147           HA       SER 147   4.903   0.477 -10.032
  930   1HB   SER 147          1HB       SER 147   6.769   1.517  -8.540
  931   2HB   SER 147          2HB       SER 147   6.355   2.353 -10.055
  932    HG   SER 147           HG       SER 147   6.551   3.746  -8.239
  933    H    LEU 148           H        LEU 148   3.172   1.886  -7.299
  934    HA   LEU 148           HA       LEU 148   3.746  -0.590  -5.714
  935   1HB   LEU 148          1HB       LEU 148   3.974   2.307  -4.910
  936   2HB   LEU 148          2HB       LEU 148   3.358   1.200  -3.725
  937    HG   LEU 148           HG       LEU 148   5.688   1.634  -3.359
  938   1HD1  LEU 148          1HD1      LEU 148   4.989  -0.500  -2.576
  939   2HD1  LEU 148          2HD1      LEU 148   5.014  -1.191  -4.211
  940   3HD1  LEU 148          3HD1      LEU 148   6.537  -0.787  -3.372
  941   1HD2  LEU 148          1HD2      LEU 148   6.363   1.990  -5.756
  942   2HD2  LEU 148          2HD2      LEU 148   7.468   0.990  -4.787
  943   3HD2  LEU 148          3HD2      LEU 148   6.375   0.218  -5.935
  944    HA   PRO 149           HA       PRO 149  -0.641  -0.898  -5.242
  945   1HB   PRO 149          1HB       PRO 149  -0.849  -1.969  -2.669
  946   2HB   PRO 149          2HB       PRO 149  -0.417  -2.879  -4.129
  947   1HG   PRO 149          1HG       PRO 149   1.382  -1.868  -1.956
  948   2HG   PRO 149          2HG       PRO 149   1.499  -3.372  -2.937
  949   1HD   PRO 149          1HD       PRO 149   3.016  -1.103  -3.400
  950   2HD   PRO 149          2HD       PRO 149   2.628  -2.283  -4.611
  951    H    SER 150           H        SER 150   1.158   0.616  -2.542
  952    HA   SER 150           HA       SER 150  -1.028   2.014  -1.336
  953   1HB   SER 150          1HB       SER 150   0.780   3.548  -0.481
  954   2HB   SER 150          2HB       SER 150   1.080   1.829  -0.172
  955    HG   SER 150           HG       SER 150   2.867   3.173  -1.067
  956    H    ARG 151           H        ARG 151   1.035   2.750  -4.151
  957    HA   ARG 151           HA       ARG 151   0.133   5.507  -4.434
  958   1HB   ARG 151          1HB       ARG 151   1.549   3.608  -6.360
  959   2HB   ARG 151          2HB       ARG 151   1.228   5.323  -6.696
  960   1HG   ARG 151          1HG       ARG 151   2.495   5.967  -4.667
  961   2HG   ARG 151          2HG       ARG 151   2.801   4.266  -4.307
  962   1HD   ARG 151          1HD       ARG 151   3.956   4.125  -6.589
  963   2HD   ARG 151          2HD       ARG 151   3.881   5.905  -6.615
  964    HE   ARG 151           HE       ARG 151   4.903   4.809  -4.104
  965   1HH1  ARG 151          1HH1      ARG 151   6.066   5.791  -7.268
  966   2HH1  ARG 151          2HH1      ARG 151   7.702   5.953  -6.673
  967   1HH2  ARG 151          1HH2      ARG 151   6.779   4.973  -3.469
  968   2HH2  ARG 151          2HH2      ARG 151   8.141   5.459  -4.497
  969    H    LEU 152           H        LEU 152  -0.844   2.350  -5.813
  970    HA   LEU 152           HA       LEU 152  -2.819   3.424  -7.646
  971   1HB   LEU 152          1HB       LEU 152  -1.959   1.187  -7.927
  972   2HB   LEU 152          2HB       LEU 152  -2.427   0.733  -6.287
  973    HG   LEU 152           HG       LEU 152  -4.780   0.786  -6.853
  974   1HD1  LEU 152          1HD1      LEU 152  -4.749   2.633  -8.582
  975   2HD1  LEU 152          2HD1      LEU 152  -3.942   1.509  -9.690
  976   3HD1  LEU 152          3HD1      LEU 152  -5.587   1.177  -9.091
  977   1HD2  LEU 152          1HD2      LEU 152  -3.277  -0.710  -9.030
  978   2HD2  LEU 152          2HD2      LEU 152  -3.337  -1.256  -7.344
  979   3HD2  LEU 152          3HD2      LEU 152  -4.835  -1.136  -8.303
  980    H    LYS 153           H        LYS 153  -2.973   2.075  -4.282
  981    HA   LYS 153           HA       LYS 153  -5.767   2.436  -3.859
  982   1HB   LYS 153          1HB       LYS 153  -3.398   2.486  -1.956
  983   2HB   LYS 153          2HB       LYS 153  -5.050   2.588  -1.379
  984   1HG   LYS 153          1HG       LYS 153  -4.346   0.275  -3.198
  985   2HG   LYS 153          2HG       LYS 153  -3.707   0.281  -1.562
  986   1HD   LYS 153          1HD       LYS 153  -5.757  -0.986  -1.573
  987   2HD   LYS 153          2HD       LYS 153  -5.948   0.467  -0.606
  988   1HE   LYS 153          1HE       LYS 153  -7.969   0.203  -1.825
  989   2HE   LYS 153          2HE       LYS 153  -7.121   1.563  -2.549
  990   1HZ   LYS 153          1HZ       LYS 153  -7.285  -1.204  -3.627
  991   2HZ   LYS 153          2HZ       LYS 153  -7.957   0.147  -4.272
  992   3HZ   LYS 153          3HZ       LYS 153  -6.334  -0.047  -4.290
  993    H    ARG 154           H        ARG 154  -3.030   4.703  -3.414
  994    HA   ARG 154           HA       ARG 154  -4.615   6.864  -2.326
  995   1HB   ARG 154          1HB       ARG 154  -2.215   6.773  -2.015
  996   2HB   ARG 154          2HB       ARG 154  -1.917   6.796  -3.754
  997   1HG   ARG 154          1HG       ARG 154  -2.587   9.051  -3.948
  998   2HG   ARG 154          2HG       ARG 154  -3.290   9.084  -2.323
  999   1HD   ARG 154          1HD       ARG 154  -1.138  10.311  -2.418
 1000   2HD   ARG 154          2HD       ARG 154  -1.145   9.007  -1.269
 1001    HE   ARG 154           HE       ARG 154   0.319   7.731  -2.589
 1002   1HH1  ARG 154          1HH1      ARG 154  -0.298  10.705  -4.346
 1003   2HH1  ARG 154          2HH1      ARG 154   1.421  11.042  -4.425
 1004   1HH2  ARG 154          1HH2      ARG 154   2.425   7.948  -3.396
 1005   2HH2  ARG 154          2HH2      ARG 154   2.787   9.320  -4.408
 1006    H    HIS 155           H        HIS 155  -3.573   5.993  -5.652
 1007    HA   HIS 155           HA       HIS 155  -4.723   8.227  -7.013
 1008   1HB   HIS 155          1HB       HIS 155  -3.217   6.751  -8.176
 1009   2HB   HIS 155          2HB       HIS 155  -4.243   5.344  -7.891
 1010    HD1  HIS 155           HD1      HIS 155  -4.289   8.603  -9.951
 1011    HD2  HIS 155           HD2      HIS 155  -6.251   4.897  -9.546
 1012    HE1  HIS 155           HE1      HIS 155  -6.134   8.608 -11.686
 1013    H    GLU 156           H        GLU 156  -6.147   5.159  -5.843
 1014    HA   GLU 156           HA       GLU 156  -8.602   5.251  -7.169
 1015   1HB   GLU 156          1HB       GLU 156  -7.549   3.511  -5.462
 1016   2HB   GLU 156          2HB       GLU 156  -8.502   4.404  -4.262
 1017   1HG   GLU 156          1HG       GLU 156 -10.539   4.013  -5.682
 1018   2HG   GLU 156          2HG       GLU 156  -9.536   3.097  -6.814
 1019    H    LYS 157           H        LYS 157  -7.501   7.203  -4.398
 1020    HA   LYS 157           HA       LYS 157 -10.056   8.144  -3.471
 1021   1HB   LYS 157          1HB       LYS 157  -7.357   9.544  -3.483
 1022   2HB   LYS 157          2HB       LYS 157  -8.773  10.049  -2.567
 1023   1HG   LYS 157          1HG       LYS 157  -8.757   7.855  -1.355
 1024   2HG   LYS 157          2HG       LYS 157  -7.228   7.462  -2.147
 1025   1HD   LYS 157          1HD       LYS 157  -7.740   9.804  -0.242
 1026   2HD   LYS 157          2HD       LYS 157  -6.860   8.318   0.104
 1027   1HE   LYS 157          1HE       LYS 157  -5.059   9.647  -0.348
 1028   2HE   LYS 157          2HE       LYS 157  -5.383   9.027  -1.970
 1029   1HZ   LYS 157          1HZ       LYS 157  -6.686  11.141  -2.335
 1030   2HZ   LYS 157          2HZ       LYS 157  -6.051  11.713  -0.915
 1031   3HZ   LYS 157          3HZ       LYS 157  -5.105  11.310  -2.201
 1032    H    VAL 158           H        VAL 158  -8.103   8.974  -6.318
 1033    HA   VAL 158           HA       VAL 158  -9.307  11.499  -6.957
 1034    HB   VAL 158           HB       VAL 158  -8.297   9.375  -8.926
 1035   1HG1  VAL 158          1HG1      VAL 158  -7.802  11.318 -10.354
 1036   2HG1  VAL 158          2HG1      VAL 158  -9.535  11.294  -9.973
 1037   3HG1  VAL 158          3HG1      VAL 158  -8.428  12.399  -9.102
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.898  11.733  -7.646
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.463  10.048  -7.304
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.182  10.725  -8.931
 1041    H    HIS 159           H        HIS 159 -10.287   8.125  -7.679
 1042    HA   HIS 159           HA       HIS 159 -12.621   8.951  -9.231
 1043   1HB   HIS 159          1HB       HIS 159 -11.688   6.274  -8.099
 1044   2HB   HIS 159          2HB       HIS 159 -13.184   6.477  -9.035
 1045    HD1  HIS 159           HD1      HIS 159 -12.522   8.041 -11.501
 1046    HD2  HIS 159           HD2      HIS 159  -9.640   5.658  -9.575
 1047    HE1  HIS 159           HE1      HIS 159 -10.601   7.734 -13.154
 1048    H    ALA 160           H        ALA 160 -11.932   8.037  -5.850
 1049    HA   ALA 160           HA       ALA 160 -14.703   7.841  -5.025
 1050   1HB   ALA 160          1HB       ALA 160 -13.797   7.852  -2.762
 1051   2HB   ALA 160          2HB       ALA 160 -12.760   6.835  -3.783
 1052   3HB   ALA 160          3HB       ALA 160 -12.245   8.480  -3.335
 1053    H    GLY 161           H        GLY 161 -12.385  10.516  -5.383
 1054   1HA   GLY 161          1HA       GLY 161 -12.986  12.782  -5.655
 1055   2HA   GLY 161          2HA       GLY 161 -14.574  12.444  -4.999
 1056    H    TYR 162           H        TYR 162 -13.524  14.683  -4.138
 1057    HA   TYR 162           HA       TYR 162 -12.444  14.072  -1.407
 1058   1HB   TYR 162          1HB       TYR 162 -11.813  16.389  -3.265
 1059   2HB   TYR 162          2HB       TYR 162 -11.281  16.286  -1.568
 1060    HD1  TYR 162           HD1      TYR 162 -11.040  14.770  -4.963
 1061    HD2  TYR 162           HD2      TYR 162  -9.458  14.813  -0.945
 1062    HE1  TYR 162           HE1      TYR 162  -9.383  13.106  -5.614
 1063    HE2  TYR 162           HE2      TYR 162  -7.580  13.366  -1.680
 1064    HH   TYR 162           HH       TYR 162  -7.081  12.421  -5.034
 1065    HA   PRO 163           HA       PRO 163 -16.418  16.167  -0.933
 1066   1HB   PRO 163          1HB       PRO 163 -17.274  14.912   1.348
 1067   2HB   PRO 163          2HB       PRO 163 -17.257  14.092  -0.241
 1068   1HG   PRO 163          1HG       PRO 163 -15.184  13.900   1.959
 1069   2HG   PRO 163          2HG       PRO 163 -15.952  12.571   1.034
 1070   1HD   PRO 163          1HD       PRO 163 -13.504  13.624   0.383
 1071   2HD   PRO 163          2HD       PRO 163 -14.638  12.999  -0.859
 1072    H    CYS 164           H        CYS 164 -17.011  17.972   0.193
 1073    HA   CYS 164           HA       CYS 164 -15.044  19.251   1.886
 1074   1HB   CYS 164          1HB       CYS 164 -16.838  20.283   0.266
 1075   2HB   CYS 164          2HB       CYS 164 -17.932  20.145   1.661
 1076    H    LYS 165           H        LYS 165 -14.995  19.583   4.041
 1077    HA   LYS 165           HA       LYS 165 -17.256  18.656   5.728
 1078   1HB   LYS 165          1HB       LYS 165 -14.354  17.797   6.147
 1079   2HB   LYS 165          2HB       LYS 165 -15.666  17.531   7.304
 1080   1HG   LYS 165          1HG       LYS 165 -16.877  16.154   5.624
 1081   2HG   LYS 165          2HG       LYS 165 -15.509  16.315   4.513
 1082   1HD   LYS 165          1HD       LYS 165 -15.371  15.052   7.281
 1083   2HD   LYS 165          2HD       LYS 165 -15.530  14.169   5.756
 1084   1HE   LYS 165          1HE       LYS 165 -13.375  15.142   4.967
 1085   2HE   LYS 165          2HE       LYS 165 -13.192  15.982   6.514
 1086   1HZ   LYS 165          1HZ       LYS 165 -13.150  13.808   7.615
 1087   2HZ   LYS 165          2HZ       LYS 165 -13.318  13.031   6.188
 1088   3HZ   LYS 165          3HZ       LYS 165 -11.966  13.891   6.497
 1089    H    LYS 166           H        LYS 166 -15.551  21.167   4.752
 1090    HA   LYS 166           HA       LYS 166 -14.471  22.312   7.203
 1091   1HB   LYS 166          1HB       LYS 166 -15.393  23.581   4.612
 1092   2HB   LYS 166          2HB       LYS 166 -14.518  24.446   5.873
 1093   1HG   LYS 166          1HG       LYS 166 -13.412  22.037   4.360
 1094   2HG   LYS 166          2HG       LYS 166 -13.130  23.723   3.926
 1095   1HD   LYS 166          1HD       LYS 166 -11.941  24.176   5.954
 1096   2HD   LYS 166          2HD       LYS 166 -12.341  22.573   6.625
 1097   1HE   LYS 166          1HE       LYS 166 -11.110  21.492   4.768
 1098   2HE   LYS 166          2HE       LYS 166 -10.682  23.079   4.122
 1099   1HZ   LYS 166          1HZ       LYS 166  -9.472  23.518   6.198
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.871  22.046   6.789
 1101   3HZ   LYS 166          3HZ       LYS 166  -8.894  22.163   5.487
 1102    H    ASP 167           H        ASP 167 -17.695  21.985   5.902
 1103    HA   ASP 167           HA       ASP 167 -18.778  23.330   8.297
 1104   1HB   ASP 167          1HB       ASP 167 -18.553  25.132   6.513
 1105   2HB   ASP 167          2HB       ASP 167 -19.683  24.212   5.520
 1106    H    ASP 168           H        ASP 168 -20.815  22.558   8.886
 1107    HA   ASP 168           HA       ASP 168 -21.454  19.931   8.025
 1108   1HB   ASP 168          1HB       ASP 168 -23.089  21.956   9.616
 1109   2HB   ASP 168          2HB       ASP 168 -23.528  20.260   9.424
 1110    H    SER 169           H        SER 169 -22.641  23.083   6.907
 1111    HA   SER 169           HA       SER 169 -24.861  21.796   5.386
 1112   1HB   SER 169          1HB       SER 169 -24.139  24.736   5.787
 1113   2HB   SER 169          2HB       SER 169 -25.576  24.130   4.947
 1114    HG   SER 169           HG       SER 169 -25.999  24.679   7.147
 1115    H    CYS 170           H        CYS 170 -21.841  21.643   4.722
 1116    HA   CYS 170           HA       CYS 170 -22.053  22.641   1.910
 1117   1HB   CYS 170          1HB       CYS 170 -20.234  23.603   3.454
 1118   2HB   CYS 170          2HB       CYS 170 -19.506  22.009   3.426
 1119    H    SER 171           H        SER 171 -22.055  21.097   0.342
 1120    HA   SER 171           HA       SER 171 -21.339  18.283   1.120
 1121   1HB   SER 171          1HB       SER 171 -23.729  19.209  -0.533
 1122   2HB   SER 171          2HB       SER 171 -23.321  17.529  -0.138
 1123    HG   SER 171           HG       SER 171 -24.919  18.391   1.266
 1124    H    PHE 172           H        PHE 172 -20.081  20.584  -0.649
 1125    HA   PHE 172           HA       PHE 172 -20.023  19.665  -3.359
 1126   1HB   PHE 172          1HB       PHE 172 -19.194  21.846  -2.912
 1127   2HB   PHE 172          2HB       PHE 172 -18.166  21.290  -1.607
 1128    HD1  PHE 172           HD1      PHE 172 -16.039  20.121  -1.996
 1129    HD2  PHE 172           HD2      PHE 172 -18.391  21.605  -5.281
 1130    HE1  PHE 172           HE1      PHE 172 -14.129  19.755  -3.521
 1131    HE2  PHE 172           HE2      PHE 172 -16.399  21.438  -6.772
 1132    HZ   PHE 172           HZ       PHE 172 -14.247  20.557  -5.877
 1133    H    VAL 173           H        VAL 173 -18.747  18.176  -4.435
 1134    HA   VAL 173           HA       VAL 173 -16.594  16.811  -2.876
 1135    HB   VAL 173           HB       VAL 173 -18.474  15.458  -4.847
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.306  13.367  -4.123
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.135  14.464  -4.847
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.230  14.313  -3.083
 1139   1HG2  VAL 173          1HG2      VAL 173 -19.721  15.760  -2.837
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.102  14.110  -2.739
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.327  15.423  -1.806
 1142    H    GLY 174           H        GLY 174 -14.677  17.134  -3.773
 1143   1HA   GLY 174          1HA       GLY 174 -14.531  18.203  -6.522
 1144   2HA   GLY 174          2HA       GLY 174 -13.189  18.014  -5.379
 1145    H    LYS 175           H        LYS 175 -14.024  17.120  -8.346
 1146    HA   LYS 175           HA       LYS 175 -13.736  14.283  -8.394
 1147   1HB   LYS 175          1HB       LYS 175 -14.504  15.887 -10.260
 1148   2HB   LYS 175          2HB       LYS 175 -12.801  16.189 -10.578
 1149   1HG   LYS 175          1HG       LYS 175 -13.684  14.580 -12.142
 1150   2HG   LYS 175          2HG       LYS 175 -12.478  13.788 -11.137
 1151   1HD   LYS 175          1HD       LYS 175 -14.248  12.698  -9.807
 1152   2HD   LYS 175          2HD       LYS 175 -15.494  13.614 -10.685
 1153   1HE   LYS 175          1HE       LYS 175 -14.744  12.525 -12.810
 1154   2HE   LYS 175          2HE       LYS 175 -13.560  11.586 -11.893
 1155   1HZ   LYS 175          1HZ       LYS 175 -15.424  10.588 -10.657
 1156   2HZ   LYS 175          2HZ       LYS 175 -16.508  11.455 -11.519
 1157   3HZ   LYS 175          3HZ       LYS 175 -15.604  10.320 -12.259
 1158    H    THR 176           H        THR 176 -11.401  16.718  -7.675
 1159    HA   THR 176           HA       THR 176  -9.298  14.663  -7.465
 1160    HB   THR 176           HB       THR 176  -7.762  16.685  -8.514
 1161    HG1  THR 176           HG1      THR 176  -8.990  17.907  -9.622
 1162   1HG2  THR 176          1HG2      THR 176  -7.562  15.296 -10.534
 1163   2HG2  THR 176          2HG2      THR 176  -7.490  14.335  -9.039
 1164   3HG2  THR 176          3HG2      THR 176  -8.971  14.368 -10.044
 1165    H    TRP 177           H        TRP 177  -7.418  15.443  -6.242
 1166    HA   TRP 177           HA       TRP 177  -8.200  16.704  -3.866
 1167   1HB   TRP 177          1HB       TRP 177  -6.286  15.270  -3.949
 1168   2HB   TRP 177          2HB       TRP 177  -5.491  16.265  -5.145
 1169    HD1  TRP 177           HD1      TRP 177  -3.493  17.247  -4.200
 1170    HE1  TRP 177           HE1      TRP 177  -2.743  18.432  -2.039
 1171    HE3  TRP 177           HE3      TRP 177  -7.679  16.452  -1.434
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.542  18.185   0.717
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.573  16.722   1.029
 1174    HH2  TRP 177           HH2      TRP 177  -5.495  17.525   2.116
 1175    H    THR 178           H        THR 178  -6.562  18.147  -6.738
 1176    HA   THR 178           HA       THR 178  -6.077  20.733  -5.681
 1177    HB   THR 178           HB       THR 178  -6.439  21.483  -8.120
 1178    HG1  THR 178           HG1      THR 178  -6.203  18.904  -8.994
 1179   1HG2  THR 178          1HG2      THR 178  -4.380  19.312  -7.682
 1180   2HG2  THR 178          2HG2      THR 178  -4.392  20.529  -8.970
 1181   3HG2  THR 178          3HG2      THR 178  -4.203  21.027  -7.280
 1182    H    LEU 179           H        LEU 179  -8.996  19.502  -7.410
 1183    HA   LEU 179           HA       LEU 179 -10.395  21.954  -7.438
 1184   1HB   LEU 179          1HB       LEU 179 -11.521  19.120  -7.315
 1185   2HB   LEU 179          2HB       LEU 179 -12.433  20.563  -7.747
 1186    HG   LEU 179           HG       LEU 179 -10.122  19.369  -9.294
 1187   1HD1  LEU 179          1HD1      LEU 179 -13.082  19.641  -9.954
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.832  18.937 -11.005
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.236  18.150  -9.478
 1190   1HD2  LEU 179          1HD2      LEU 179 -11.778  21.855  -9.911
 1191   2HD2  LEU 179          2HD2      LEU 179 -10.021  21.789  -9.616
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.695  21.045 -11.064
 1193    H    TYR 180           H        TYR 180 -10.165  19.489  -4.876
 1194    HA   TYR 180           HA       TYR 180 -12.263  20.651  -3.217
 1195   1HB   TYR 180          1HB       TYR 180 -11.838  18.458  -2.720
 1196   2HB   TYR 180          2HB       TYR 180 -10.087  18.595  -2.854
 1197    HD1  TYR 180           HD1      TYR 180 -12.968  19.793  -0.729
 1198    HD2  TYR 180           HD2      TYR 180  -8.788  18.740  -0.905
 1199    HE1  TYR 180           HE1      TYR 180 -12.762  20.149   1.730
 1200    HE2  TYR 180           HE2      TYR 180  -8.610  19.014   1.561
 1201    HH   TYR 180           HH       TYR 180  -9.707  19.512   3.499
 1202    H    LEU 181           H        LEU 181  -8.657  20.733  -3.164
 1203    HA   LEU 181           HA       LEU 181  -8.396  22.549  -1.020
 1204   1HB   LEU 181          1HB       LEU 181  -6.691  22.042  -3.494
 1205   2HB   LEU 181          2HB       LEU 181  -6.226  23.179  -2.262
 1206    HG   LEU 181           HG       LEU 181  -6.660  20.162  -1.896
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.610  20.448  -3.028
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.207  21.933  -2.113
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.153  20.358  -1.324
 1210   1HD2  LEU 181          1HD2      LEU 181  -5.948  22.269   0.157
 1211   2HD2  LEU 181          2HD2      LEU 181  -7.286  21.107   0.195
 1212   3HD2  LEU 181          3HD2      LEU 181  -5.643  20.519   0.394
 1213    H    LYS 182           H        LYS 182  -8.814  23.222  -4.527
 1214    HA   LYS 182           HA       LYS 182  -8.611  26.093  -4.365
 1215   1HB   LYS 182          1HB       LYS 182  -8.479  24.809  -6.490
 1216   2HB   LYS 182          2HB       LYS 182 -10.189  24.369  -6.344
 1217   1HG   LYS 182          1HG       LYS 182 -10.809  26.788  -6.440
 1218   2HG   LYS 182          2HG       LYS 182  -9.094  27.218  -6.552
 1219   1HD   LYS 182          1HD       LYS 182  -8.950  25.943  -8.688
 1220   2HD   LYS 182          2HD       LYS 182 -10.677  25.577  -8.588
 1221   1HE   LYS 182          1HE       LYS 182  -9.477  28.392  -8.698
 1222   2HE   LYS 182          2HE       LYS 182 -10.061  27.503 -10.100
 1223   1HZ   LYS 182          1HZ       LYS 182 -11.738  28.473  -7.830
 1224   2HZ   LYS 182          2HZ       LYS 182 -11.786  28.941  -9.376
 1225   3HZ   LYS 182          3HZ       LYS 182 -12.283  27.440  -8.988
 1226    H    HIS 183           H        HIS 183 -11.422  23.849  -4.170
 1227    HA   HIS 183           HA       HIS 183 -13.438  25.856  -3.888
 1228   1HB   HIS 183          1HB       HIS 183 -14.107  23.612  -4.394
 1229   2HB   HIS 183          2HB       HIS 183 -13.245  22.943  -3.019
 1230    HD1  HIS 183           HD1      HIS 183 -16.540  24.760  -3.781
 1231    HD2  HIS 183           HD2      HIS 183 -14.373  23.067  -0.595
 1232    HE1  HIS 183           HE1      HIS 183 -18.126  24.693  -1.785
 1233    H    VAL 184           H        VAL 184 -11.380  24.160  -1.483
 1234    HA   VAL 184           HA       VAL 184 -12.620  25.255   0.856
 1235    HB   VAL 184           HB       VAL 184  -9.938  24.013   0.238
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.294  24.060   2.565
 1237   2HG1  VAL 184          2HG1      VAL 184  -9.358  25.704   1.928
 1238   3HG1  VAL 184          3HG1      VAL 184 -10.687  25.112   2.966
 1239   1HG2  VAL 184          1HG2      VAL 184 -11.786  22.538   0.414
 1240   2HG2  VAL 184          2HG2      VAL 184 -10.903  22.377   1.917
 1241   3HG2  VAL 184          3HG2      VAL 184 -12.427  23.350   1.857
 1242    H    ALA 185           H        ALA 185  -9.806  26.323  -1.091
 1243    HA   ALA 185           HA       ALA 185  -9.161  28.522   0.591
 1244   1HB   ALA 185          1HB       ALA 185  -7.828  29.300  -1.346
 1245   2HB   ALA 185          2HB       ALA 185  -7.602  27.562  -1.071
 1246   3HB   ALA 185          3HB       ALA 185  -8.651  28.123  -2.394
 1247    H    GLU 186           H        GLU 186 -11.505  28.112  -2.027
 1248    HA   GLU 186           HA       GLU 186 -11.950  31.000  -2.344
 1249   1HB   GLU 186          1HB       GLU 186 -11.938  29.213  -4.164
 1250   2HB   GLU 186          2HB       GLU 186 -13.523  28.706  -3.586
 1251   1HG   GLU 186          1HG       GLU 186 -14.414  30.950  -4.157
 1252   2HG   GLU 186          2HG       GLU 186 -12.796  31.479  -4.638
 1253    H    CYS 187           H        CYS 187 -13.421  28.348  -0.522
 1254    HA   CYS 187           HA       CYS 187 -15.889  30.007  -0.053
 1255   1HB   CYS 187          1HB       CYS 187 -15.589  26.967  -0.070
 1256   2HB   CYS 187          2HB       CYS 187 -17.086  27.867   0.200
 1257    HG   CYS 187           HG       CYS 187 -15.139  27.727  -2.447
 1258    H    HIS 188           H        HIS 188 -13.204  28.424   1.550
 1259    HA   HIS 188           HA       HIS 188 -14.491  28.979   4.201
 1260   1HB   HIS 188          1HB       HIS 188 -12.889  26.472   3.560
 1261   2HB   HIS 188          2HB       HIS 188 -13.651  26.869   5.103
 1262    HD1  HIS 188           HD1      HIS 188 -16.504  26.951   4.959
 1263    HD2  HIS 188           HD2      HIS 188 -14.270  25.122   1.905
 1264    HE1  HIS 188           HE1      HIS 188 -18.118  25.379   3.740
 1265    H    GLN 189           H        GLN 189 -12.231  30.117   2.316
 1266    HA   GLN 189           HA       GLN 189 -10.395  30.748   4.550
 1267   1HB   GLN 189          1HB       GLN 189  -9.699  28.690   2.805
 1268   2HB   GLN 189          2HB       GLN 189  -8.915  30.087   2.062
 1269   1HG   GLN 189          1HG       GLN 189  -7.685  30.520   4.155
 1270   2HG   GLN 189          2HG       GLN 189  -8.613  29.262   4.978
 1271   1HE2  GLN 189          1HE2      GLN 189  -6.954  27.771   5.472
 1272   2HE2  GLN 189          2HE2      GLN 189  -5.961  26.998   4.241
 1273    H    ASP 190           H        ASP 190  -8.601  32.335   3.612
 1274    HA   ASP 190           HA       ASP 190  -9.574  34.047   1.414
 1275   1HB   ASP 190          1HB       ASP 190  -9.774  36.055   2.730
 1276   2HB   ASP 190          2HB       ASP 190 -10.849  34.851   3.418
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  -6.928  30.224 -14.705
    2   2H5*    G   1          2H5*        G   1  -7.849  28.770 -14.270
    3    H4*    G   1           H4*        G   1  -7.031  28.637 -16.559
    4    H3*    G   1           H3*        G   1  -5.620  26.712 -14.692
    5    H2*    G   1           H2*        G   1  -4.687  25.743 -16.722
    6   2HO*    G   1          2HO*        G   1  -6.737  26.292 -18.005
    7    H1*    G   1           H1*        G   1  -3.912  28.139 -17.697
    8    H8     G   1           H8         G   1  -3.589  28.734 -13.997
    9    H1     G   1           H1         G   1   1.224  25.305 -16.519
   10   1H2     G   1          1H2         G   1   0.599  24.392 -18.395
   11   2H2     G   1          2H2         G   1  -0.898  24.857 -19.173
   12   1H5*    G   2          1H5*        G   2  -6.978  24.323 -17.824
   13   2H5*    G   2          2H5*        G   2  -7.743  22.845 -17.239
   14    H4*    G   2           H4*        G   2  -6.013  22.347 -18.879
   15    H3*    G   2           H3*        G   2  -5.281  21.490 -16.067
   16    H2*    G   2           H2*        G   2  -3.437  20.306 -17.123
   17   2HO*    G   2          2HO*        G   2  -4.827  19.883 -19.144
   18    H1*    G   2           H1*        G   2  -2.708  22.448 -18.626
   19    H8     G   2           H8         G   2  -4.021  24.045 -15.461
   20    H1     G   2           H1         G   2   1.839  21.465 -14.808
   21   1H2     G   2          1H2         G   2   2.199  20.031 -16.388
   22   2H2     G   2          2H2         G   2   1.095  19.844 -17.737
   23   1H5*    G   3          1H5*        G   3  -4.804  18.023 -18.344
   24   2H5*    G   3          2H5*        G   3  -5.573  16.630 -17.576
   25    H4*    G   3           H4*        G   3  -3.231  16.151 -18.109
   26    H3*    G   3           H3*        G   3  -3.836  16.402 -15.144
   27    H2*    G   3           H2*        G   3  -1.602  15.556 -14.795
   28   2HO*    G   3          2HO*        G   3  -1.825  14.084 -16.776
   29    H1*    G   3           H1*        G   3  -0.471  17.135 -16.733
   30    H8     G   3           H8         G   3  -3.116  19.284 -15.045
   31    H1     G   3           H1         G   3   2.416  18.831 -11.784
   32   1H2     G   3          1H2         G   3   3.532  17.114 -12.456
   33   2H2     G   3          2H2         G   3   3.041  16.179 -13.855
   34   1H5*    C   4          1H5*        C   4  -2.114  12.608 -15.283
   35   2H5*    C   4          2H5*        C   4  -2.985  11.467 -14.249
   36    H4*    C   4           H4*        C   4  -0.638  11.638 -13.591
   37    H3*    C   4           H3*        C   4  -2.582  12.795 -11.578
   38    H2*    C   4           H2*        C   4  -0.705  13.126 -10.141
   39   2HO*    C   4          2HO*        C   4   0.218  10.945 -10.880
   40    H1*    C   4           H1*        C   4   1.066  13.881 -12.155
   41   1H4     C   4          1H4         C   4  -1.089  19.025  -9.054
   42   2H4     C   4          2H4         C   4  -2.577  19.001  -9.971
   43    H5     C   4           H5         C   4  -3.096  17.310 -11.592
   44    H6     C   4           H6         C   4  -2.290  15.256 -12.650
   45   1H5*    C   5          1H5*        C   5  -1.222  11.566  -8.639
   46   2H5*    C   5          2H5*        C   5  -2.208  10.395  -7.771
   47    H4*    C   5           H4*        C   5  -1.672  12.453  -6.509
   48    H3*    C   5           H3*        C   5  -4.062  11.067  -6.319
   49    H2*    C   5           H2*        C   5  -5.181  12.483  -7.945
   50   2HO*    C   5          2HO*        C   5  -5.554  13.418  -5.295
   51    H1*    C   5           H1*        C   5  -4.030  14.879  -6.596
   52   1H4     C   5          1H4         C   5  -6.137  17.895 -11.729
   53   2H4     C   5          2H4         C   5  -5.790  16.534 -12.767
   54    H5     C   5           H5         C   5  -4.891  14.479 -11.952
   55    H6     C   5           H6         C   5  -4.293  13.228  -9.942
   56   1H5*    A   6          1H5*        A   6  -2.171  14.547  -4.258
   57   2H5*    A   6          2H5*        A   6  -0.758  13.489  -4.233
   58    H4*    A   6           H4*        A   6  -0.197  15.479  -3.271
   59    H3*    A   6           H3*        A   6  -0.355  13.240  -1.327
   60    H2*    A   6           H2*        A   6  -0.076  14.707   0.560
   61   2HO*    A   6          2HO*        A   6   1.576  16.080   0.048
   62    H1*    A   6           H1*        A   6  -1.481  16.870  -0.327
   63    H8     A   6           H8         A   6  -3.944  14.620  -1.599
   64   1H6     A   6          1H6         A   6  -5.858  13.602   4.199
   65   2H6     A   6          2H6         A   6  -6.177  13.276   2.514
   66    H2     A   6           H2         A   6  -2.028  15.822   4.405
   67   1H5*    U   7          1H5*        U   7   3.479  12.814   0.809
   68   2H5*    U   7          2H5*        U   7   2.390  14.093   0.295
   69    H4*    U   7           H4*        U   7   4.152  15.000   1.624
   70    H3*    U   7           H3*        U   7   3.397  16.152  -0.786
   71    H2*    U   7           H2*        U   7   5.189  15.116  -1.986
   72   2HO*    U   7          2HO*        U   7   5.860  17.705  -1.095
   73    H1*    U   7           H1*        U   7   7.030  15.800   0.338
   74    H3     U   7           H3         U   7  10.652  14.184  -1.736
   75    H5     U   7           H5         U   7   7.961  10.987  -1.777
   76    H6     U   7           H6         U   7   6.185  12.531  -1.099
   77   1H5*    A   8          1H5*        A   8   4.078  19.839  -0.842
   78   2H5*    A   8          2H5*        A   8   3.346  20.678   0.530
   79    H4*    A   8           H4*        A   8   2.535  21.728  -1.395
   80    H3*    A   8           H3*        A   8   0.762  20.739   0.425
   81    H2*    A   8           H2*        A   8   0.407  18.721  -0.867
   82   2HO*    A   8          2HO*        A   8  -1.690  19.602  -0.339
   83    H1*    A   8           H1*        A   8   0.068  20.585  -3.205
   84    H8     A   8           H8         A   8   2.363  17.505  -3.011
   85   1H6     A   8          1H6         A   8  -1.317  15.190  -7.434
   86   2H6     A   8          2H6         A   8   0.253  15.071  -6.676
   87    H2     A   8           H2         A   8  -3.277  18.817  -5.778
   88   1H5*    C   9          1H5*        C   9  -2.511  21.995  -0.406
   89   2H5*    C   9          2H5*        C   9  -2.863  23.513   0.431
   90    H4*    C   9           H4*        C   9  -4.358  21.849   1.214
   91    H3*    C   9           H3*        C   9  -2.315  22.576   3.285
   92    H2*    C   9           H2*        C   9  -3.465  21.057   4.773
   93   2HO*    C   9          2HO*        C   9  -5.616  21.712   3.569
   94    H1*    C   9           H1*        C   9  -3.773  19.036   2.985
   95   1H4     C   9          1H4         C   9   1.907  18.045   5.784
   96   2H4     C   9          2H4         C   9   2.672  18.595   4.308
   97    H5     C   9           H5         C   9   1.474  19.704   2.567
   98    H6     C   9           H6         C   9  -0.731  20.407   1.806
   99   1H5*    C  10          1H5*        C  10  -5.799  22.677   5.302
  100   2H5*    C  10          2H5*        C  10  -6.030  24.080   6.343
  101    H4*    C  10           H4*        C  10  -6.126  21.989   7.627
  102    H3*    C  10           H3*        C  10  -3.678  23.682   8.212
  103    H2*    C  10           H2*        C  10  -3.278  22.168  10.034
  104   2HO*    C  10          2HO*        C  10  -5.637  21.918  10.534
  105    H1*    C  10           H1*        C  10  -3.794  19.906   8.526
  106   1H4     C  10          1H4         C  10   2.473  20.663   8.006
  107   2H4     C  10          2H4         C  10   2.244  21.549   6.515
  108    H5     C  10           H5         C  10   0.091  22.258   5.724
  109    H6     C  10           H6         C  10  -2.312  22.221   6.200
  110   1H5*    U  11          1H5*        U  11  -5.121  23.921  12.136
  111   2H5*    U  11          2H5*        U  11  -4.724  25.525  12.765
  112    H4*    U  11           H4*        U  11  -3.510  23.572  13.818
  113    H3*    U  11           H3*        U  11  -1.896  25.743  12.491
  114    H2*    U  11           H2*        U  11   0.003  24.781  13.594
  115   2HO*    U  11          2HO*        U  11  -1.302  24.279  15.603
  116    H1*    U  11           H1*        U  11  -0.753  22.196  13.019
  117    H3     U  11           H3         U  11   2.909  23.096  10.411
  118    H5     U  11           H5         U  11  -0.239  24.992   8.402
  119    H6     U  11           H6         U  11  -1.702  24.455  10.298
  120   1H5*    C  12          1H5*        C  12  -0.219  26.773  16.683
  121   2H5*    C  12          2H5*        C  12   0.711  28.141  16.067
  122    H4*    C  12           H4*        C  12   1.346  25.202  16.145
  123    H3*    C  12           H3*        C  12   2.386  27.387  17.416
  124    H2*    C  12           H2*        C  12   2.961  28.516  15.380
  125   2HO*    C  12          2HO*        C  12   4.982  27.703  16.883
  126    H1*    C  12           H1*        C  12   4.207  25.916  14.429
  127   1H4     C  12          1H4         C  12   5.002  29.632   9.318
  128   2H4     C  12          2H4         C  12   3.313  30.075   9.306
  129    H5     C  12           H5         C  12   1.749  29.326  10.966
  130    H6     C  12           H6         C  12   1.492  27.982  13.001
  131   1H5*    U  13          1H5*        U  13   3.644  22.975  18.535
  132   2H5*    U  13          2H5*        U  13   4.455  23.072  20.099
  133    H4*    U  13           H4*        U  13   5.570  21.258  19.265
  134    H3*    U  13           H3*        U  13   7.266  23.469  19.067
  135    H2*    U  13           H2*        U  13   6.607  23.900  16.787
  136   2HO*    U  13          2HO*        U  13   8.974  22.313  16.859
  137    H1*    U  13           H1*        U  13   6.923  20.894  16.364
  138    H3     U  13           H3         U  13   6.565  21.566  11.889
  139    H5     U  13           H5         U  13   3.485  23.939  13.421
  140    H6     U  13           H6         U  13   4.206  23.327  15.687
  141   1H5*    U  14          1H5*        U  14  10.117  18.749  19.784
  142   2H5*    U  14          2H5*        U  14  11.546  19.553  19.139
  143    H4*    U  14           H4*        U  14   8.848  19.227  17.787
  144    H3*    U  14           H3*        U  14  11.263  17.664  17.719
  145    H2*    U  14           H2*        U  14  12.375  19.228  16.388
  146   2HO*    U  14          2HO*        U  14  10.910  17.473  14.701
  147    H1*    U  14           H1*        U  14   9.697  19.820  15.042
  148    H3     U  14           H3         U  14  11.988  22.278  11.951
  149    H5     U  14           H5         U  14  13.473  23.711  15.590
  150    H6     U  14           H6         U  14  12.141  22.000  16.749
  151   1H5*    G  15          1H5*        G  15   6.683  14.860  15.998
  152   2H5*    G  15          2H5*        G  15   7.144  16.389  15.227
  153    H4*    G  15           H4*        G  15   4.934  16.302  17.296
  154    H3*    G  15           H3*        G  15   4.725  15.667  14.346
  155    H2*    G  15           H2*        G  15   2.430  16.449  14.543
  156   2HO*    G  15          2HO*        G  15   2.199  15.650  16.840
  157    H1*    G  15           H1*        G  15   3.212  18.723  15.790
  158    H8     G  15           H8         G  15   6.185  18.199  13.591
  159    H1     G  15           H1         G  15   0.963  20.004  10.301
  160   1H2     G  15          1H2         G  15  -0.812  19.669  11.484
  161   2H2     G  15          2H2         G  15  -0.729  19.206  13.173
  162   1H5*    G  16          1H5*        G  16   1.148  14.097  15.789
  163   2H5*    G  16          2H5*        G  16   0.879  12.469  15.157
  164    H4*    G  16           H4*        G  16  -1.050  13.883  14.751
  165    H3*    G  16           H3*        G  16   0.455  13.186  12.213
  166    H2*    G  16           H2*        G  16  -1.473  14.136  11.074
  167   2HO*    G  16          2HO*        G  16  -3.026  13.329  12.779
  168    H1*    G  16           H1*        G  16  -1.511  16.367  12.611
  169    H8     G  16           H8         G  16   2.172  15.681  12.481
  170    H1     G  16           H1         G  16  -0.134  17.375   6.751
  171   1H2     G  16          1H2         G  16  -2.301  17.612   6.831
  172   2H2     G  16          2H2         G  16  -3.213  17.104   8.239
  173   1H5*    G  17          1H5*        G  17  -3.269  11.933  11.034
  174   2H5*    G  17          2H5*        G  17  -3.184  10.391  10.172
  175    H4*    G  17           H4*        G  17  -4.135  12.184   8.799
  176    H3*    G  17           H3*        G  17  -1.473  11.142   7.794
  177    H2*    G  17           H2*        G  17  -1.932  12.555   5.824
  178   2HO*    G  17          2HO*        G  17  -4.318  12.164   6.053
  179    H1*    G  17           H1*        G  17  -2.365  14.755   7.257
  180    H8     G  17           H8         G  17  -0.121  13.110   9.714
  181    H1     G  17           H1         G  17   2.985  15.484   4.618
  182   1H2     G  17          1H2         G  17   1.574  15.986   3.046
  183   2H2     G  17          2H2         G  17  -0.129  15.561   3.165
  184   1H5*    C  18          1H5*        C  18  -3.287  10.755   4.297
  185   2H5*    C  18          2H5*        C  18  -3.057   9.172   3.525
  186    H4*    C  18           H4*        C  18  -2.140  10.886   2.100
  187    H3*    C  18           H3*        C  18   0.108   9.411   3.491
  188    H2*    C  18           H2*        C  18   1.612  10.704   1.966
  189   2HO*    C  18          2HO*        C  18   0.491  11.150   0.077
  190    H1*    C  18           H1*        C  18   0.539  12.960   2.664
  191   1H4     C  18          1H4         C  18   4.644  11.705   7.368
  192   2H4     C  18          2H4         C  18   3.319  11.149   8.359
  193    H5     C  18           H5         C  18   1.071  10.950   7.562
  194    H6     C  18           H6         C  18  -0.359  11.200   5.607
  195   1H5*    C  19          1H5*        C  19   1.537   9.360  -0.215
  196   2H5*    C  19          2H5*        C  19   2.056   7.752  -0.737
  197    H4*    C  19           H4*        C  19   3.809   9.390  -1.123
  198    H3*    C  19           H3*        C  19   4.446   7.367   1.062
  199    H2*    C  19           H2*        C  19   6.676   8.275   0.996
  200   2HO*    C  19          2HO*        C  19   6.383   8.603  -1.457
  201    H1*    C  19           H1*        C  19   5.902  10.896   0.943
  202   1H4     C  19          1H4         C  19   6.600   9.222   7.074
  203   2H4     C  19          2H4         C  19   4.928   8.713   7.145
  204    H5     C  19           H5         C  19   3.489   8.641   5.233
  205    H6     C  19           H6         C  19   3.332   9.161   2.847
  206   1H5*    U  20          1H5*        U  20   7.796   7.027  -1.268
  207   2H5*    U  20          2H5*        U  20   8.162   5.330  -1.604
  208    H4*    U  20           H4*        U  20  10.066   6.376  -0.609
  209    H3*    U  20           H3*        U  20   8.710   4.527   1.389
  210    H2*    U  20           H2*        U  20  10.815   4.717   2.566
  211   2HO*    U  20          2HO*        U  20  12.171   4.840   0.574
  212    H1*    U  20           H1*        U  20  10.832   7.437   2.260
  213    H3     U  20           H3         U  20   9.698   6.505   6.611
  214    H5     U  20           H5         U  20   6.088   6.167   4.530
  215    H6     U  20           H6         U  20   7.337   6.411   2.423
  216   1H5*    G  21          1H5*        G  21  12.520   2.889   0.688
  217   2H5*    G  21          2H5*        G  21  12.486   1.126   0.716
  218    H4*    G  21           H4*        G  21  14.151   2.005   2.248
  219    H3*    G  21           H3*        G  21  11.823   0.756   3.756
  220    H2*    G  21           H2*        G  21  13.316   0.929   5.666
  221   2HO*    G  21          2HO*        G  21  15.319   0.590   4.233
  222    H1*    G  21           H1*        G  21  13.901   3.526   5.123
  223    H8     G  21           H8         G  21  10.313   3.082   3.930
  224    H1     G  21           H1         G  21  10.887   3.376  10.336
  225   1H2     G  21          1H2         G  21  12.954   3.123  10.905
  226   2H2     G  21          2H2         G  21  14.242   3.042   9.720
  227   1H5*    G  22          1H5*        G  22  15.198  -1.180   5.069
  228   2H5*    G  22          2H5*        G  22  15.001  -2.929   5.133
  229    H4*    G  22           H4*        G  22  15.858  -2.073   7.238
  230    H3*    G  22           H3*        G  22  13.006  -3.111   7.448
  231    H2*    G  22           H2*        G  22  13.260  -2.865   9.801
  232   2HO*    G  22          2HO*        G  22  15.518  -3.612   9.881
  233    H1*    G  22           H1*        G  22  14.482  -0.410   9.643
  234    H8     G  22           H8         G  22  11.860  -0.336   6.915
  235    H1     G  22           H1         G  22   9.416   0.256  12.844
  236   1H2     G  22          1H2         G  22  10.887  -0.312  14.313
  237   2H2     G  22          2H2         G  22  12.534  -0.725  13.874
  238   1H5*    U  23          1H5*        U  23  12.451  -7.356   9.816
  239   2H5*    U  23          2H5*        U  23  11.554  -5.912   9.297
  240    H4*    U  23           H4*        U  23  13.066  -6.166  11.922
  241    H3*    U  23           H3*        U  23  10.112  -6.285  11.239
  242    H2*    U  23           H2*        U  23   9.701  -5.520  13.463
  243   2HO*    U  23          2HO*        U  23  11.630  -6.686  14.390
  244    H1*    U  23           H1*        U  23  11.498  -3.492  13.224
  245    H3     U  23           H3         U  23   7.010  -2.232  12.644
  246    H5     U  23           H5         U  23   8.591  -2.709   8.800
  247    H6     U  23           H6         U  23  10.651  -3.603   9.810
  248   1H5*    U  24          1H5*        U  24   9.771  -8.101  14.396
  249   2H5*    U  24          2H5*        U  24   9.087  -9.729  14.448
  250    H4*    U  24           H4*        U  24   7.745  -8.302  15.824
  251    H3*    U  24           H3*        U  24   6.385  -8.793  13.174
  252    H2*    U  24           H2*        U  24   4.422  -7.907  14.130
  253   2HO*    U  24          2HO*        U  24   4.712  -8.838  16.310
  254    H1*    U  24           H1*        U  24   5.809  -5.801  15.278
  255    H3     U  24           H3         U  24   3.254  -4.323  11.698
  256    H5     U  24           H5         U  24   6.843  -5.651   9.983
  257    H6     U  24           H6         U  24   7.530  -6.501  12.183
  258   1H5*    A  25          1H5*        A  25   4.823 -12.775  11.872
  259   2H5*    A  25          2H5*        A  25   6.523 -13.148  11.642
  260    H4*    A  25           H4*        A  25   5.599 -12.685   9.492
  261    H3*    A  25           H3*        A  25   7.805 -11.165  10.283
  262    H2*    A  25           H2*        A  25   6.382  -9.311  10.943
  263   2HO*    A  25          2HO*        A  25   8.043  -8.493   9.615
  264    H1*    A  25           H1*        A  25   5.055  -9.990   8.250
  265    H8     A  25           H8         A  25   3.548  -8.922  11.712
  266   1H6     A  25          1H6         A  25   0.754  -4.492   8.320
  267   2H6     A  25          2H6         A  25   0.687  -5.382   9.829
  268    H2     A  25           H2         A  25   3.809  -6.505   5.775
  269   1H5*    G  26          1H5*        G  26   7.677 -14.130   5.181
  270   2H5*    G  26          2H5*        G  26   7.696 -12.393   4.937
  271    H4*    G  26           H4*        G  26   5.704 -13.001   6.959
  272    H3*    G  26           H3*        G  26   5.850 -15.257   5.314
  273    H2*    G  26           H2*        G  26   5.736 -13.774   3.408
  274   2HO*    G  26          2HO*        G  26   4.304 -15.611   3.061
  275    H1*    G  26           H1*        G  26   3.318 -12.712   4.916
  276    H8     G  26           H8         G  26   5.173 -12.606   1.622
  277    H1     G  26           H1         G  26   0.645  -8.144   2.348
  278   1H2     G  26          1H2         G  26   0.496  -7.600   4.436
  279   2H2     G  26          2H2         G  26   1.186  -8.594   5.708
  280   1H5*    U  27          1H5*        U  27   4.556 -15.683   8.529
  281   2H5*    U  27          2H5*        U  27   3.753 -17.238   8.840
  282    H4*    U  27           H4*        U  27   3.532 -16.202  10.904
  283    H3*    U  27           H3*        U  27   1.025 -15.376   9.375
  284    H2*    U  27           H2*        U  27   0.397 -14.016  11.222
  285   2HO*    U  27          2HO*        U  27   1.439 -15.722  12.755
  286    H1*    U  27           H1*        U  27   2.815 -12.880  11.647
  287    H3     U  27           H3         U  27   0.272  -9.781   9.406
  288    H5     U  27           H5         U  27   2.941 -11.418   6.663
  289    H6     U  27           H6         U  27   3.258 -13.318   8.182
  290   1H5*    A  28          1H5*        A  28  -0.736 -15.514  12.918
  291   2H5*    A  28          2H5*        A  28  -2.027 -16.715  12.880
  292    H4*    A  28           H4*        A  28  -2.953 -14.601  13.564
  293    H3*    A  28           H3*        A  28  -3.739 -15.298  10.706
  294    H2*    A  28           H2*        A  28  -5.191 -13.370  10.828
  295   2HO*    A  28          2HO*        A  28  -5.666 -13.789  13.206
  296    H1*    A  28           H1*        A  28  -3.296 -11.766  11.945
  297    H8     A  28           H8         A  28  -1.066 -13.631   9.664
  298   1H6     A  28          1H6         A  28  -3.187  -9.906   5.150
  299   2H6     A  28          2H6         A  28  -1.974 -11.108   5.554
  300    H2     A  28           H2         A  28  -6.216 -10.009   8.384
  301   1H5*    C  29          1H5*        C  29  -7.327 -14.558  11.758
  302   2H5*    C  29          2H5*        C  29  -8.509 -15.787  11.291
  303    H4*    C  29           H4*        C  29  -8.987 -13.702  10.154
  304    H3*    C  29           H3*        C  29  -7.871 -15.801   8.274
  305    H2*    C  29           H2*        C  29  -8.412 -14.212   6.494
  306   2HO*    C  29          2HO*        C  29 -10.410 -13.428   7.682
  307    H1*    C  29           H1*        C  29  -7.290 -12.119   7.719
  308   1H4     C  29          1H4         C  29  -2.651 -15.036   4.417
  309   2H4     C  29          2H4         C  29  -2.122 -15.832   5.883
  310    H5     C  29           H5         C  29  -3.344 -15.743   7.941
  311    H6     C  29           H6         C  29  -5.327 -14.820   9.031
  312   1H5*    C  30          1H5*        C  30 -11.421 -14.814   6.394
  313   2H5*    C  30          2H5*        C  30 -12.304 -16.234   5.819
  314    H4*    C  30           H4*        C  30 -11.799 -14.682   3.989
  315    H3*    C  30           H3*        C  30 -10.200 -17.253   3.808
  316    H2*    C  30           H2*        C  30  -9.628 -16.470   1.576
  317   2HO*    C  30          2HO*        C  30 -11.847 -15.364   1.355
  318    H1*    C  30           H1*        C  30  -9.035 -13.958   2.476
  319   1H4     C  30          1H4         C  30  -3.815 -17.654   2.589
  320   2H4     C  30          2H4         C  30  -4.150 -18.116   4.243
  321    H5     C  30           H5         C  30  -6.127 -17.429   5.427
  322    H6     C  30           H6         C  30  -8.224 -16.175   5.228
  323   1H5*    U  31          1H5*        U  31 -12.353 -16.779   0.116
  324   2H5*    U  31          2H5*        U  31 -13.308 -18.213  -0.257
  325    H4*    U  31           H4*        U  31 -12.248 -17.365  -2.257
  326    H3*    U  31           H3*        U  31 -11.005 -19.971  -1.353
  327    H2*    U  31           H2*        U  31  -9.845 -19.962  -3.451
  328   2HO*    U  31          2HO*        U  31 -11.749 -18.992  -4.630
  329    H1*    U  31           H1*        U  31  -9.133 -17.323  -3.288
  330    H3     U  31           H3         U  31  -5.324 -19.789  -2.413
  331    H5     U  31           H5         U  31  -7.216 -19.317   1.299
  332    H6     U  31           H6         U  31  -9.194 -18.460   0.132
  333   1H5*    C  32          1H5*        C  32 -12.254 -21.168  -4.917
  334   2H5*    C  32          2H5*        C  32 -13.005 -22.766  -4.941
  335    H4*    C  32           H4*        C  32 -10.991 -22.769  -6.299
  336    H3*    C  32           H3*        C  32 -10.568 -24.299  -3.710
  337    H2*    C  32           H2*        C  32  -8.408 -24.888  -4.615
  338   2HO*    C  32          2HO*        C  32  -9.417 -24.982  -6.908
  339    H1*    C  32           H1*        C  32  -7.867 -22.363  -5.576
  340   1H4     C  32          1H4         C  32  -5.282 -23.098   0.215
  341   2H4     C  32          2H4         C  32  -6.810 -22.742   0.989
  342    H5     C  32           H5         C  32  -8.830 -22.298  -0.230
  343    H6     C  32           H6         C  32  -9.809 -22.177  -2.472
  344   1H5*    U  33          1H5*        U  33  -8.784 -26.839  -5.939
  345   2H5*    U  33          2H5*        U  33  -9.495 -28.454  -5.913
  346    H4*    U  33           H4*        U  33  -7.156 -28.674  -5.349
  347    H3*    U  33           H3*        U  33  -8.932 -28.881  -2.898
  348    H2*    U  33           H2*        U  33  -7.094 -29.341  -1.637
  349   2HO*    U  33          2HO*        U  33  -5.198 -29.778  -3.748
  350    H1*    U  33           H1*        U  33  -5.318 -27.709  -3.118
  351    H3     U  33           H3         U  33  -5.147 -26.268   1.217
  352    H5     U  33           H5         U  33  -9.102 -25.473   0.111
  353    H6     U  33           H6         U  33  -8.631 -26.449  -2.094
  354   1H5*    U  34          1H5*        U  34  -9.099 -34.526  -2.481
  355   2H5*    U  34          2H5*        U  34  -8.323 -33.645  -1.162
  356    H4*    U  34           H4*        U  34  -7.201 -35.767  -1.605
  357    H3*    U  34           H3*        U  34  -5.780 -33.461  -1.178
  358    H2*    U  34           H2*        U  34  -5.549 -32.949  -3.512
  359   2HO*    U  34          2HO*        U  34  -3.280 -34.465  -2.666
  360    H1*    U  34           H1*        U  34  -4.869 -35.886  -3.934
  361    H3     U  34           H3         U  34  -4.008 -35.163  -8.308
  362    H5     U  34           H5         U  34  -7.334 -32.712  -7.646
  363    H6     U  34           H6         U  34  -7.315 -33.413  -5.291
  364   1H5*    C  35          1H5*        C  35  -2.298 -33.725  -0.581
  365   2H5*    C  35          2H5*        C  35  -1.904 -34.693   0.840
  366    H4*    C  35           H4*        C  35  -0.864 -32.500   0.926
  367    H3*    C  35           H3*        C  35  -2.015 -33.643   3.125
  368    H2*    C  35           H2*        C  35  -4.151 -32.619   2.766
  369   2HO*    C  35          2HO*        C  35  -2.609 -31.010   4.542
  370    H1*    C  35           H1*        C  35  -2.783 -29.960   2.232
  371   1H4     C  35          1H4         C  35  -8.997 -28.945   1.164
  372   2H4     C  35          2H4         C  35  -9.025 -30.189  -0.076
  373    H5     C  35           H5         C  35  -7.159 -31.600  -0.523
  374    H6     C  35           H6         C  35  -4.786 -31.960  -0.085
  375   1H5*    G  36          1H5*        G  36   2.512 -30.443   3.131
  376   2H5*    G  36          2H5*        G  36   0.934 -30.432   2.327
  377    H4*    G  36           H4*        G  36   3.429 -31.810   1.262
  378    H3*    G  36           H3*        G  36   1.946 -29.287   0.430
  379    H2*    G  36           H2*        G  36   2.675 -29.731  -1.781
  380   2HO*    G  36          2HO*        G  36   4.929 -30.333  -0.802
  381    H1*    G  36           H1*        G  36   2.686 -32.553  -1.427
  382    H8     G  36           H8         G  36   1.304 -32.878  -3.640
  383    H1     G  36           H1         G  36  -3.212 -28.679  -1.781
  384   1H2     G  36          1H2         G  36  -2.702 -27.798   0.097
  385   2H2     G  36          2H2         G  36  -1.212 -28.168   0.935
  386   1H5*    G  37          1H5*        G  37   4.456 -28.205  -1.600
  387   2H5*    G  37          2H5*        G  37   4.953 -26.513  -1.568
  388    H4*    G  37           H4*        G  37   3.568 -27.305  -3.570
  389    H3*    G  37           H3*        G  37   2.542 -24.946  -1.946
  390    H2*    G  37           H2*        G  37   0.961 -24.727  -3.824
  391   2HO*    G  37          2HO*        G  37   2.669 -25.648  -5.414
  392    H1*    G  37           H1*        G  37   0.274 -27.327  -3.756
  393    H8     G  37           H8         G  37   1.148 -26.255  -0.173
  394    H1     G  37           H1         G  37  -4.459 -23.944  -2.297
  395   1H2     G  37          1H2         G  37  -4.680 -24.370  -4.401
  396   2H2     G  37          2H2         G  37  -3.555 -25.397  -5.267
  397   1H5*    U  38          1H5*        U  38   1.973 -23.734  -5.712
  398   2H5*    U  38          2H5*        U  38   2.688 -22.190  -6.150
  399    H4*    U  38           H4*        U  38   0.353 -22.286  -6.788
  400    H3*    U  38           H3*        U  38   0.830 -20.364  -4.530
  401    H2*    U  38           H2*        U  38  -1.378 -19.524  -4.975
  402   2HO*    U  38          2HO*        U  38  -1.385 -19.755  -7.305
  403    H1*    U  38           H1*        U  38  -2.461 -22.027  -4.999
  404    H3     U  38           H3         U  38  -3.507 -20.483  -0.809
  405    H5     U  38           H5         U  38   0.389 -21.949  -0.429
  406    H6     U  38           H6         U  38   0.467 -22.224  -2.860
  407   1H5*    G  39          1H5*        G  39  -0.163 -17.861  -7.667
  408   2H5*    G  39          2H5*        G  39   0.742 -16.352  -7.594
  409    H4*    G  39           H4*        G  39  -1.613 -15.917  -7.633
  410    H3*    G  39           H3*        G  39  -0.550 -15.353  -4.858
  411    H2*    G  39           H2*        G  39  -2.777 -14.413  -4.475
  412   2HO*    G  39          2HO*        G  39  -2.962 -13.702  -6.848
  413    H1*    G  39           H1*        G  39  -4.009 -16.608  -5.460
  414    H8     G  39           H8         G  39  -0.676 -17.714  -3.894
  415    H1     G  39           H1         G  39  -5.315 -16.486   0.380
  416   1H2     G  39          1H2         G  39  -6.938 -15.438  -0.585
  417   2H2     G  39          2H2         G  39  -7.009 -15.229  -2.322
  418   1H5*    G  40          1H5*        G  40  -2.581 -11.995  -5.963
  419   2H5*    G  40          2H5*        G  40  -1.809 -10.509  -5.376
  420    H4*    G  40           H4*        G  40  -4.145 -10.563  -4.778
  421    H3*    G  40           H3*        G  40  -2.121 -10.665  -2.513
  422    H2*    G  40           H2*        G  40  -4.040 -10.290  -1.066
  423   2HO*    G  40          2HO*        G  40  -5.107  -8.858  -2.810
  424    H1*    G  40           H1*        G  40  -5.590 -12.141  -2.264
  425    H8     G  40           H8         G  40  -2.188 -13.714  -2.521
  426    H1     G  40           H1         G  40  -4.423 -13.585   3.503
  427   1H2     G  40          1H2         G  40  -6.160 -12.312   3.630
  428   2H2     G  40          2H2         G  40  -6.799 -11.469   2.232
  429   1H5*    G  41          1H5*        G  41  -4.186  -8.126  -0.868
  430   2H5*    G  41          2H5*        G  41  -3.341  -6.657  -0.408
  431    H4*    G  41           H4*        G  41  -4.211  -7.638   1.593
  432    H3*    G  41           H3*        G  41  -1.228  -8.077   1.322
  433    H2*    G  41           H2*        G  41  -1.298  -8.910   3.617
  434   2HO*    G  41          2HO*        G  41  -3.007  -7.541   4.453
  435    H1*    G  41           H1*        G  41  -3.379 -10.573   3.100
  436    H8     G  41           H8         G  41  -1.645 -10.477  -0.256
  437    H1     G  41           H1         G  41   1.230 -14.347   4.005
  438   1H2     G  41          1H2         G  41   0.554 -13.941   5.986
  439   2H2     G  41          2H2         G  41  -0.661 -12.724   6.353
  440   1H5*    A  42          1H5*        A  42  -0.420  -4.125   4.992
  441   2H5*    A  42          2H5*        A  42  -0.124  -5.453   6.116
  442    H4*    A  42           H4*        A  42  -2.810  -4.707   4.891
  443    H3*    A  42           H3*        A  42  -1.688  -4.794   7.715
  444    H2*    A  42           H2*        A  42  -3.967  -5.139   8.471
  445   2HO*    A  42          2HO*        A  42  -4.918  -3.775   6.669
  446    H1*    A  42           H1*        A  42  -4.388  -7.157   6.738
  447    H8     A  42           H8         A  42  -0.846  -7.888   7.114
  448   1H6     A  42          1H6         A  42  -1.940  -9.914  12.880
  449   2H6     A  42          2H6         A  42  -0.868 -10.048  11.502
  450    H2     A  42           H2         A  42  -5.420  -7.475  11.609
  451   1H5*    A  43          1H5*        A  43  -4.442  -2.267   8.083
  452   2H5*    A  43          2H5*        A  43  -4.443  -0.685   8.825
  453    H4*    A  43           H4*        A  43  -5.830  -2.147  10.148
  454    H3*    A  43           H3*        A  43  -3.153  -1.695  11.525
  455    H2*    A  43           H2*        A  43  -3.975  -3.092  13.325
  456   2HO*    A  43          2HO*        A  43  -6.257  -2.168  13.003
  457    H1*    A  43           H1*        A  43  -5.043  -5.013  11.660
  458    H8     A  43           H8         A  43  -1.987  -4.241   9.758
  459   1H6     A  43          1H6         A  43   1.138  -7.811  13.746
  460   2H6     A  43          2H6         A  43   1.150  -7.109  12.139
  461    H2     A  43           H2         A  43  -2.744  -6.745  15.625
  462   1H5*    U  44          1H5*        U  44  -5.180  -1.039  14.730
  463   2H5*    U  44          2H5*        U  44  -4.713   0.458  15.555
  464    H4*    U  44           H4*        U  44  -4.110  -1.435  16.944
  465    H3*    U  44           H3*        U  44  -1.694  -0.165  15.616
  466    H2*    U  44           H2*        U  44  -0.368  -1.599  17.022
  467   2HO*    U  44          2HO*        U  44  -2.031  -1.411  18.853
  468    H1*    U  44           H1*        U  44  -1.864  -3.832  16.518
  469    H3     U  44           H3         U  44   2.062  -4.199  14.081
  470    H5     U  44           H5         U  44  -0.493  -1.945  11.652
  471    H6     U  44           H6         U  44  -2.056  -1.790  13.530
  472   1H5*    A  45          1H5*        A  45  -0.650  -0.071  19.565
  473   2H5*    A  45          2H5*        A  45   0.146   1.439  20.021
  474    H4*    A  45           H4*        A  45   1.590  -0.478  20.436
  475    H3*    A  45           H3*        A  45   2.582   1.239  18.129
  476    H2*    A  45           H2*        A  45   4.602  -0.063  18.311
  477   2HO*    A  45          2HO*        A  45   4.371  -0.302  20.750
  478    H1*    A  45           H1*        A  45   3.259  -2.426  18.348
  479    H8     A  45           H8         A  45   1.169  -0.047  16.220
  480   1H6     A  45          1H6         A  45   4.942  -1.565  11.506
  481   2H6     A  45          2H6         A  45   3.415  -0.822  11.939
  482    H2     A  45           H2         A  45   6.675  -3.212  15.236
  483   1H5*    C  46          1H5*        C  46   5.638   1.184  20.876
  484   2H5*    C  46          2H5*        C  46   6.357   2.780  21.098
  485    H4*    C  46           H4*        C  46   8.049   1.141  20.523
  486    H3*    C  46           H3*        C  46   7.542   3.108  18.255
  487    H2*    C  46           H2*        C  46   9.594   2.225  17.358
  488   2HO*    C  46          2HO*        C  46  10.578   1.923  19.586
  489    H1*    C  46           H1*        C  46   8.852  -0.374  17.851
  490   1H4     C  46          1H4         C  46   6.956   1.047  11.926
  491   2H4     C  46          2H4         C  46   5.407   1.592  12.531
  492    H5     C  46           H5         C  46   4.899   1.783  14.872
  493    H6     C  46           H6         C  46   5.785   1.449  17.135
  494   1H5*    C  47          1H5*        C  47  11.516   3.647  19.291
  495   2H5*    C  47          2H5*        C  47  11.966   5.354  19.280
  496    H4*    C  47           H4*        C  47  13.420   4.051  17.827
  497    H3*    C  47           H3*        C  47  11.556   5.863  16.262
  498    H2*    C  47           H2*        C  47  13.033   5.361  14.404
  499   2HO*    C  47          2HO*        C  47  15.029   5.286  15.759
  500    H1*    C  47           H1*        C  47  13.061   2.675  14.996
  501   1H4     C  47          1H4         C  47   8.364   3.687  10.794
  502   2H4     C  47          2H4         C  47   7.256   4.097  12.084
  503    H5     C  47           H5         C  47   7.910   4.239  14.391
  504    H6     C  47           H6         C  47   9.794   4.007  15.945
  505   1H5*    A  48          1H5*        A  48  15.558   7.168  15.437
  506   2H5*    A  48          2H5*        A  48  15.640   8.926  15.313
  507    H4*    A  48           H4*        A  48  16.601   7.855  13.348
  508    H3*    A  48           H3*        A  48  13.989   9.263  12.736
  509    H2*    A  48           H2*        A  48  14.617   8.905  10.403
  510   2HO*    A  48          2HO*        A  48  17.023   9.102  10.912
  511    H1*    A  48           H1*        A  48  15.143   6.281  10.828
  512    H8     A  48           H8         A  48  12.389   7.109  13.306
  513   1H6     A  48          1H6         A  48   8.405   6.524   8.562
  514   2H6     A  48          2H6         A  48   8.556   6.699  10.299
  515    H2     A  48           H2         A  48  12.523   6.526   6.903
  516   1H5*    G  49          1H5*        G  49  16.823  10.915  10.154
  517   2H5*    G  49          2H5*        G  49  16.681  12.665   9.997
  518    H4*    G  49           H4*        G  49  16.716  11.573   7.822
  519    H3*    G  49           H3*        G  49  14.002  12.786   8.464
  520    H2*    G  49           H2*        G  49  13.511  12.306   6.113
  521   2HO*    G  49          2HO*        G  49  15.919  12.657   5.514
  522    H1*    G  49           H1*        G  49  14.396   9.766   6.293
  523    H8     G  49           H8         G  49  13.059  10.357   9.769
  524    H1     G  49           H1         G  49   8.425   9.778   5.352
  525   1H2     G  49          1H2         G  49   9.242  10.110   3.380
  526   2H2     G  49          2H2         G  49  10.968  10.224   3.099
  527   1H5*    G  50          1H5*        G  50  14.815  14.142   4.725
  528   2H5*    G  50          2H5*        G  50  14.644  15.884   4.539
  529    H4*    G  50           H4*        G  50  13.435  14.663   2.793
  530    H3*    G  50           H3*        G  50  11.623  16.135   4.736
  531    H2*    G  50           H2*        G  50   9.820  15.531   3.196
  532   2HO*    G  50          2HO*        G  50  11.446  15.680   1.282
  533    H1*    G  50           H1*        G  50  10.620  12.939   2.966
  534    H8     G  50           H8         G  50  11.482  13.511   6.552
  535    H1     G  50           H1         G  50   5.158  12.892   5.516
  536   1H2     G  50          1H2         G  50   4.737  13.044   3.418
  537   2H2     G  50          2H2         G  50   5.966  13.483   2.248
  538   1H5*    U  51          1H5*        U  51  10.304  17.248   1.113
  539   2H5*    U  51          2H5*        U  51  10.397  18.968   0.737
  540    H4*    U  51           H4*        U  51   8.195  18.088   0.178
  541    H3*    U  51           H3*        U  51   8.628  20.362   1.767
  542    H2*    U  51           H2*        U  51   8.001  19.445   3.744
  543   2HO*    U  51          2HO*        U  51   5.289  19.725   2.913
  544    H1*    U  51           H1*        U  51   5.905  17.689   2.465
  545    H3     U  51           H3         U  51   4.854  16.102   6.504
  546    H5     U  51           H5         U  51   8.960  16.838   6.894
  547    H6     U  51           H6         U  51   9.027  17.426   4.511
  548   1H5*    G  52          1H5*        G  52   7.454  22.140  -2.449
  549   2H5*    G  52          2H5*        G  52   5.812  22.280  -3.059
  550    H4*    G  52           H4*        G  52   7.169  19.639  -2.367
  551    H3*    G  52           H3*        G  52   6.531  21.076  -4.968
  552    H2*    G  52           H2*        G  52   6.451  18.900  -6.001
  553   2HO*    G  52          2HO*        G  52   7.037  17.640  -3.498
  554    H1*    G  52           H1*        G  52   4.877  17.875  -4.011
  555    H8     G  52           H8         G  52   3.707  21.453  -4.319
  556    H1     G  52           H1         G  52   1.227  17.428  -8.680
  557   1H2     G  52          1H2         G  52   2.512  15.709  -8.917
  558   2H2     G  52          2H2         G  52   3.911  15.442  -7.896
  559   1H5*    C  53          1H5*        C  53   9.340  18.347  -6.330
  560   2H5*    C  53          2H5*        C  53  10.481  19.086  -7.460
  561    H4*    C  53           H4*        C  53   9.389  17.178  -8.485
  562    H3*    C  53           H3*        C  53   8.386  19.781  -9.691
  563    H2*    C  53           H2*        C  53   7.371  18.345 -11.360
  564   2HO*    C  53          2HO*        C  53   9.228  16.726 -11.215
  565    H1*    C  53           H1*        C  53   6.333  16.643  -9.496
  566   1H4     C  53          1H4         C  53   1.806  21.023 -10.200
  567   2H4     C  53          2H4         C  53   2.543  22.016  -8.962
  568    H5     C  53           H5         C  53   4.725  21.590  -8.060
  569    H6     C  53           H6         C  53   6.551  19.962  -7.990
  570   1H5*    C  54          1H5*        C  54   9.679  17.603 -12.995
  571   2H5*    C  54          2H5*        C  54  10.551  18.619 -14.148
  572    H4*    C  54           H4*        C  54   8.699  17.462 -15.225
  573    H3*    C  54           H3*        C  54   8.177  20.446 -14.980
  574    H2*    C  54           H2*        C  54   6.353  20.012 -16.511
  575   2HO*    C  54          2HO*        C  54   7.657  18.224 -17.639
  576    H1*    C  54           H1*        C  54   5.494  17.828 -15.109
  577   1H4     C  54          1H4         C  54   2.376  22.795 -12.641
  578   2H4     C  54          2H4         C  54   3.666  23.062 -11.494
  579    H5     C  54           H5         C  54   5.747  21.876 -11.553
  580    H6     C  54           H6         C  54   6.994  20.106 -12.699
  581   1H5*    C  55          1H5*        C  55   7.750  19.691 -19.037
  582   2H5*    C  55          2H5*        C  55   8.584  20.903 -20.011
  583    H4*    C  55           H4*        C  55   6.249  20.736 -20.686
  584    H3*    C  55           H3*        C  55   6.875  23.329 -19.223
  585    H2*    C  55           H2*        C  55   4.700  24.046 -19.872
  586   2HO*    C  55          2HO*        C  55   4.898  23.004 -22.062
  587    H1*    C  55           H1*        C  55   3.496  21.602 -19.343
  588   1H4     C  55          1H4         C  55   2.730  25.481 -14.319
  589   2H4     C  55          2H4         C  55   4.310  25.048 -13.704
  590    H5     C  55           H5         C  55   5.818  23.584 -14.860
  591    H6     C  55           H6         C  55   6.131  22.251 -16.895
  592   1H    MET 104          1H        MET 104  10.331 -15.847   3.233
  593    HA   MET 104           HA       MET 104  11.288 -13.109   2.631
  594   1HB   MET 104          1HB       MET 104  13.103 -14.435   3.917
  595   2HB   MET 104          2HB       MET 104  13.209 -15.472   2.507
  596   1HG   MET 104          1HG       MET 104  14.719 -14.068   1.699
  597   2HG   MET 104          2HG       MET 104  13.459 -12.873   1.440
  598   1HE   MET 104          1HE       MET 104  12.599 -11.512   3.848
  599   2HE   MET 104          2HE       MET 104  13.853 -10.427   4.462
  600   3HE   MET 104          3HE       MET 104  13.524 -10.482   2.719
  601    H    TYR 105           H        TYR 105  10.972 -12.654   0.531
  602    HA   TYR 105           HA       TYR 105  10.293 -14.924  -1.316
  603   1HB   TYR 105          1HB       TYR 105   9.266 -12.082  -1.052
  604   2HB   TYR 105          2HB       TYR 105   9.083 -12.969  -2.559
  605    HD1  TYR 105           HD1      TYR 105   7.399 -14.542  -2.876
  606    HD2  TYR 105           HD2      TYR 105   8.291 -13.375   1.223
  607    HE1  TYR 105           HE1      TYR 105   5.524 -15.931  -2.035
  608    HE2  TYR 105           HE2      TYR 105   6.582 -14.920   2.014
  609    HH   TYR 105           HH       TYR 105   4.477 -16.797  -0.195
  610    H    VAL 106           H        VAL 106  11.638 -15.341  -2.939
  611    HA   VAL 106           HA       VAL 106  13.820 -13.357  -3.459
  612    HB   VAL 106           HB       VAL 106  13.719 -16.370  -3.858
  613   1HG1  VAL 106          1HG1      VAL 106  15.399 -15.389  -5.366
  614   2HG1  VAL 106          2HG1      VAL 106  16.117 -14.489  -4.010
  615   3HG1  VAL 106          3HG1      VAL 106  16.185 -16.262  -4.059
  616   1HG2  VAL 106          1HG2      VAL 106  13.667 -15.776  -1.479
  617   2HG2  VAL 106          2HG2      VAL 106  15.217 -16.502  -1.955
  618   3HG2  VAL 106          3HG2      VAL 106  15.098 -14.730  -1.716
  619    H    CYS 107           H        CYS 107  14.357 -12.675  -5.475
  620    HA   CYS 107           HA       CYS 107  12.590 -13.285  -7.731
  621   1HB   CYS 107          1HB       CYS 107  13.492 -10.994  -7.347
  622   2HB   CYS 107          2HB       CYS 107  15.133 -11.621  -7.535
  623    H    HIS 108           H        HIS 108  12.935 -14.791  -9.237
  624    HA   HIS 108           HA       HIS 108  15.549 -16.235  -9.190
  625   1HB   HIS 108          1HB       HIS 108  12.789 -17.202 -10.069
  626   2HB   HIS 108          2HB       HIS 108  14.271 -18.169 -10.083
  627    HD2  HIS 108           HD2      HIS 108  11.360 -18.065  -8.075
  628    HE1  HIS 108           HE1      HIS 108  14.337 -18.198  -5.013
  629    HE2  HIS 108           HE2      HIS 108  11.856 -18.499  -5.525
  630    H    PHE 109           H        PHE 109  14.766 -13.716 -10.739
  631    HA   PHE 109           HA       PHE 109  14.721 -14.382 -13.552
  632   1HB   PHE 109          1HB       PHE 109  14.385 -12.058 -12.300
  633   2HB   PHE 109          2HB       PHE 109  16.125 -11.917 -12.444
  634    HD1  PHE 109           HD1      PHE 109  12.905 -11.834 -14.094
  635    HD2  PHE 109           HD2      PHE 109  17.172 -11.632 -14.639
  636    HE1  PHE 109           HE1      PHE 109  12.528 -11.013 -16.415
  637    HE2  PHE 109           HE2      PHE 109  16.806 -10.783 -16.988
  638    HZ   PHE 109           HZ       PHE 109  14.474 -10.460 -17.853
  639    H    GLU 110           H        GLU 110  16.531 -14.304 -15.048
  640    HA   GLU 110           HA       GLU 110  18.531 -16.117 -14.370
  641   1HB   GLU 110          1HB       GLU 110  17.812 -15.512 -16.678
  642   2HB   GLU 110          2HB       GLU 110  18.686 -13.983 -16.555
  643   1HG   GLU 110          1HG       GLU 110  20.821 -15.229 -16.281
  644   2HG   GLU 110          2HG       GLU 110  19.941 -16.757 -16.307
  645    H    ASN 111           H        ASN 111  20.085 -15.950 -12.858
  646    HA   ASN 111           HA       ASN 111  22.081 -15.291 -11.895
  647   1HB   ASN 111          1HB       ASN 111  22.630 -14.623 -14.356
  648   2HB   ASN 111          2HB       ASN 111  22.293 -12.964 -13.856
  649   1HD2  ASN 111          1HD2      ASN 111  24.392 -12.156 -14.043
  650   2HD2  ASN 111          2HD2      ASN 111  25.713 -12.751 -13.048
  651    H    CYS 112           H        CYS 112  19.282 -13.912 -11.413
  652    HA   CYS 112           HA       CYS 112  20.067 -11.292 -10.328
  653   1HB   CYS 112          1HB       CYS 112  17.924 -11.605 -11.465
  654   2HB   CYS 112          2HB       CYS 112  17.380 -12.748 -10.211
  655    H    GLY 113           H        GLY 113  18.037 -13.845  -8.766
  656   1HA   GLY 113          1HA       GLY 113  18.162 -14.871  -6.695
  657   2HA   GLY 113          2HA       GLY 113  19.889 -14.468  -6.686
  658    H    LYS 114           H        LYS 114  17.821 -11.675  -6.977
  659    HA   LYS 114           HA       LYS 114  18.626 -10.646  -4.381
  660   1HB   LYS 114          1HB       LYS 114  17.993  -9.423  -6.589
  661   2HB   LYS 114          2HB       LYS 114  16.326  -9.540  -6.018
  662   1HG   LYS 114          1HG       LYS 114  16.854  -8.173  -4.074
  663   2HG   LYS 114          2HG       LYS 114  18.604  -8.349  -4.351
  664   1HD   LYS 114          1HD       LYS 114  18.448  -7.099  -6.459
  665   2HD   LYS 114          2HD       LYS 114  16.700  -7.015  -6.276
  666   1HE   LYS 114          1HE       LYS 114  17.577  -4.904  -5.769
  667   2HE   LYS 114          2HE       LYS 114  16.910  -5.610  -4.287
  668   1HZ   LYS 114          1HZ       LYS 114  19.806  -5.543  -4.992
  669   2HZ   LYS 114          2HZ       LYS 114  19.089  -4.572  -3.897
  670   3HZ   LYS 114          3HZ       LYS 114  19.193  -6.174  -3.612
  671    H    ALA 115           H        ALA 115  17.422 -10.340  -2.481
  672    HA   ALA 115           HA       ALA 115  14.925 -11.996  -2.291
  673   1HB   ALA 115          1HB       ALA 115  16.859 -13.088  -1.265
  674   2HB   ALA 115          2HB       ALA 115  17.145 -11.661  -0.226
  675   3HB   ALA 115          3HB       ALA 115  15.658 -12.632  -0.048
  676    H    PHE 116           H        PHE 116  13.181 -11.183  -1.275
  677    HA   PHE 116           HA       PHE 116  13.426  -8.460  -0.050
  678   1HB   PHE 116          1HB       PHE 116  11.037  -9.478  -1.637
  679   2HB   PHE 116          2HB       PHE 116  11.392  -7.863  -1.064
  680    HD1  PHE 116           HD1      PHE 116  12.391 -10.457  -3.523
  681    HD2  PHE 116           HD2      PHE 116  12.752  -6.328  -2.334
  682    HE1  PHE 116           HE1      PHE 116  13.808 -10.038  -5.489
  683    HE2  PHE 116           HE2      PHE 116  14.181  -5.902  -4.345
  684    HZ   PHE 116           HZ       PHE 116  14.720  -7.807  -5.882
  685    H    LYS 117           H        LYS 117  11.760  -7.881   1.462
  686    HA   LYS 117           HA       LYS 117  11.247  -9.849   3.427
  687   1HB   LYS 117          1HB       LYS 117  11.303  -7.368   3.734
  688   2HB   LYS 117          2HB       LYS 117   9.708  -7.235   2.982
  689   1HG   LYS 117          1HG       LYS 117   8.652  -8.447   4.777
  690   2HG   LYS 117          2HG       LYS 117  10.232  -9.060   5.309
  691   1HD   LYS 117          1HD       LYS 117  10.765  -6.524   5.734
  692   2HD   LYS 117          2HD       LYS 117   9.016  -6.291   5.615
  693   1HE   LYS 117          1HE       LYS 117  10.021  -6.562   7.933
  694   2HE   LYS 117          2HE       LYS 117   8.603  -7.551   7.556
  695   1HZ   LYS 117          1HZ       LYS 117  10.001  -9.439   7.272
  696   2HZ   LYS 117          2HZ       LYS 117  11.385  -8.550   7.511
  697   3HZ   LYS 117          3HZ       LYS 117  10.294  -8.772   8.734
  698    H    LYS 118           H        LYS 118   9.075  -8.500   0.894
  699    HA   LYS 118           HA       LYS 118   7.159 -10.752   1.425
  700   1HB   LYS 118          1HB       LYS 118   6.339  -7.811   1.077
  701   2HB   LYS 118          2HB       LYS 118   5.285  -9.180   1.444
  702   1HG   LYS 118          1HG       LYS 118   6.991  -9.499   3.451
  703   2HG   LYS 118          2HG       LYS 118   7.300  -7.785   3.188
  704   1HD   LYS 118          1HD       LYS 118   5.379  -7.195   4.292
  705   2HD   LYS 118          2HD       LYS 118   4.455  -8.504   3.555
  706   1HE   LYS 118          1HE       LYS 118   4.613  -9.281   5.851
  707   2HE   LYS 118          2HE       LYS 118   5.887 -10.103   4.970
  708   1HZ   LYS 118          1HZ       LYS 118   6.116  -8.148   7.038
  709   2HZ   LYS 118          2HZ       LYS 118   7.113  -9.406   6.656
  710   3HZ   LYS 118          3HZ       LYS 118   7.212  -8.001   5.814
  711    H    HIS 119           H        HIS 119   5.628 -11.162  -0.319
  712    HA   HIS 119           HA       HIS 119   6.968 -11.327  -2.813
  713   1HB   HIS 119          1HB       HIS 119   4.890 -12.169  -3.728
  714   2HB   HIS 119          2HB       HIS 119   5.277 -12.899  -2.204
  715    HD1  HIS 119           HD1      HIS 119   2.800  -9.979  -3.164
  716    HD2  HIS 119           HD2      HIS 119   3.310 -13.564  -0.975
  717    HE1  HIS 119           HE1      HIS 119   0.532 -10.485  -2.019
  718    HE2  HIS 119           HE2      HIS 119   0.847 -12.669  -0.769
  719    H    ASN 120           H        ASN 120   4.829  -8.801  -1.541
  720    HA   ASN 120           HA       ASN 120   4.184  -7.556  -4.048
  721   1HB   ASN 120          1HB       ASN 120   4.619  -5.803  -1.655
  722   2HB   ASN 120          2HB       ASN 120   3.282  -5.853  -2.777
  723   1HD2  ASN 120          1HD2      ASN 120   1.371  -6.978  -2.085
  724   2HD2  ASN 120          2HD2      ASN 120   1.370  -7.843  -0.553
  725    H    GLN 121           H        GLN 121   7.038  -7.341  -1.904
  726    HA   GLN 121           HA       GLN 121   8.256  -5.111  -3.371
  727   1HB   GLN 121          1HB       GLN 121   9.503  -7.110  -1.481
  728   2HB   GLN 121          2HB       GLN 121  10.198  -5.564  -2.061
  729   1HG   GLN 121          1HG       GLN 121   8.381  -4.380  -0.867
  730   2HG   GLN 121          2HG       GLN 121   7.891  -5.935  -0.140
  731   1HE2  GLN 121          1HE2      GLN 121   9.144  -3.343   1.052
  732   2HE2  GLN 121          2HE2      GLN 121  10.510  -3.968   1.953
  733    H    LEU 122           H        LEU 122   8.556  -8.709  -3.286
  734    HA   LEU 122           HA       LEU 122  10.589  -8.967  -5.240
  735   1HB   LEU 122          1HB       LEU 122   9.883 -10.850  -3.919
  736   2HB   LEU 122          2HB       LEU 122   8.221 -10.704  -4.459
  737    HG   LEU 122           HG       LEU 122   8.763 -11.497  -6.680
  738   1HD1  LEU 122          1HD1      LEU 122  11.087 -10.582  -6.815
  739   2HD1  LEU 122          2HD1      LEU 122  11.571 -11.771  -5.582
  740   3HD1  LEU 122          3HD1      LEU 122  10.963 -12.295  -7.187
  741   1HD2  LEU 122          1HD2      LEU 122   9.445 -13.798  -6.114
  742   2HD2  LEU 122          2HD2      LEU 122   9.996 -13.288  -4.514
  743   3HD2  LEU 122          3HD2      LEU 122   8.269 -13.195  -4.928
  744    H    LYS 123           H        LYS 123   7.004  -8.974  -5.660
  745    HA   LYS 123           HA       LYS 123   6.921  -9.009  -8.467
  746   1HB   LYS 123          1HB       LYS 123   5.002  -9.301  -6.955
  747   2HB   LYS 123          2HB       LYS 123   5.035  -7.594  -6.520
  748   1HG   LYS 123          1HG       LYS 123   4.189  -6.919  -8.608
  749   2HG   LYS 123          2HG       LYS 123   4.677  -8.423  -9.410
  750   1HD   LYS 123          1HD       LYS 123   2.225  -8.305  -9.090
  751   2HD   LYS 123          2HD       LYS 123   2.959  -9.693  -8.282
  752   1HE   LYS 123          1HE       LYS 123   2.902  -8.418  -6.114
  753   2HE   LYS 123          2HE       LYS 123   2.077  -7.096  -6.945
  754   1HZ   LYS 123          1HZ       LYS 123   1.015  -9.882  -6.636
  755   2HZ   LYS 123          2HZ       LYS 123   0.488  -8.561  -5.843
  756   3HZ   LYS 123          3HZ       LYS 123   0.267  -8.680  -7.457
  757    H    VAL 124           H        VAL 124   7.328  -6.233  -6.236
  758    HA   VAL 124           HA       VAL 124   7.244  -4.144  -8.193
  759    HB   VAL 124           HB       VAL 124   8.508  -4.444  -5.472
  760   1HG1  VAL 124          1HG1      VAL 124   9.006  -2.020  -5.435
  761   2HG1  VAL 124          2HG1      VAL 124  10.093  -2.920  -6.489
  762   3HG1  VAL 124          3HG1      VAL 124   8.769  -1.965  -7.196
  763   1HG2  VAL 124          1HG2      VAL 124   6.769  -3.204  -4.755
  764   2HG2  VAL 124          2HG2      VAL 124   6.594  -2.380  -6.345
  765   3HG2  VAL 124          3HG2      VAL 124   5.990  -4.025  -6.091
  766    H    HIS 125           H        HIS 125   9.941  -6.191  -6.980
  767    HA   HIS 125           HA       HIS 125  11.981  -4.791  -8.392
  768   1HB   HIS 125          1HB       HIS 125  12.483  -6.159  -6.490
  769   2HB   HIS 125          2HB       HIS 125  11.816  -7.605  -7.249
  770    HD1  HIS 125           HD1      HIS 125  14.854  -5.255  -7.643
  771    HD2  HIS 125           HD2      HIS 125  13.321  -9.010  -8.788
  772    HE1  HIS 125           HE1      HIS 125  16.783  -6.506  -8.734
  773    H    GLN 126           H        GLN 126  10.136  -7.799  -9.182
  774    HA   GLN 126           HA       GLN 126  11.557  -8.366 -11.592
  775   1HB   GLN 126          1HB       GLN 126   8.767  -9.167 -10.643
  776   2HB   GLN 126          2HB       GLN 126   9.516  -9.740 -12.166
  777   1HG   GLN 126          1HG       GLN 126  11.571 -10.374 -10.807
  778   2HG   GLN 126          2HG       GLN 126  10.677 -10.051  -9.331
  779   1HE2  GLN 126          1HE2      GLN 126  11.966 -12.422  -9.921
  780   2HE2  GLN 126          2HE2      GLN 126  10.734 -13.701 -10.103
  781    H    PHE 127           H        PHE 127   8.784  -6.242 -10.942
  782    HA   PHE 127           HA       PHE 127   7.941  -5.732 -13.595
  783   1HB   PHE 127          1HB       PHE 127   6.589  -4.435 -12.550
  784   2HB   PHE 127          2HB       PHE 127   7.393  -4.747 -11.067
  785    HD1  PHE 127           HD1      PHE 127   8.054  -2.244 -13.950
  786    HD2  PHE 127           HD2      PHE 127   7.395  -2.956  -9.770
  787    HE1  PHE 127           HE1      PHE 127   8.482   0.115 -13.482
  788    HE2  PHE 127           HE2      PHE 127   7.930  -0.699  -9.207
  789    HZ   PHE 127           HZ       PHE 127   8.568   0.934 -11.098
  790    H    SER 128           H        SER 128  10.877  -4.723 -11.894
  791    HA   SER 128           HA       SER 128  11.643  -2.629 -13.766
  792   1HB   SER 128          1HB       SER 128  12.499  -2.945 -11.401
  793   2HB   SER 128          2HB       SER 128  13.488  -4.298 -12.007
  794    HG   SER 128           HG       SER 128  14.618  -2.278 -12.005
  795    H    HIS 129           H        HIS 129  12.506  -6.143 -13.419
  796    HA   HIS 129           HA       HIS 129  14.286  -6.242 -15.683
  797   1HB   HIS 129          1HB       HIS 129  12.563  -8.411 -14.407
  798   2HB   HIS 129          2HB       HIS 129  13.758  -8.664 -15.654
  799    HD1  HIS 129           HD1      HIS 129  16.418  -8.215 -14.881
  800    HD2  HIS 129           HD2      HIS 129  13.396  -9.097 -12.129
  801    HE1  HIS 129           HE1      HIS 129  17.555  -9.253 -12.826
  802    H    THR 130           H        THR 130  10.756  -6.668 -15.341
  803    HA   THR 130           HA       THR 130  10.389  -7.460 -18.147
  804    HB   THR 130           HB       THR 130   7.971  -7.303 -17.598
  805    HG1  THR 130           HG1      THR 130   8.937  -6.227 -15.214
  806   1HG2  THR 130          1HG2      THR 130   7.791  -9.080 -16.032
  807   2HG2  THR 130          2HG2      THR 130   9.381  -9.365 -16.790
  808   3HG2  THR 130          3HG2      THR 130   9.264  -8.647 -15.170
  809    H    GLN 131           H        GLN 131  10.566  -4.483 -16.374
  810    HA   GLN 131           HA       GLN 131  10.234  -2.287 -16.889
  811   1HB   GLN 131          1HB       GLN 131  11.602  -3.217 -19.023
  812   2HB   GLN 131          2HB       GLN 131  10.108  -2.793 -19.858
  813   1HG   GLN 131          1HG       GLN 131  11.057  -0.707 -19.922
  814   2HG   GLN 131          2HG       GLN 131  10.425  -0.547 -18.282
  815   1HE2  GLN 131          1HE2      GLN 131  12.337  -2.005 -16.686
  816   2HE2  GLN 131          2HE2      GLN 131  13.878  -1.228 -16.945
  817    H    GLN 132           H        GLN 132   7.877  -4.053 -16.499
  818    HA   GLN 132           HA       GLN 132   5.906  -2.083 -17.609
  819   1HB   GLN 132          1HB       GLN 132   4.208  -3.806 -17.846
  820   2HB   GLN 132          2HB       GLN 132   5.576  -4.066 -18.914
  821   1HG   GLN 132          1HG       GLN 132   4.843  -6.197 -18.195
  822   2HG   GLN 132          2HG       GLN 132   6.377  -5.867 -17.416
  823   1HE2  GLN 132          1HE2      GLN 132   6.448  -6.194 -15.240
  824   2HE2  GLN 132          2HE2      GLN 132   5.038  -6.277 -14.172
  825    H    LEU 133           H        LEU 133   3.983  -1.822 -16.229
  826    HA   LEU 133           HA       LEU 133   4.894  -1.877 -13.431
  827   1HB   LEU 133          1HB       LEU 133   2.803  -0.301 -14.942
  828   2HB   LEU 133          2HB       LEU 133   2.847  -0.240 -13.172
  829    HG   LEU 133           HG       LEU 133   5.381   0.269 -14.865
  830   1HD1  LEU 133          1HD1      LEU 133   3.648   1.918 -15.511
  831   2HD1  LEU 133          2HD1      LEU 133   3.400   2.326 -13.797
  832   3HD1  LEU 133          3HD1      LEU 133   4.960   2.662 -14.582
  833   1HD2  LEU 133          1HD2      LEU 133   5.699  -0.276 -12.463
  834   2HD2  LEU 133          2HD2      LEU 133   6.213   1.352 -12.912
  835   3HD2  LEU 133          3HD2      LEU 133   4.679   1.125 -12.064
  836    HA   PRO 134           HA       PRO 134   2.246  -5.251 -12.542
  837   1HB   PRO 134          1HB       PRO 134   2.543  -5.108  -9.732
  838   2HB   PRO 134          2HB       PRO 134   3.615  -5.969 -10.878
  839   1HG   PRO 134          1HG       PRO 134   4.120  -3.514  -9.346
  840   2HG   PRO 134          2HG       PRO 134   5.254  -4.521 -10.259
  841   1HD   PRO 134          1HD       PRO 134   4.127  -1.979 -11.000
  842   2HD   PRO 134          2HD       PRO 134   5.206  -3.029 -11.914
  843    H    TYR 135           H        TYR 135   1.727  -2.252 -10.663
  844    HA   TYR 135           HA       TYR 135  -0.922  -3.240  -9.771
  845   1HB   TYR 135          1HB       TYR 135   0.649  -0.768  -8.891
  846   2HB   TYR 135          2HB       TYR 135  -0.785  -1.411  -8.133
  847    HD1  TYR 135           HD1      TYR 135   2.844  -1.686  -8.372
  848    HD2  TYR 135           HD2      TYR 135  -0.763  -3.611  -6.995
  849    HE1  TYR 135           HE1      TYR 135   4.227  -3.182  -6.920
  850    HE2  TYR 135           HE2      TYR 135   0.641  -5.222  -5.652
  851    HH   TYR 135           HH       TYR 135   4.199  -5.112  -5.609
  852    H    GLU 136           H        GLU 136  -2.325  -2.916 -11.489
  853    HA   GLU 136           HA       GLU 136  -2.357  -0.202 -12.734
  854   1HB   GLU 136          1HB       GLU 136  -3.608  -1.195 -14.535
  855   2HB   GLU 136          2HB       GLU 136  -2.109  -2.084 -14.267
  856   1HG   GLU 136          1HG       GLU 136  -3.437  -3.863 -13.088
  857   2HG   GLU 136          2HG       GLU 136  -4.916  -2.997 -13.541
  858    H    CYS 137           H        CYS 137  -4.177   1.061 -12.729
  859    HA   CYS 137           HA       CYS 137  -6.162   0.579 -10.649
  860   1HB   CYS 137          1HB       CYS 137  -5.396   2.827 -11.067
  861   2HB   CYS 137          2HB       CYS 137  -5.836   2.736 -12.758
  862    HA   PRO 138           HA       PRO 138  -8.698  -1.663 -13.567
  863   1HB   PRO 138          1HB       PRO 138 -10.283  -3.000 -11.826
  864   2HB   PRO 138          2HB       PRO 138  -8.510  -3.240 -11.811
  865   1HG   PRO 138          1HG       PRO 138 -10.146  -1.384 -10.034
  866   2HG   PRO 138          2HG       PRO 138  -8.931  -2.598  -9.528
  867   1HD   PRO 138          1HD       PRO 138  -8.347   0.086  -9.899
  868   2HD   PRO 138          2HD       PRO 138  -7.160  -1.231 -10.150
  869    H    HIS 139           H        HIS 139  -9.610   1.183 -12.117
  870    HA   HIS 139           HA       HIS 139 -12.492   1.008 -12.066
  871   1HB   HIS 139          1HB       HIS 139 -10.864   2.733 -10.957
  872   2HB   HIS 139          2HB       HIS 139 -10.952   3.585 -12.502
  873    HD2  HIS 139           HD2      HIS 139 -13.038   2.576  -9.424
  874    HE1  HIS 139           HE1      HIS 139 -15.443   5.348 -11.601
  875    HE2  HIS 139           HE2      HIS 139 -15.250   4.012  -9.440
  876    H    GLU 140           H        GLU 140 -14.031   1.974 -13.505
  877    HA   GLU 140           HA       GLU 140 -13.528   1.407 -16.284
  878   1HB   GLU 140          1HB       GLU 140 -15.791   2.401 -16.628
  879   2HB   GLU 140          2HB       GLU 140 -15.735   1.127 -15.421
  880   1HG   GLU 140          1HG       GLU 140 -15.823   2.831 -13.603
  881   2HG   GLU 140          2HG       GLU 140 -15.942   4.108 -14.820
  882    H    GLY 141           H        GLY 141 -12.811   2.665 -17.922
  883   1HA   GLY 141          1HA       GLY 141 -12.373   4.612 -19.148
  884   2HA   GLY 141          2HA       GLY 141 -13.083   5.584 -17.847
  885    H    CYS 142           H        CYS 142 -10.847   3.534 -16.403
  886    HA   CYS 142           HA       CYS 142  -8.672   5.582 -16.582
  887   1HB   CYS 142          1HB       CYS 142  -9.964   5.156 -14.367
  888   2HB   CYS 142          2HB       CYS 142  -9.111   3.622 -14.306
  889    H    ASP 143           H        ASP 143  -6.494   4.845 -16.649
  890    HA   ASP 143           HA       ASP 143  -5.998   1.942 -17.024
  891   1HB   ASP 143          1HB       ASP 143  -6.625   3.047 -19.272
  892   2HB   ASP 143          2HB       ASP 143  -5.118   3.951 -19.142
  893    H    LYS 144           H        LYS 144  -5.214   4.438 -15.241
  894    HA   LYS 144           HA       LYS 144  -2.367   4.838 -15.562
  895   1HB   LYS 144          1HB       LYS 144  -4.366   5.251 -13.310
  896   2HB   LYS 144          2HB       LYS 144  -2.648   5.281 -12.982
  897   1HG   LYS 144          1HG       LYS 144  -3.228   7.484 -13.166
  898   2HG   LYS 144          2HG       LYS 144  -2.320   7.108 -14.631
  899   1HD   LYS 144          1HD       LYS 144  -4.403   7.112 -15.945
  900   2HD   LYS 144          2HD       LYS 144  -5.357   7.290 -14.450
  901   1HE   LYS 144          1HE       LYS 144  -4.153   9.427 -13.961
  902   2HE   LYS 144          2HE       LYS 144  -3.327   9.299 -15.519
  903   1HZ   LYS 144          1HZ       LYS 144  -6.269   9.508 -15.167
  904   2HZ   LYS 144          2HZ       LYS 144  -5.299  10.749 -15.603
  905   3HZ   LYS 144          3HZ       LYS 144  -5.491   9.467 -16.606
  906    H    ARG 145           H        ARG 145  -0.609   3.838 -14.543
  907    HA   ARG 145           HA       ARG 145  -1.160   1.418 -12.869
  908   1HB   ARG 145          1HB       ARG 145   0.996   1.444 -15.036
  909   2HB   ARG 145          2HB       ARG 145   0.442   0.107 -13.978
  910   1HG   ARG 145          1HG       ARG 145  -1.822   0.308 -15.054
  911   2HG   ARG 145          2HG       ARG 145  -1.102   1.380 -16.253
  912   1HD   ARG 145          1HD       ARG 145   0.285  -0.384 -17.130
  913   2HD   ARG 145          2HD       ARG 145  -0.038  -1.418 -15.733
  914    HE   ARG 145           HE       ARG 145  -2.054  -2.100 -16.648
  915   1HH1  ARG 145          1HH1      ARG 145  -1.159   0.757 -18.497
  916   2HH1  ARG 145          2HH1      ARG 145  -2.723   0.803 -19.278
  917   1HH2  ARG 145          1HH2      ARG 145  -3.860  -2.013 -17.638
  918   2HH2  ARG 145          2HH2      ARG 145  -4.252  -0.688 -18.758
  919    H    PHE 146           H        PHE 146   0.481   0.873 -11.416
  920    HA   PHE 146           HA       PHE 146   2.352   3.122 -10.811
  921   1HB   PHE 146          1HB       PHE 146   0.616   1.629  -8.781
  922   2HB   PHE 146          2HB       PHE 146   1.637   3.000  -8.485
  923    HD1  PHE 146           HD1      PHE 146   1.114   5.264  -9.259
  924    HD2  PHE 146           HD2      PHE 146  -1.586   1.968  -9.992
  925    HE1  PHE 146           HE1      PHE 146  -0.645   6.848 -10.021
  926    HE2  PHE 146           HE2      PHE 146  -3.342   3.535 -10.635
  927    HZ   PHE 146           HZ       PHE 146  -2.834   5.986 -10.777
  928    H    SER 147           H        SER 147   4.044   2.615  -9.318
  929    HA   SER 147           HA       SER 147   5.225   0.045 -10.017
  930   1HB   SER 147          1HB       SER 147   7.110   1.106  -8.478
  931   2HB   SER 147          2HB       SER 147   6.764   1.794 -10.077
  932    HG   SER 147           HG       SER 147   6.215   3.576  -9.176
  933    H    LEU 148           H        LEU 148   3.599   1.441  -7.212
  934    HA   LEU 148           HA       LEU 148   4.202  -1.062  -5.681
  935   1HB   LEU 148          1HB       LEU 148   4.476   1.818  -4.822
  936   2HB   LEU 148          2HB       LEU 148   3.893   0.686  -3.647
  937    HG   LEU 148           HG       LEU 148   6.242   1.114  -3.358
  938   1HD1  LEU 148          1HD1      LEU 148   5.510  -1.700  -4.197
  939   2HD1  LEU 148          2HD1      LEU 148   7.059  -1.313  -3.395
  940   3HD1  LEU 148          3HD1      LEU 148   5.533  -1.014  -2.559
  941   1HD2  LEU 148          1HD2      LEU 148   6.824   1.458  -5.787
  942   2HD2  LEU 148          2HD2      LEU 148   7.962   0.458  -4.854
  943   3HD2  LEU 148          3HD2      LEU 148   6.818  -0.303  -5.960
  944    HA   PRO 149           HA       PRO 149  -0.173  -1.321  -5.069
  945   1HB   PRO 149          1HB       PRO 149  -0.317  -2.413  -2.504
  946   2HB   PRO 149          2HB       PRO 149   0.066  -3.315  -3.983
  947   1HG   PRO 149          1HG       PRO 149   1.942  -2.323  -1.861
  948   2HG   PRO 149          2HG       PRO 149   2.001  -3.835  -2.838
  949   1HD   PRO 149          1HD       PRO 149   3.552  -1.616  -3.374
  950   2HD   PRO 149          2HD       PRO 149   3.065  -2.778  -4.564
  951    H    SER 150           H        SER 150   1.746   0.172  -2.446
  952    HA   SER 150           HA       SER 150  -0.379   1.577  -1.137
  953   1HB   SER 150          1HB       SER 150   1.486   3.105  -0.374
  954   2HB   SER 150          2HB       SER 150   1.765   1.382  -0.060
  955    HG   SER 150           HG       SER 150   3.565   2.603  -1.021
  956    H    ARG 151           H        ARG 151   1.575   2.313  -4.027
  957    HA   ARG 151           HA       ARG 151   0.676   5.075  -4.267
  958   1HB   ARG 151          1HB       ARG 151   2.035   3.172  -6.237
  959   2HB   ARG 151          2HB       ARG 151   1.703   4.884  -6.577
  960   1HG   ARG 151          1HG       ARG 151   3.037   5.577  -4.643
  961   2HG   ARG 151          2HG       ARG 151   3.271   3.901  -4.155
  962   1HD   ARG 151          1HD       ARG 151   4.503   3.534  -6.355
  963   2HD   ARG 151          2HD       ARG 151   4.500   5.304  -6.535
  964    HE   ARG 151           HE       ARG 151   5.326   4.773  -3.896
  965   1HH1  ARG 151          1HH1      ARG 151   6.788   3.866  -6.980
  966   2HH1  ARG 151          2HH1      ARG 151   8.381   3.923  -6.269
  967   1HH2  ARG 151          1HH2      ARG 151   7.139   4.614  -3.110
  968   2HH2  ARG 151          2HH2      ARG 151   8.602   4.266  -4.045
  969    H    LEU 152           H        LEU 152  -0.365   1.926  -5.616
  970    HA   LEU 152           HA       LEU 152  -2.427   3.003  -7.357
  971   1HB   LEU 152          1HB       LEU 152  -1.557   0.759  -7.661
  972   2HB   LEU 152          2HB       LEU 152  -2.001   0.308  -6.011
  973    HG   LEU 152           HG       LEU 152  -4.361   0.366  -6.540
  974   1HD1  LEU 152          1HD1      LEU 152  -5.187   0.748  -8.799
  975   2HD1  LEU 152          2HD1      LEU 152  -4.391   2.214  -8.245
  976   3HD1  LEU 152          3HD1      LEU 152  -3.550   1.135  -9.375
  977   1HD2  LEU 152          1HD2      LEU 152  -4.447  -1.547  -8.001
  978   2HD2  LEU 152          2HD2      LEU 152  -2.907  -1.116  -8.761
  979   3HD2  LEU 152          3HD2      LEU 152  -2.927  -1.682  -7.082
  980    H    LYS 153           H        LYS 153  -2.406   1.671  -3.981
  981    HA   LYS 153           HA       LYS 153  -5.166   1.995  -3.395
  982   1HB   LYS 153          1HB       LYS 153  -2.674   2.105  -1.656
  983   2HB   LYS 153          2HB       LYS 153  -4.288   2.278  -0.972
  984   1HG   LYS 153          1HG       LYS 153  -4.958   0.081  -1.676
  985   2HG   LYS 153          2HG       LYS 153  -3.494  -0.148  -2.635
  986   1HD   LYS 153          1HD       LYS 153  -2.117   0.002  -0.553
  987   2HD   LYS 153          2HD       LYS 153  -3.604   0.193   0.397
  988   1HE   LYS 153          1HE       LYS 153  -4.376  -2.040  -0.405
  989   2HE   LYS 153          2HE       LYS 153  -2.880  -2.222  -1.330
  990   1HZ   LYS 153          1HZ       LYS 153  -3.035  -1.961   1.633
  991   2HZ   LYS 153          2HZ       LYS 153  -2.718  -3.340   0.833
  992   3HZ   LYS 153          3HZ       LYS 153  -1.648  -2.126   0.794
  993    H    ARG 154           H        ARG 154  -2.464   4.352  -3.146
  994    HA   ARG 154           HA       ARG 154  -4.067   6.487  -2.029
  995   1HB   ARG 154          1HB       ARG 154  -1.627   6.432  -1.844
  996   2HB   ARG 154          2HB       ARG 154  -1.439   6.547  -3.596
  997   1HG   ARG 154          1HG       ARG 154  -2.247   8.772  -3.642
  998   2HG   ARG 154          2HG       ARG 154  -2.893   8.682  -1.999
  999   1HD   ARG 154          1HD       ARG 154  -0.846  10.073  -2.093
 1000   2HD   ARG 154          2HD       ARG 154  -0.718   8.726  -1.009
 1001    HE   ARG 154           HE       ARG 154   0.775   7.599  -2.464
 1002   1HH1  ARG 154          1HH1      ARG 154  -0.062  10.631  -3.998
 1003   2HH1  ARG 154          2HH1      ARG 154   1.629  11.099  -4.084
 1004   1HH2  ARG 154          1HH2      ARG 154   2.861   8.026  -3.235
 1005   2HH2  ARG 154          2HH2      ARG 154   3.118   9.478  -4.164
 1006    H    HIS 155           H        HIS 155  -3.153   5.574  -5.380
 1007    HA   HIS 155           HA       HIS 155  -4.393   7.762  -6.737
 1008   1HB   HIS 155          1HB       HIS 155  -2.930   6.259  -7.923
 1009   2HB   HIS 155          2HB       HIS 155  -3.953   4.862  -7.581
 1010    HD1  HIS 155           HD1      HIS 155  -4.099   8.124  -9.629
 1011    HD2  HIS 155           HD2      HIS 155  -6.030   4.409  -9.154
 1012    HE1  HIS 155           HE1      HIS 155  -5.970   8.105 -11.329
 1013    H    GLU 156           H        GLU 156  -5.734   4.715  -5.432
 1014    HA   GLU 156           HA       GLU 156  -8.251   4.765  -6.634
 1015   1HB   GLU 156          1HB       GLU 156  -7.101   3.076  -4.930
 1016   2HB   GLU 156          2HB       GLU 156  -8.016   3.989  -3.714
 1017   1HG   GLU 156          1HG       GLU 156 -10.103   3.554  -5.036
 1018   2HG   GLU 156          2HG       GLU 156  -9.143   2.643  -6.207
 1019    H    LYS 157           H        LYS 157  -7.026   6.796  -3.971
 1020    HA   LYS 157           HA       LYS 157  -9.528   7.732  -2.913
 1021   1HB   LYS 157          1HB       LYS 157  -6.854   9.163  -3.155
 1022   2HB   LYS 157          2HB       LYS 157  -8.198   9.693  -2.159
 1023   1HG   LYS 157          1HG       LYS 157  -7.973   7.897  -0.633
 1024   2HG   LYS 157          2HG       LYS 157  -6.924   6.979  -1.716
 1025   1HD   LYS 157          1HD       LYS 157  -5.670   7.947   0.127
 1026   2HD   LYS 157          2HD       LYS 157  -5.096   8.534  -1.422
 1027   1HE   LYS 157          1HE       LYS 157  -7.042  10.176   0.235
 1028   2HE   LYS 157          2HE       LYS 157  -5.322  10.136   0.623
 1029   1HZ   LYS 157          1HZ       LYS 157  -4.905  10.840  -1.755
 1030   2HZ   LYS 157          2HZ       LYS 157  -6.474  11.138  -1.925
 1031   3HZ   LYS 157          3HZ       LYS 157  -5.595  11.966  -0.807
 1032    H    VAL 158           H        VAL 158  -7.766   8.510  -5.894
 1033    HA   VAL 158           HA       VAL 158  -9.046  11.003  -6.525
 1034    HB   VAL 158           HB       VAL 158  -8.086   8.847  -8.489
 1035   1HG1  VAL 158          1HG1      VAL 158  -8.299  11.865  -8.719
 1036   2HG1  VAL 158          2HG1      VAL 158  -7.703  10.775  -9.980
 1037   3HG1  VAL 158          3HG1      VAL 158  -9.418  10.723  -9.521
 1038   1HG2  VAL 158          1HG2      VAL 158  -6.216   9.598  -6.953
 1039   2HG2  VAL 158          2HG2      VAL 158  -6.011  10.269  -8.590
 1040   3HG2  VAL 158          3HG2      VAL 158  -6.723  11.266  -7.285
 1041    H    HIS 159           H        HIS 159  -9.991   7.590  -7.160
 1042    HA   HIS 159           HA       HIS 159 -12.413   8.360  -8.604
 1043   1HB   HIS 159          1HB       HIS 159 -11.370   5.709  -7.511
 1044   2HB   HIS 159          2HB       HIS 159 -12.904   5.877  -8.390
 1045    HD1  HIS 159           HD1      HIS 159 -12.383   7.453 -10.874
 1046    HD2  HIS 159           HD2      HIS 159  -9.380   5.108  -9.079
 1047    HE1  HIS 159           HE1      HIS 159 -10.538   7.179 -12.613
 1048    H    ALA 160           H        ALA 160 -11.533   7.563  -5.254
 1049    HA   ALA 160           HA       ALA 160 -14.247   7.261  -4.285
 1050   1HB   ALA 160          1HB       ALA 160 -11.741   8.085  -2.750
 1051   2HB   ALA 160          2HB       ALA 160 -13.233   7.415  -2.072
 1052   3HB   ALA 160          3HB       ALA 160 -12.202   6.400  -3.101
 1053    H    GLY 161           H        GLY 161 -12.113  10.013  -4.941
 1054   1HA   GLY 161          1HA       GLY 161 -12.792  12.237  -5.237
 1055   2HA   GLY 161          2HA       GLY 161 -14.361  11.849  -4.564
 1056    H    TYR 162           H        TYR 162 -13.390  14.178  -3.810
 1057    HA   TYR 162           HA       TYR 162 -12.291  13.718  -1.061
 1058   1HB   TYR 162          1HB       TYR 162 -11.769  15.977  -3.019
 1059   2HB   TYR 162          2HB       TYR 162 -11.212  15.963  -1.325
 1060    HD1  TYR 162           HD1      TYR 162  -9.368  14.544  -0.653
 1061    HD2  TYR 162           HD2      TYR 162 -10.937  14.338  -4.674
 1062    HE1  TYR 162           HE1      TYR 162  -7.460  13.125  -1.335
 1063    HE2  TYR 162           HE2      TYR 162  -9.215  12.694  -5.271
 1064    HH   TYR 162           HH       TYR 162  -6.952  12.055  -4.669
 1065    HA   PRO 163           HA       PRO 163 -16.340  15.672  -0.646
 1066   1HB   PRO 163          1HB       PRO 163 -17.154  14.450   1.666
 1067   2HB   PRO 163          2HB       PRO 163 -17.094  13.583   0.104
 1068   1HG   PRO 163          1HG       PRO 163 -15.028  13.544   2.319
 1069   2HG   PRO 163          2HG       PRO 163 -15.733  12.157   1.430
 1070   1HD   PRO 163          1HD       PRO 163 -13.327  13.297   0.760
 1071   2HD   PRO 163          2HD       PRO 163 -14.424  12.579  -0.463
 1072    H    CYS 164           H        CYS 164 -16.998  17.487   0.424
 1073    HA   CYS 164           HA       CYS 164 -15.076  18.874   2.080
 1074   1HB   CYS 164          1HB       CYS 164 -16.884  19.799   0.415
 1075   2HB   CYS 164          2HB       CYS 164 -17.981  19.688   1.810
 1076    H    LYS 165           H        LYS 165 -15.029  19.256   4.222
 1077    HA   LYS 165           HA       LYS 165 -17.283  18.356   5.933
 1078   1HB   LYS 165          1HB       LYS 165 -14.369  17.556   6.412
 1079   2HB   LYS 165          2HB       LYS 165 -15.701  17.296   7.545
 1080   1HG   LYS 165          1HG       LYS 165 -16.833  15.830   5.884
 1081   2HG   LYS 165          2HG       LYS 165 -15.443  16.017   4.794
 1082   1HD   LYS 165          1HD       LYS 165 -13.952  15.042   6.521
 1083   2HD   LYS 165          2HD       LYS 165 -15.350  14.827   7.597
 1084   1HE   LYS 165          1HE       LYS 165 -16.431  13.378   5.888
 1085   2HE   LYS 165          2HE       LYS 165 -15.032  13.586   4.826
 1086   1HZ   LYS 165          1HZ       LYS 165 -14.955  12.314   7.514
 1087   2HZ   LYS 165          2HZ       LYS 165 -14.887  11.516   6.094
 1088   3HZ   LYS 165          3HZ       LYS 165 -13.663  12.504   6.531
 1089    H    LYS 166           H        LYS 166 -15.610  20.856   4.878
 1090    HA   LYS 166           HA       LYS 166 -14.552  22.108   7.283
 1091   1HB   LYS 166          1HB       LYS 166 -15.505  23.234   4.641
 1092   2HB   LYS 166          2HB       LYS 166 -14.694  24.204   5.869
 1093   1HG   LYS 166          1HG       LYS 166 -13.422  21.762   4.551
 1094   2HG   LYS 166          2HG       LYS 166 -13.266  23.412   3.942
 1095   1HD   LYS 166          1HD       LYS 166 -12.132  24.168   5.901
 1096   2HD   LYS 166          2HD       LYS 166 -12.420  22.628   6.752
 1097   1HE   LYS 166          1HE       LYS 166 -11.076  21.439   5.033
 1098   2HE   LYS 166          2HE       LYS 166 -10.759  22.974   4.216
 1099   1HZ   LYS 166          1HZ       LYS 166  -8.935  22.353   5.692
 1100   2HZ   LYS 166          2HZ       LYS 166  -9.625  23.730   6.248
 1101   3HZ   LYS 166          3HZ       LYS 166  -9.922  22.303   6.992
 1102    H    ASP 167           H        ASP 167 -17.771  21.685   5.983
 1103    HA   ASP 167           HA       ASP 167 -18.886  23.079   8.339
 1104   1HB   ASP 167          1HB       ASP 167 -18.692  24.808   6.478
 1105   2HB   ASP 167          2HB       ASP 167 -19.805  23.828   5.530
 1106    H    ASP 168           H        ASP 168 -20.861  22.234   8.992
 1107    HA   ASP 168           HA       ASP 168 -21.437  19.576   8.169
 1108   1HB   ASP 168          1HB       ASP 168 -23.361  19.734   9.696
 1109   2HB   ASP 168          2HB       ASP 168 -21.897  20.380  10.419
 1110    H    SER 169           H        SER 169 -22.678  22.657   6.976
 1111    HA   SER 169           HA       SER 169 -24.913  21.286   5.537
 1112   1HB   SER 169          1HB       SER 169 -24.263  24.237   5.974
 1113   2HB   SER 169          2HB       SER 169 -25.623  23.647   5.011
 1114    HG   SER 169           HG       SER 169 -25.206  22.940   7.742
 1115    H    CYS 170           H        CYS 170 -21.919  21.149   4.839
 1116    HA   CYS 170           HA       CYS 170 -22.177  22.076   2.007
 1117   1HB   CYS 170          1HB       CYS 170 -20.352  23.106   3.498
 1118   2HB   CYS 170          2HB       CYS 170 -19.604  21.522   3.510
 1119    H    SER 171           H        SER 171 -22.115  20.498   0.462
 1120    HA   SER 171           HA       SER 171 -21.386  17.710   1.320
 1121   1HB   SER 171          1HB       SER 171 -23.784  18.565  -0.364
 1122   2HB   SER 171          2HB       SER 171 -23.344  16.902   0.054
 1123    HG   SER 171           HG       SER 171 -24.148  18.977   1.836
 1124    H    PHE 172           H        PHE 172 -20.133  19.975  -0.483
 1125    HA   PHE 172           HA       PHE 172 -20.061  18.990  -3.176
 1126   1HB   PHE 172          1HB       PHE 172 -19.293  21.208  -2.774
 1127   2HB   PHE 172          2HB       PHE 172 -18.234  20.704  -1.474
 1128    HD1  PHE 172           HD1      PHE 172 -16.083  19.590  -1.874
 1129    HD2  PHE 172           HD2      PHE 172 -18.530  20.925  -5.152
 1130    HE1  PHE 172           HE1      PHE 172 -14.187  19.245  -3.425
 1131    HE2  PHE 172           HE2      PHE 172 -16.564  20.774  -6.675
 1132    HZ   PHE 172           HZ       PHE 172 -14.375  19.973  -5.801
 1133    H    VAL 173           H        VAL 173 -18.745  17.506  -4.206
 1134    HA   VAL 173           HA       VAL 173 -16.550  16.255  -2.613
 1135    HB   VAL 173           HB       VAL 173 -18.394  14.778  -4.527
 1136   1HG1  VAL 173          1HG1      VAL 173 -17.146  12.750  -3.748
 1137   2HG1  VAL 173          2HG1      VAL 173 -16.016  13.862  -4.511
 1138   3HG1  VAL 173          3HG1      VAL 173 -16.097  13.764  -2.745
 1139   1HG2  VAL 173          1HG2      VAL 173 -18.219  14.828  -1.486
 1140   2HG2  VAL 173          2HG2      VAL 173 -19.630  15.105  -2.511
 1141   3HG2  VAL 173          3HG2      VAL 173 -18.968  13.474  -2.376
 1142    H    GLY 174           H        GLY 174 -14.647  16.588  -3.535
 1143   1HA   GLY 174          1HA       GLY 174 -14.545  17.571  -6.320
 1144   2HA   GLY 174          2HA       GLY 174 -13.190  17.443  -5.182
 1145    H    LYS 175           H        LYS 175 -14.014  16.442  -8.112
 1146    HA   LYS 175           HA       LYS 175 -13.663  13.596  -8.060
 1147   1HB   LYS 175          1HB       LYS 175 -13.023  15.609 -10.275
 1148   2HB   LYS 175          2HB       LYS 175 -13.081  13.860 -10.470
 1149   1HG   LYS 175          1HG       LYS 175 -15.466  13.839  -9.781
 1150   2HG   LYS 175          2HG       LYS 175 -15.433  15.607  -9.625
 1151   1HD   LYS 175          1HD       LYS 175 -14.882  15.823 -12.039
 1152   2HD   LYS 175          2HD       LYS 175 -14.833  14.064 -12.186
 1153   1HE   LYS 175          1HE       LYS 175 -16.935  14.778 -13.052
 1154   2HE   LYS 175          2HE       LYS 175 -17.236  13.940 -11.529
 1155   1HZ   LYS 175          1HZ       LYS 175 -17.162  16.899 -11.862
 1156   2HZ   LYS 175          2HZ       LYS 175 -18.518  16.008 -11.717
 1157   3HZ   LYS 175          3HZ       LYS 175 -17.489  16.120 -10.459
 1158    H    THR 176           H        THR 176 -11.404  16.140  -7.471
 1159    HA   THR 176           HA       THR 176  -9.243  14.158  -7.185
 1160    HB   THR 176           HB       THR 176  -7.771  16.175  -8.316
 1161    HG1  THR 176           HG1      THR 176  -9.032  17.329  -9.456
 1162   1HG2  THR 176          1HG2      THR 176  -8.912  13.769  -9.756
 1163   2HG2  THR 176          2HG2      THR 176  -7.532  14.718 -10.284
 1164   3HG2  THR 176          3HG2      THR 176  -7.430  13.819  -8.754
 1165    H    TRP 177           H        TRP 177  -7.396  15.031  -5.986
 1166    HA   TRP 177           HA       TRP 177  -8.221  16.358  -3.666
 1167   1HB   TRP 177          1HB       TRP 177  -6.262  14.985  -3.691
 1168   2HB   TRP 177          2HB       TRP 177  -5.496  15.963  -4.920
 1169    HD1  TRP 177           HD1      TRP 177  -3.534  17.029  -3.998
 1170    HE1  TRP 177           HE1      TRP 177  -2.822  18.292  -1.873
 1171    HE3  TRP 177           HE3      TRP 177  -7.730  16.254  -1.238
 1172    HZ2  TRP 177           HZ2      TRP 177  -3.635  18.118   0.884
 1173    HZ3  TRP 177           HZ3      TRP 177  -7.640  16.589   1.216
 1174    HH2  TRP 177           HH2      TRP 177  -5.585  17.459   2.292
 1175    H    THR 178           H        THR 178  -6.602  17.753  -6.572
 1176    HA   THR 178           HA       THR 178  -6.206  20.383  -5.606
 1177    HB   THR 178           HB       THR 178  -6.575  21.045  -8.061
 1178    HG1  THR 178           HG1      THR 178  -6.290  18.441  -8.851
 1179   1HG2  THR 178          1HG2      THR 178  -4.467  18.933  -7.570
 1180   2HG2  THR 178          2HG2      THR 178  -4.507  20.121  -8.884
 1181   3HG2  THR 178          3HG2      THR 178  -4.330  20.662  -7.206
 1182    H    LEU 179           H        LEU 179  -9.078  19.017  -7.310
 1183    HA   LEU 179           HA       LEU 179 -10.546  21.417  -7.425
 1184   1HB   LEU 179          1HB       LEU 179 -11.585  18.556  -7.188
 1185   2HB   LEU 179          2HB       LEU 179 -12.548  19.951  -7.668
 1186    HG   LEU 179           HG       LEU 179 -10.206  18.772  -9.179
 1187   1HD1  LEU 179          1HD1      LEU 179 -13.175  18.936  -9.836
 1188   2HD1  LEU 179          2HD1      LEU 179 -11.907  18.217 -10.861
 1189   3HD1  LEU 179          3HD1      LEU 179 -12.285  17.492  -9.295
 1190   1HD2  LEU 179          1HD2      LEU 179 -10.836  20.365 -11.010
 1191   2HD2  LEU 179          2HD2      LEU 179 -11.936  21.187  -9.879
 1192   3HD2  LEU 179          3HD2      LEU 179 -10.177  21.185  -9.594
 1193    H    TYR 180           H        TYR 180 -10.264  19.059  -4.763
 1194    HA   TYR 180           HA       TYR 180 -12.391  20.237  -3.158
 1195   1HB   TYR 180          1HB       TYR 180 -11.893  18.060  -2.609
 1196   2HB   TYR 180          2HB       TYR 180 -10.144  18.276  -2.674
 1197    HD1  TYR 180           HD1      TYR 180 -13.154  19.478  -0.735
 1198    HD2  TYR 180           HD2      TYR 180  -8.958  18.483  -0.660
 1199    HE1  TYR 180           HE1      TYR 180 -13.082  19.942   1.702
 1200    HE2  TYR 180           HE2      TYR 180  -8.917  18.846   1.808
 1201    HH   TYR 180           HH       TYR 180 -11.860  19.785   3.623
 1202    H    LEU 181           H        LEU 181  -8.790  20.411  -3.088
 1203    HA   LEU 181           HA       LEU 181  -8.583  22.325  -1.024
 1204   1HB   LEU 181          1HB       LEU 181  -6.864  21.782  -3.479
 1205   2HB   LEU 181          2HB       LEU 181  -6.432  22.964  -2.278
 1206    HG   LEU 181           HG       LEU 181  -6.795  19.946  -1.835
 1207   1HD1  LEU 181          1HD1      LEU 181  -4.742  20.241  -2.952
 1208   2HD1  LEU 181          2HD1      LEU 181  -4.384  21.767  -2.085
 1209   3HD1  LEU 181          3HD1      LEU 181  -4.297  20.223  -1.241
 1210   1HD2  LEU 181          1HD2      LEU 181  -7.472  20.911   0.221
 1211   2HD2  LEU 181          2HD2      LEU 181  -5.813  20.382   0.460
 1212   3HD2  LEU 181          3HD2      LEU 181  -6.173  22.115   0.175
 1213    H    LYS 182           H        LYS 182  -9.006  22.835  -4.554
 1214    HA   LYS 182           HA       LYS 182  -8.886  25.706  -4.532
 1215   1HB   LYS 182          1HB       LYS 182  -8.784  24.122  -6.533
 1216   2HB   LYS 182          2HB       LYS 182 -10.539  23.972  -6.429
 1217   1HG   LYS 182          1HG       LYS 182 -10.697  26.478  -6.760
 1218   2HG   LYS 182          2HG       LYS 182  -8.928  26.521  -6.891
 1219   1HD   LYS 182          1HD       LYS 182  -9.160  24.824  -8.818
 1220   2HD   LYS 182          2HD       LYS 182 -10.902  25.082  -8.717
 1221   1HE   LYS 182          1HE       LYS 182 -10.152  26.469 -10.477
 1222   2HE   LYS 182          2HE       LYS 182 -10.484  27.558  -9.127
 1223   1HZ   LYS 182          1HZ       LYS 182  -7.786  26.539  -9.857
 1224   2HZ   LYS 182          2HZ       LYS 182  -8.336  28.014 -10.264
 1225   3HZ   LYS 182          3HZ       LYS 182  -8.098  27.644  -8.688
 1226    H    HIS 183           H        HIS 183 -11.652  23.415  -4.229
 1227    HA   HIS 183           HA       HIS 183 -13.718  25.380  -4.016
 1228   1HB   HIS 183          1HB       HIS 183 -14.347  23.116  -4.419
 1229   2HB   HIS 183          2HB       HIS 183 -13.435  22.501  -3.056
 1230    HD1  HIS 183           HD1      HIS 183 -16.794  24.228  -3.749
 1231    HD2  HIS 183           HD2      HIS 183 -14.499  22.617  -0.610
 1232    HE1  HIS 183           HE1      HIS 183 -18.322  24.142  -1.706
 1233    H    VAL 184           H        VAL 184 -11.624  23.819  -1.544
 1234    HA   VAL 184           HA       VAL 184 -12.888  24.950   0.762
 1235    HB   VAL 184           HB       VAL 184 -10.158  23.794   0.173
 1236   1HG1  VAL 184          1HG1      VAL 184  -9.632  25.534   1.822
 1237   2HG1  VAL 184          2HG1      VAL 184 -10.954  24.945   2.870
 1238   3HG1  VAL 184          3HG1      VAL 184  -9.533  23.917   2.514
 1239   1HG2  VAL 184          1HG2      VAL 184 -12.585  23.061   1.857
 1240   2HG2  VAL 184          2HG2      VAL 184 -11.972  22.253   0.405
 1241   3HG2  VAL 184          3HG2      VAL 184 -11.024  22.155   1.878
 1242    H    ALA 185           H        ALA 185 -10.120  26.063  -1.223
 1243    HA   ALA 185           HA       ALA 185  -9.486  28.291   0.397
 1244   1HB   ALA 185          1HB       ALA 185  -8.263  29.102  -1.598
 1245   2HB   ALA 185          2HB       ALA 185  -7.986  27.370  -1.338
 1246   3HB   ALA 185          3HB       ALA 185  -9.105  27.911  -2.610
 1247    H    GLU 186           H        GLU 186 -11.933  27.854  -2.134
 1248    HA   GLU 186           HA       GLU 186 -12.460  30.747  -2.353
 1249   1HB   GLU 186          1HB       GLU 186 -12.463  29.191  -4.308
 1250   2HB   GLU 186          2HB       GLU 186 -13.883  28.378  -3.649
 1251   1HG   GLU 186          1HG       GLU 186 -15.214  30.419  -3.911
 1252   2HG   GLU 186          2HG       GLU 186 -13.775  31.346  -4.347
 1253    H    CYS 187           H        CYS 187 -13.877  27.909  -0.743
 1254    HA   CYS 187           HA       CYS 187 -16.373  29.461  -0.167
 1255   1HB   CYS 187          1HB       CYS 187 -15.835  26.453  -0.113
 1256   2HB   CYS 187          2HB       CYS 187 -17.386  27.229   0.233
 1257    HG   CYS 187           HG       CYS 187 -15.566  27.246  -2.515
 1258    H    HIS 188           H        HIS 188 -13.570  28.094   1.466
 1259    HA   HIS 188           HA       HIS 188 -14.897  28.618   4.110
 1260   1HB   HIS 188          1HB       HIS 188 -13.131  26.227   3.446
 1261   2HB   HIS 188          2HB       HIS 188 -13.858  26.582   5.020
 1262    HD1  HIS 188           HD1      HIS 188 -16.740  26.585   4.928
 1263    HD2  HIS 188           HD2      HIS 188 -14.492  24.757   1.889
 1264    HE1  HIS 188           HE1      HIS 188 -18.321  24.945   3.766
 1265    H    GLN 189           H        GLN 189 -12.675  29.908   2.233
 1266    HA   GLN 189           HA       GLN 189 -10.952  30.638   4.553
 1267   1HB   GLN 189          1HB       GLN 189  -9.843  29.831   1.825
 1268   2HB   GLN 189          2HB       GLN 189  -8.921  30.594   3.117
 1269   1HG   GLN 189          1HG       GLN 189  -9.517  28.662   4.616
 1270   2HG   GLN 189          2HG       GLN 189 -10.221  27.837   3.224
 1271   1HE2  GLN 189          1HE2      GLN 189  -8.038  26.869   4.871
 1272   2HE2  GLN 189          2HE2      GLN 189  -6.643  26.695   3.822
 1273    H    ASP 190           H        ASP 190 -11.529  31.316   1.036
 1274    HA   ASP 190           HA       ASP 190 -12.062  34.159   1.702
 1275   1HB   ASP 190          1HB       ASP 190  -9.622  34.088   1.365
 1276   2HB   ASP 190          2HB       ASP 190  -9.821  33.265  -0.176