*HEADER    DE NOVO PROTEIN                         04-JUN-09   2KJN              
*TITLE     PH DEPENDENT STRUCTURES OF LAH4 IN MICELLAR ENVIRONMNET:MODE OF ACTING
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LAH4;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: ARTIFICIAL GENE;                                
*SOURCE   4 ORGANISM_TAXID: 32630                                                
*KEYWDS    AMPHIPATHIC PEPTIDE, DE NOVO PROTEIN                                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.GEORGESCU, B.BECHINGER                                              
*REVDAT   1   23-JUN-10 2KJN    0                                                



assig (resid   2 and name HA) (resid   3 and name HN)  3.7   0.4   0.4
assig (resid   2 and name Hb#) (resid   3 and name HN)  4.3   0.6   1.8
assig (resid  2 and name ha) (resid   2 and name HN)  2.6   0.3   0.3
assig (resid   2 and name he*) (resid   3 and name HN)  4.2   0.6   1.8
assig (resid   2 and name hg*) (resid   3 and name HN)  3.9   0.4   1.4
assig (resid   3 and name HA) (resid   4 and name HN)  4.1   0.6   0.8
assig (resid   3 and name Hb#) (resid   4 and name HN)  4.1   0.6   1.8 
assig (resid  3 and name Hb#) (resid   3 and name HN)  3.0   0.4   0.4
assig (resid  3 and name Ha) (resid   3 and name HN)  2.7   0.3   0.3
assig (resid  3 and name ha) (resid  3 and name Hb#)  2.8   0.4   0.4
assig (resid   4 and name HA) (resid   5 and name HN)  4.3   0.6   0.8
assig (resid   4 and name Hb#) (resid   5 and name HN)  4.1   0.6   1.8
assig (resid  4 and name Hb#) (resid   4 and name HN)  3.0   0.4   1.0
assig (resid  4 and name Ha) (resid   4 and name HN)  2.7   0.3   0.3
assig (resid  4 and name Hd1#) (resid   5 and name HN)  4.1   0.6   1.8
assig (resid  4 and name Hd2#) (resid   5 and name HN)  4.4   0.6   1.8
assig (resid   4 and name Hg)  (resid   5 and name HN)  4.0   0.6   0.8
assig (resid   5 and name HA) (resid   6 and name HN)  4.1   0.6   0.8
assig (resid   5 and name Hb#) (resid   6 and name HN)  4.1   0.6   1.8 
assig (resid  5 and name Hb1) (resid   5 and name HN)  2.6   0.3   0.3
assig (resid  5 and name Hb2) (resid   5 and name HN)  3.0   0.4   0.4
assig (resid  5 and name Ha) (resid   5 and name HN)  2.6   0.3   0.3
assig (resid  5 and name Hd2#) (resid   6 and name HN)  4.1   0.6   1.8
assig (resid  5 and name Hd1#) (resid   6 and name HN)  4.3   0.6   1.8
assig (resid   5 and name Hg)  (resid   6 and name HN)  3.9   0.4   0.4
assig (resid   6 and name HA) (resid   7 and name HN)  4.2   0.6   0.8
assig (resid   6 and name Hb#) (resid   7 and name HN)  4.1   0.6   1.8 
assig (resid  6 and name Hb#) (resid   6 and name HN)  3.2   0.4   0.4
assig (resid  6 and name Ha) (resid   6 and name Hn)  2.7   0.3   0.3
assig (resid  6 and name ha) (resid  6 and name Hb#)  2.8   0.4   0.4
assig (resid   7 and name HA) (resid   8 and name HN)  4.1   0.6   0.8
assig (resid   7 and name Hb#) (resid   8 and name HN)  4.1   0.6   1.8 
assig (resid  7 and name Hb1) (resid   7 and name HN)  3.5   0.6   0.8
assig (resid  7 and name Hb2) (resid   7 and name HN)  2.5   0.3   0.3
assig (resid  7 and name Ha) (resid   7 and name HN)  2.7   0.3   0.3
assig (resid  7 and name Hd1#) (resid   8 and name HN)  4.1   0.6   1.8
assig (resid  7 and name Hd2#) (resid   8 and name HN)  4.3   0.6   1.8
assig (resid   8 and name HA) (resid   9 and name HN)  3.2   0.3   0.3
assig (resid   8 and name HN) (resid  9 and name HN)   2.5   0.3   0.3
assig (resid   8 and name HN) (resid  10 and name HN)  4.0   0.6   0.8
assig (resid   8 and name HA) (resid  10 and name HN)  4.0   0.6   0.8
assig (resid   8 and name Hb#) (resid   9 and name HN)  2.9   0.3   1.3 
assig (resid  8 and name Hb#) (resid   8 and name HN)  3.0   0.4   0.4
assig (resid  8 and name Ha) (resid   8 and name HN)  2.6   0.3   0.3
assig (resid   8 and name ha) (resid  8 and name Hb#)  2.8   0.4   0.4
assig (resid   8 and name ha) (resid  11 and name Hb1)  3.2   0.4   0.4
assig (resid   9 and name HN) (resid  10 and name HN)  2.5   0.3   0.3
assig (resid   9 and name HN) (resid  11 and name HN)  4.0   0.6   0.8
assig (resid   9 and name HA) (resid  10 and name HN)  3.2   0.3   0.3
assig (resid   9 and name HA) (resid  11 and name HN)  4.0   0.6   0.8
assig (resid   9 and name HA) (resid  12 and name HN)  3.1   0.3   0.3
assig (resid   9 and name HA) (resid  13 and name HN)  4.0   0.6   0.8
assig (resid   9 and name Hb#) (resid  10 and name HN)  2.8   0.3   1.3 
assig (resid   9 and name Ha) (resid  12 and name HB#)  3.1   0.3   1.3
assig (resid   9 and name Hn) (resid   11 and name Hd2)  3.6   0.4   0.4
assig (resid   9 and name Hn) (resid   10 and name Hd2)  4.0   0.6   0.8
assig (resid   9 and name Hb#) (resid   9 and name HN)  2.8   0.3   1.0
assig (resid   9 and name Ha) (resid   9 and name HN)  2.5   0.3   0.3
assig (resid  9 and name Hd1#) (resid  10 and name HN)  4.0   0.4   1.4
assig (resid  9 and name Hd2#) (resid  10 and name HN)  3.7   0.4   1.4
assig (resid   9 and name hg)  (resid  10 and name HN)  3.6   0.4   0.4
assig (resid   9 and name Hb#) (resid  11 and name Hb2)  4.0   0.6   1.8
assig (resid  10 and name HN) (resid  11 and name HN)  2.5   0.3   0.3
assig (resid  10 and name HN) (resid  12 and name HN)  4.0   0.6   0.8
assig (resid  10 and name HA) (resid  11 and name HN)  3.2   0.3   0.3
assig (resid  10 and name HA) (resid  12 and name HN)  4.0   0.6   0.8
assig (resid  10 and name HA) (resid  13 and name HN)  3.1   0.3   0.3
assig (resid  10 and name HA) (resid  14 and name HN)  4.0   0.6   0.8
assig (resid  10 and name hb1) (resid  11 and name HN)  3.1   0.3   0.3
assig (resid  10 and name hb2) (resid  11 and name HN)  3.6   0.4   0.4
assig (resid  10 and name Hb1) (resid  12 and name HN)  4.0   0.6   0.8 
assig (resid  10 and name Hb2) (resid  12 and name HN)  4.3   0.6   0.8
assig (resid  10 and name Ha) (resid  13 and name HB#)  3.1   0.3   1.3
assig (resid  10 and name Hn) (resid   10 and name Hd2)  3.4   0.3   0.3
assig (resid  10 and name Hb1) (resid  10 and name HD2)  3.1   0.4   0.4
assig (resid  10 and name Hb1) (resid  10 and name HE1)  4.9   0.3   0.3
assig (resid  10 and name Hb2) (resid  10 and name HE1)  4.9   0.3   0.3
assig (resid  10 and name Hb2) (resid  10 and name HD2)  3.1   0.4   0.4
assig (resid  10 and name hb1) (resid  10 and name HN)  2.5   0.3   0.3
assig (resid  10 and name hb2) (resid  10 and name HN)  3.6   0.6   0.8
assig (resid  10 and name ha) (resid  10 and name HN)  2.5   0.3   0.3
assig (resid  10 and name Hn) (resid  11 and name Hd2)  3.9   0.4   0.4
assig (resid  11 and name HN) (resid  12 and name HN)  2.5   0.3   0.3
assig (resid  11 and name HN) (resid  13 and name HN)  4.0   0.6   0.8
assig (resid  11 and name HA) (resid  12 and name HN)  3.2   0.3   0.3
assig (resid  11 and name HA) (resid  13 and name HN)  4.0   0.6   0.8
assig (resid  11 and name HA) (resid  14 and name HN)  3.1   0.3   0.3
assig (resid  11 and name hb1) (resid  12 and name HN)  3.1   0.3   0.3
assig (resid  11 and name hb2) (resid  12 and name HN)  3.6   0.4   0.4
assig (resid  11 and name Hb1) (resid  13 and name HN)  4.0   0.6   0.8 
assig (resid  11 and name Hb2) (resid  13 and name HN)  4.3   0.6   0.8
assig (resid  11 and name Ha) (resid  14 and name HB#)  3.1   0.3   1.3
assig (resid  11 and name Hn) (resid   11 and name Hd2)  3.6   0.4   0.4
assig (resid  11 and name Hb2) (resid  11 and name Hd1)  3.1   0.4   0.4
assig (resid  11 and name Hb1) (resid  11 and name He1)  4.9   0.3   0.3
assig (resid  11 and name Hb1) (resid  11 and name Hd2)  3.1   0.4   0.4
assig (resid  11 and name Hb2) (resid  11 and name He1)  4.9   0.3   0.3
assig (resid  11 and name hb1) (resid  11 and name HN)  3.6   0.6   0.8
assig (resid  11 and name hb2) (resid  11 and name HN)  2.5   0.3   0.3
assig (resid  11 and name ha) (resid  11 and name HN)  2.5   0.3   0.3
assig (resid  12 and name HN) (resid  13 and name HN)  2.5   0.3   0.3
assig (resid  12 and name HN) (resid  14 and name HN)  4.0   0.6   0.8
assig (resid  12 and name HA) (resid  13 and name HN)  3.2   0.3   0.3
assig (resid  12 and name HA) (resid  14 and name HN)  4.0   0.6   0.8
assig (resid  12 and name HA) (resid  15 and name HN)  3.1   0.3   0.3
assig (resid  12 and name Hb#) (resid  13 and name HN)  2.8   0.3   1.3
assig (resid  12 and name hb#) (resid  12 and name HN)  2.8   0.3   1.0
assig (resid  12 and name ha) (resid  12 and name HN)  2.5   0.3   0.3
assig (resid  12 and name Hd#) (resid  13 and name HN)  4.0   0.6   2.4
assig (resid  12 and name hg)  (resid  13 and name HN)  4.4   0.6   0.8
assig (resid  12 and name Ha) (resid  14 and name Hd2)  4.0   0.6   0.8
assig (resid  13 and name HN) (resid  15 and name HN)  4.0   0.6   0.8
assig (resid  13 and name HN) (resid  14 and name HN)  2.5   0.3   0.3
assig (resid  13 and name HA) (resid  14 and name HN)  3.2   0.3   0.3
assig (resid  13 and name HA) (resid  15 and name HN)  4.0   0.6   0.8
assig (resid  13 and name HA) (resid  16 and name HN)  3.1   0.3   0.3
assig (resid  13 and name Hb#) (resid  14 and name HN)  2.9   0.3   1.3 
assig (resid  13 and name Ha) (resid  16 and name HB#)  3.2   0.3   1.3
assig (resid  13 and name hb#) (resid  13 and name HN)  3.0   0.4   0.4
assig (resid  13 and name ha) (resid  13 and name HN)  2.5   0.3   0.3
assig (resid  14 and name HN) (resid  15 and name HN)  2.5   0.3   0.3
assig (resid  14 and name HN) (resid  16 and name HN)  4.0   0.6   0.8
assig (resid  14 and name HA) (resid  15 and name HN)  3.2   0.3   0.3
assig (resid  14 and name HA) (resid  16 and name HN)  4.0   0.6   0.8
assig (resid  14 and name HA) (resid  17 and name HN)  3.1   0.3   0.3
assig (resid  14 and name HA) (resid  18 and name HN)  4.0   0.6   0.8
assig (resid  14 and name Hb1) (resid  15 and name HN)  2.9   0.3   0.3 
assig (resid  14 and name Hb2) (resid  15 and name HN)  3.6   0.4   0.4 
assig (resid  14 and name Hb1) (resid  16 and name HN)  4.0   0.6   0.8 
assig (resid  14 and name Hb2) (resid  16 and name HN)  4.3   0.6   0.8 
assig (resid  14 and name Hn) (resid   14 and name Hd2)  3.4   0.3   0.3
assig (resid  14 and name Hb2) (resid  14 and name Hd2)  3.1   0.4   0.4
assig (resid  14 and name Hb1) (resid  14 and name He1)  4.9   0.3   0.3
assig (resid  14 and name Hb1) (resid  14 and name Hd2)  3.1   0.4   0.4
assig (resid  14 and name Hb2) (resid  14 and name He1)  4.8   0.3   0.3
assig (resid  14 and name hb2) (resid  14 and name HN)  3.5   0.6   0.8
assig (resid  14 and name hb1) (resid  14 and name HN)  2.5   0.3   0.3
assig (resid  14 and name ha) (resid  14 and name HN)  2.5   0.3   0.3
assig (resid  14 and name ha) (resid  17 and name Hb1)  3.0   0.4   0.4
assig (resid  14 and name He1) (resid  18 and name Hd2)  3.9   0.4   0.4
assig (resid  15 and name HN) (resid  16 and name HN)  2.5   0.3   0.3
assig (resid  15 and name HN) (resid  17 and name HN)  4.0   0.6   0.8
assig (resid  15 and name HA) (resid  16 and name HN)  3.2   0.3   0.3
assig (resid  15 and name HA) (resid  17 and name HN)  4.0   0.6   0.8
assig (resid  15 and name HA) (resid  18 and name HN)  3.1   0.3   0.3
assig (resid  15 and name HA) (resid  19 and name HN)  4.0   0.6   0.8
assig (resid  15 and name Hb#) (resid  16 and name HN)  2.8   0.3   1.3 
assig (resid  15 and name hb#) (resid  15 and name HN)  2.8   0.4   1.0
assig (resid  15 and name ha) (resid  15 and name HN)  2.5   0.3   0.3
assig (resid  15 and name Hd1#) (resid   16 and name HN)  3.7   0.4   1.4
assig (resid  15 and name Hd2#) (resid   16 and name HN)  4.0   0.4   1.4
assig (resid  15 and name hg)  (resid  16 and name HN)  3.6   0.4   0.4
assig (resid  15 and name Hn) (resid   16 and name HB#)  4.5   0.6   1.8
assig (resid  15 and name Hn) (resid   16 and name Ha)   4.3   0.6   0.8
assig (resid  15 and name Hd1#) (resid  14 and name He1)  4.1   0.6   1.8
assig (resid  16 and name HN) (resid  17 and name HN)  2.5   0.3   0.3
assig (resid  16 and name HN) (resid  18 and name HN)  4.0   0.6   0.8
assig (resid  16 and name HA) (resid  17 and name HN)  3.2   0.3   0.3
assig (resid  16 and name HA) (resid  18 and name HN)  4.0   0.6   0.8
assig (resid  16 and name HA) (resid  19 and name HN)  3.1   0.3   0.3
assig (resid  16 and name Hb#) (resid  17 and name HN)  3.2   0.3   1.3
assig (resid  16 and name Ha) (resid  19 and name HB#)  3.3   0.3   1.3
assig (resid  16 and name hb#) (resid  16 and name HN)  3.0   0.4   0.4
assig (resid  16 and name ha) (resid  16 and name HN)  2.5   0.3   0.3
assig (resid  17 and name HN) (resid  18 and name HN)  2.5   0.3   0.3
assig (resid  17 and name HN) (resid  19 and name HN)  4.0   0.6   0.8
assig (resid  17 and name HA) (resid  18 and name HN)  3.2   0.3   0.3
assig (resid  17 and name HA) (resid  19 and name HN)  4.0   0.6   0.8
assig (resid  17 and name HA) (resid  20 and name HN)  3.1   0.3   0.3
assig (resid  17 and name HA) (resid  21 and name HN)  4.0   0.6   0.8
assig (resid  17 and name Hb#) (resid  18 and name HN)  2.9   0.3   1.3
assig (resid  17 and name Ha) (resid  20 and name HB#)  3.1   0.3   1.3
assig (resid  17 and name Hd#) (resid   18 and name Hd2)  3.9   0.4   2.4
assig (resid  17 and name Hb#) (resid   18 and name Hd2)  3.6   0.4   1.4
assig (resid  17 and name Hg) (resid   18 and name Hd2)  4.1   0.6   0.8
assig (resid  17 and name hb#) (resid  17 and name HN)  2.8   0.3   1.0
assig (resid  17 and name ha) (resid  17 and name HN)  2.5   0.3   0.3
assig (resid  17 and name Hd#) (resid   18 and name HN)  3.9   0.4   2.4
assig (resid  17 and name hg)  (resid  18 and name HN)  4.4   0.6   0.8
assig (resid  17 and name Hg) (resid   18 and name HB2)  4.0   0.6   0.8
assig (resid  18 and name HN) (resid  19 and name HN)  2.5   0.3   0.3
assig (resid  18 and name HN) (resid  20 and name HN)  4.0   0.6   0.8
assig (resid  18 and name HA) (resid  19 and name HN)  3.2   0.3   0.3
assig (resid  18 and name HA) (resid  20 and name HN)  4.0   0.6   0.8
assig (resid  18 and name HA) (resid  21 and name HN)  3.1   0.3   0.3
assig (resid  18 and name Hb1) (resid  19 and name HN)  3.1   0.3   0.3 
assig (resid  18 and name Hb2) (resid  19 and name HN)  3.6   0.4   0.4
assig (resid  18 and name Hb1) (resid  20 and name HN)  4.0   0.6   0.8 
assig (resid  18 and name Hb2) (resid  20 and name HN)  4.3   0.6   0.8
assig (resid  18 and name Hn) (resid   18 and name Hd2)  3.4   0.3   0.3
assig (resid  18 and name Hb2) (resid  18 and name HE1)  4.9   0.3   0.3
assig (resid  18 and name Hb1) (resid  18 and name Hd2)  3.1   0.4   0.4
assig (resid  18 and name Hb1) (resid  18 and name He1)  4.9   0.3   0.3
assig (resid  18 and name Hb2) (resid  18 and name Hd2)  3.1   0.4   0.4
assig (resid  18 and name hb1) (resid  18 and name HN)  2.5   0.3   0.3
assig (resid  18 and name hb2) (resid  18 and name HN)  3.6   0.6   0.8
assig (resid  18 and name ha) (resid  18 and name HN)  2.5   0.3   0.3
assig (resid  18 and name He1) (resid  19 and name Hd#)  3.1   0.4   2.4
assig (resid  19 and name HN) (resid  20 and name HN)  2.5   0.3   0.3
assig (resid  19 and name HN) (resid  21 and name HN)  4.0   0.6   0.8
assig (resid  19 and name HA) (resid  20 and name HN)  3.2   0.3   0.3
assig (resid  19 and name HA) (resid  21 and name HN)  4.0   0.6   0.8
assig (resid  19 and name HA) (resid  22 and name HN)  3.1   0.3   0.3
assig (resid  19 and name Hb#) (resid  20 and name HN)  2.9   0.3   1.3
assig (resid  19 and name Ha) (resid  22 and name HB#)  3.4   0.3   1.3
assig (resid  19 and name hb#) (resid  19 and name HN)  2.7   0.3   1.0
assig (resid  19 and name ha) (resid  19 and name HN)  2.5   0.3   0.3
assig (resid  19 and name Hd#) (resid   20 and name HN)  4.2   0.6   2.4
assig (resid  19 and name hg)  (resid  20 and name HN)  4.3   0.6   0.8
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assig (resid  20 and name HA) (resid  21 and name HN)  3.2   0.3   0.3
assig (resid  20 and name HA) (resid  22 and name HN)  4.0   0.6   0.8
assig (resid  20 and name HA) (resid  23 and name HN)  3.1   0.3   0.3
assig (resid  20 and name HA) (resid  24 and name HN)  4.0   0.6   0.8
assig (resid  20 and name Hb#) (resid  21 and name HN)  2.8   0.3   1.3
assig (resid  20 and name Ha) (resid  23 and name HB#)  3.1   0.3   1.3
assig (resid  20 and name hb#) (resid  20 and name HN)  3.0   0.4   0.4
assig (resid  20 and name ha) (resid  20 and name HN)  2.5   0.3   0.3
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assig (resid  22 and name Hb#) (resid  23 and name HN)  3.1   0.3   1.3
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assig (resid  22 and name ha) (resid  22 and name HN)  2.5   0.3   0.3
assig (resid  23 and name HN) (resid  24 and name HN)  2.5   0.3   0.3
assig (resid  23 and name HA) (resid  24 and name HN)  3.2   0.3   0.3
assig (resid  23 and name Hb#) (resid  24 and name HN)  2.8   0.3   1.3
assig (resid  23 and name hb1) (resid  23 and name HN)  2.5   0.3   0.3
assig (resid  23 and name hb2) (resid  23 and name HN)  3.5   0.6   0.8
assig (resid  23 and name ha) (resid  23 and name HN)  2.5   0.3   0.3
assig (resid  23 and name Hd#) (resid   24 and name HN)  4.2   0.6   2.4
assig (resid  24 and name HA) (resid  25 and name HN)  3.2   0.3   0.3
assig (resid  24 and name Hb#) (resid  25 and name HN)  3.9   0.4   1.4
assig (resid  24 and name hb#) (resid  24 and name HN)  2.9   0.4   1.0
assig (resid  24 and name ha) (resid  24 and name HN)  2.5   0.3   0.3
assig (resid  24 and name ha) (resid  24 and name Hd#)  4.1   0.6   0.8
assig (resid  24 and name ha) (resid  24 and name Hg#)  2.7   0.3   0.9
assig (resid  24 and name hg*) (resid  25 and name HN)  3.9   0.4   1.4
assig (resid  24 and name he*) (resid  25 and name HN)  4.3   0.6   1.8
assig (resid  25 and name HA) (resid  26 and name HN)  3.9   0.4   0.4
assig (resid  25 and name hb#) (resid  25 and name HN)  3.0   0.4   1.0
assig (resid  25 and name ha) (resid  25 and name HN)  2.6   0.3   0.3
assig (resid  25 and name ha) (resid  25 and name Hg#)  2.7   0.3   0.9
assig (resid  25 and name ha) (resid  25 and name HD#)  4.1   0.6   0.8
assig (resid  25 and name hg*) (resid  26 and name HN)  4.0   0.6   1.8
assig (resid  25 and name he*) (resid  26 and name HN)  3.9   0.4   1.4
assig (resid  26 and name Hb#) (resid  26 and name HN)  3.0   0.4   0.4
assig (resid  26 and name ha) (resid  26 and name HN)  2.7   0.3   0.3
assig (resid  26 and name ha) (resid 26 and name Hb#)  2.8   0.4   0.4

assig (resid   9 and name O) (resid  12 and name HN)  1.8   0.3   0.5
assig (resid   9 and name O) (resid  13 and name HN)  1.8   0.3   0.5
assig (resid  10 and name O) (resid  14 and name HN)  1.8   0.3   0.5
assig (resid  11 and name O) (resid  15 and name HN)  1.8   0.3   0.5
assig (resid  12 and name O) (resid  16 and name HN)  1.8   0.3   0.5
assig (resid  13 and name O) (resid  17 and name HN)  1.8   0.3   0.5
assig (resid  14 and name O) (resid  18 and name HN)  1.8   0.3   0.5
assig (resid  15 and name O) (resid  19 and name HN)  1.8   0.3   0.5
assig (resid  16 and name O) (resid  20 and name HN)  1.8   0.3   0.5
assig (resid  17 and name O) (resid  21 and name HN)  1.8   0.3   0.5
assig (resid  18 and name O) (resid  22 and name HN)  1.8   0.3   0.5
assig (resid  19 and name O) (resid  23 and name HN)  1.8   0.3   0.5
assig (resid  20 and name O) (resid  24 and name HN)  1.8   0.3   0.5
assig (resid  21 and name O) (resid  25 and name HN)  1.8   0.3   0.5




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           1HT      LYS   1  -9.372   2.111  17.434
    2    H2   LYS   1           2HT      LYS   1  -8.325   0.903  16.869
    3    H3   LYS   1           3HT      LYS   1  -9.603   1.447  15.898
    4    HA   LYS   1           HA       LYS   1  -7.589   3.369  16.814
    5    HB2  LYS   1           2HB      LYS   1  -6.315   2.890  14.695
    6    HB3  LYS   1           1HB      LYS   1  -6.221   1.588  15.878
    7    HG2  LYS   1           2HG      LYS   1  -8.169   0.492  14.681
    8    HG3  LYS   1           1HG      LYS   1  -7.980   1.704  13.415
    9    HD2  LYS   1           2HD      LYS   1  -5.861   0.900  12.781
   10    HD3  LYS   1           1HD      LYS   1  -5.617   0.057  14.310
   11    HE2  LYS   1           2HE      LYS   1  -7.575  -0.707  12.121
   12    HE3  LYS   1           1HE      LYS   1  -6.120  -1.584  12.581
   13    HZ1  LYS   1           2HZ      LYS   1  -7.469  -1.315  14.919
   14    HZ2  LYS   1           3HZ      LYS   1  -7.449  -2.709  13.945
   15    HZ3  LYS   1           1HZ      LYS   1  -8.712  -1.587  13.803
   16    H    LYS   2           H        LYS   2  -7.729   5.257  15.595
   17    HA   LYS   2           HA       LYS   2 -10.267   5.703  14.285
   18    HB2  LYS   2           2HB      LYS   2  -7.873   7.506  14.744
   19    HB3  LYS   2           1HB      LYS   2  -9.387   8.035  14.010
   20    HG2  LYS   2           2HG      LYS   2 -10.076   6.633  16.386
   21    HG3  LYS   2           1HG      LYS   2  -8.759   7.728  16.805
   22    HD2  LYS   2           2HD      LYS   2 -10.567   9.163  17.056
   23    HD3  LYS   2           1HD      LYS   2 -10.174   9.456  15.363
   24    HE2  LYS   2           2HE      LYS   2 -12.500   9.080  15.315
   25    HE3  LYS   2           1HE      LYS   2 -11.828   7.518  14.860
   26    HZ1  LYS   2           3HZ      LYS   2 -12.608   8.255  17.627
   27    HZ2  LYS   2           1HZ      LYS   2 -12.098   6.732  17.082
   28    HZ3  LYS   2           2HZ      LYS   2 -13.581   7.374  16.553
   29    H    ALA   3           H        ALA   3 -10.596   5.152  12.226
   30    HA   ALA   3           HA       ALA   3  -8.352   5.463  10.314
   31    HB1  ALA   3           1HB      ALA   3  -9.083   3.527   9.130
   32    HB2  ALA   3           2HB      ALA   3 -10.578   3.434  10.061
   33    HB3  ALA   3           3HB      ALA   3  -9.034   3.067  10.831
   34    H    LEU   4           H        LEU   4  -9.005   5.976   8.122
   35    HA   LEU   4           HA       LEU   4 -11.541   7.494   8.041
   36    HB2  LEU   4           2HB      LEU   4  -9.231   7.953   6.170
   37    HB3  LEU   4           1HB      LEU   4 -10.539   9.053   6.605
   38    HG   LEU   4           HG       LEU   4  -8.344   8.126   8.488
   39   HD11  LEU   4          1HD1      LEU   4  -7.849  10.694   8.307
   40   HD12  LEU   4          2HD1      LEU   4  -8.734  10.574   6.787
   41   HD13  LEU   4          3HD1      LEU   4  -7.276   9.615   7.032
   42   HD21  LEU   4          3HD2      LEU   4 -10.312   8.619   9.768
   43   HD22  LEU   4          1HD2      LEU   4 -10.693  10.021   8.775
   44   HD23  LEU   4          2HD2      LEU   4  -9.308  10.065   9.864
   45    H    LEU   5           H        LEU   5 -11.985   7.851   5.487
   46    HA   LEU   5           HA       LEU   5 -12.645   5.199   4.521
   47    HB2  LEU   5           2HB      LEU   5 -13.508   7.940   3.988
   48    HB3  LEU   5           1HB      LEU   5 -13.300   7.006   2.508
   49    HG   LEU   5           HG       LEU   5 -15.604   6.841   3.511
   50   HD11  LEU   5          1HD1      LEU   5 -15.713   4.345   3.355
   51   HD12  LEU   5          2HD1      LEU   5 -13.949   4.310   3.321
   52   HD13  LEU   5          3HD1      LEU   5 -14.847   5.090   2.017
   53   HD21  LEU   5          3HD2      LEU   5 -14.509   4.978   5.582
   54   HD22  LEU   5          1HD2      LEU   5 -15.994   5.924   5.600
   55   HD23  LEU   5          2HD2      LEU   5 -14.443   6.712   5.913
   56    H    ALA   6           H        ALA   6 -11.484   4.041   3.128
   57    HA   ALA   6           HA       ALA   6  -9.985   5.173   0.978
   58    HB1  ALA   6           1HB      ALA   6  -8.592   5.502   3.214
   59    HB2  ALA   6           2HB      ALA   6  -7.805   5.043   1.706
   60    HB3  ALA   6           3HB      ALA   6  -8.170   3.818   2.920
   61    H    LEU   7           H        LEU   7  -8.577   3.433  -0.080
   62    HA   LEU   7           HA       LEU   7 -10.101   0.923   0.017
   63    HB2  LEU   7           2HB      LEU   7  -9.287   2.392  -2.138
   64    HB3  LEU   7           1HB      LEU   7  -7.985   1.207  -2.011
   65    HG   LEU   7           HG       LEU   7 -10.154  -0.396  -1.599
   66   HD11  LEU   7          1HD1      LEU   7 -11.819   1.282  -1.988
   67   HD12  LEU   7          2HD1      LEU   7 -11.777   0.263  -3.425
   68   HD13  LEU   7          3HD1      LEU   7 -11.002   1.845  -3.442
   69   HD21  LEU   7          3HD2      LEU   7  -9.652  -1.306  -3.684
   70   HD22  LEU   7          1HD2      LEU   7  -8.171  -0.432  -3.301
   71   HD23  LEU   7          2HD2      LEU   7  -9.346   0.273  -4.410
   72    H    ALA   8           H        ALA   8  -9.336  -0.590   1.286
   73    HA   ALA   8           HA       ALA   8  -6.813  -0.624   2.510
   74    HB1  ALA   8           1HB      ALA   8  -8.620  -1.858   3.489
   75    HB2  ALA   8           2HB      ALA   8  -7.380  -3.024   3.028
   76    HB3  ALA   8           3HB      ALA   8  -8.817  -2.825   2.029
   77    H    LEU   9           H        LEU   9  -7.848  -1.736  -0.537
   78    HA   LEU   9           HA       LEU   9  -5.747  -3.592  -1.068
   79    HB2  LEU   9           2HB      LEU   9  -8.095  -2.696  -2.314
   80    HB3  LEU   9           1HB      LEU   9  -6.780  -2.310  -3.424
   81    HG   LEU   9           HG       LEU   9  -7.276  -5.030  -2.169
   82   HD11  LEU   9          1HD1      LEU   9  -7.809  -5.678  -4.534
   83   HD12  LEU   9          2HD1      LEU   9  -7.777  -3.971  -4.961
   84   HD13  LEU   9          3HD1      LEU   9  -8.978  -4.573  -3.819
   85   HD21  LEU   9          3HD2      LEU   9  -5.307  -4.192  -4.331
   86   HD22  LEU   9          1HD2      LEU   9  -5.508  -5.815  -3.680
   87   HD23  LEU   9          2HD2      LEU   9  -4.874  -4.529  -2.657
   88    H    HIS  10           H        HIS  10  -6.405  -0.470  -2.580
   89    HA   HIS  10           HA       HIS  10  -3.930  -0.019  -3.759
   90    HB2  HIS  10           2HB      HIS  10  -6.098   1.759  -2.713
   91    HB3  HIS  10           1HB      HIS  10  -4.550   2.482  -3.126
   92    HD1  HIS  10           1HD      HIS  10  -4.818   3.483  -5.399
   93    HD2  HIS  10           2HD      HIS  10  -6.581  -0.292  -5.162
   94    HE1  HIS  10           1HE      HIS  10  -5.634   2.922  -7.735
   95    HE2  HIS  10           2HE      HIS  10  -6.734   0.629  -7.600
   96    H    HIS  11           H        HIS  11  -5.155   0.581  -0.599
   97    HA   HIS  11           HA       HIS  11  -3.258   1.992   0.731
   98    HB2  HIS  11           2HB      HIS  11  -5.260  -0.006   1.330
   99    HB3  HIS  11           1HB      HIS  11  -3.866  -0.163   2.411
  100    HD1  HIS  11           1HD      HIS  11  -3.698   1.506   4.296
  101    HD2  HIS  11           2HD      HIS  11  -6.340   2.743   1.310
  102    HE1  HIS  11           1HE      HIS  11  -4.729   3.681   5.111
  103    HE2  HIS  11           2HE      HIS  11  -6.325   4.470   3.286
  104    H    LEU  12           H        LEU  12  -3.251  -1.433  -0.014
  105    HA   LEU  12           HA       LEU  12  -0.745  -1.969   1.267
  106    HB2  LEU  12           2HB      LEU  12  -2.800  -3.494   0.052
  107    HB3  LEU  12           1HB      LEU  12  -1.319  -3.858  -0.832
  108    HG   LEU  12           HG       LEU  12  -1.469  -3.875   2.193
  109   HD11  LEU  12          1HD1      LEU  12  -1.572  -6.280   0.352
  110   HD12  LEU  12          2HD1      LEU  12  -3.017  -5.555   1.059
  111   HD13  LEU  12          3HD1      LEU  12  -1.782  -6.260   2.105
  112   HD21  LEU  12          3HD2      LEU  12   0.512  -4.788   0.103
  113   HD22  LEU  12          1HD2      LEU  12   0.557  -5.415   1.746
  114   HD23  LEU  12          2HD2      LEU  12   0.785  -3.693   1.454
  115    H    ALA  13           H        ALA  13  -1.781  -1.519  -2.039
  116    HA   ALA  13           HA       ALA  13   0.752  -1.759  -3.276
  117    HB1  ALA  13           1HB      ALA  13  -0.239  -0.590  -5.175
  118    HB2  ALA  13           2HB      ALA  13  -1.572  -0.032  -4.169
  119    HB3  ALA  13           3HB      ALA  13  -1.402  -1.745  -4.533
  120    H    HIS  14           H        HIS  14  -0.851   0.751  -1.564
  121    HA   HIS  14           HA       HIS  14   0.830   2.916  -2.326
  122    HB2  HIS  14           2HB      HIS  14  -0.970   3.857  -1.442
  123    HB3  HIS  14           1HB      HIS  14  -1.405   2.440  -0.521
  124    HD1  HIS  14           1HD      HIS  14   1.419   5.037  -0.300
  125    HD2  HIS  14           2HD      HIS  14  -1.312   3.021   2.133
  126    HE1  HIS  14           1HE      HIS  14   1.816   5.865   2.070
  127    HE2  HIS  14           2HE      HIS  14   0.160   4.644   3.568
  128    H    LEU  15           H        LEU  15   0.662   0.897   0.560
  129    HA   LEU  15           HA       LEU  15   2.918   1.945   1.877
  130    HB2  LEU  15           2HB      LEU  15   1.562  -0.741   1.828
  131    HB3  LEU  15           1HB      LEU  15   3.146  -0.611   2.581
  132    HG   LEU  15           HG       LEU  15   2.355   0.686   4.330
  133   HD11  LEU  15          1HD1      LEU  15   0.215   1.572   2.399
  134   HD12  LEU  15          2HD1      LEU  15   1.437   2.563   3.188
  135   HD13  LEU  15          3HD1      LEU  15   0.097   1.904   4.124
  136   HD21  LEU  15          3HD2      LEU  15   1.033  -1.589   3.810
  137   HD22  LEU  15          1HD2      LEU  15  -0.327  -0.469   3.750
  138   HD23  LEU  15          2HD2      LEU  15   0.661  -0.585   5.213
  139    H    ALA  16           H        ALA  16   2.344  -0.343  -0.598
  140    HA   ALA  16           HA       ALA  16   5.006  -1.307  -0.883
  141    HB1  ALA  16           1HB      ALA  16   2.714  -2.197  -1.859
  142    HB2  ALA  16           2HB      ALA  16   4.232  -2.501  -2.698
  143    HB3  ALA  16           3HB      ALA  16   3.176  -1.199  -3.234
  144    H    LEU  17           H        LEU  17   3.289   1.429  -2.115
  145    HA   LEU  17           HA       LEU  17   4.982   2.148  -4.206
  146    HB2  LEU  17           2HB      LEU  17   3.480   3.802  -4.411
  147    HB3  LEU  17           1HB      LEU  17   2.721   3.218  -2.942
  148    HG   LEU  17           HG       LEU  17   4.350   4.678  -1.640
  149   HD11  LEU  17          1HD1      LEU  17   4.921   6.686  -3.431
  150   HD12  LEU  17          2HD1      LEU  17   5.203   5.246  -4.407
  151   HD13  LEU  17          3HD1      LEU  17   6.079   5.469  -2.896
  152   HD21  LEU  17          3HD2      LEU  17   3.020   6.690  -2.011
  153   HD22  LEU  17          1HD2      LEU  17   1.980   5.272  -2.104
  154   HD23  LEU  17          2HD2      LEU  17   2.497   6.082  -3.581
  155    H    HIS  18           H        HIS  18   5.083   3.159  -0.812
  156    HA   HIS  18           HA       HIS  18   7.596   4.542  -1.311
  157    HB2  HIS  18           2HB      HIS  18   7.614   5.063   1.022
  158    HB3  HIS  18           1HB      HIS  18   5.987   5.266   0.400
  159    HD1  HIS  18           1HD      HIS  18   8.002   3.145   2.707
  160    HD2  HIS  18           2HD      HIS  18   4.073   3.447   1.330
  161    HE1  HIS  18           1HE      HIS  18   6.596   1.698   4.251
  162    HE2  HIS  18           2HE      HIS  18   4.184   1.886   3.435
  163    H    LEU  19           H        LEU  19   6.497   1.608   0.204
  164    HA   LEU  19           HA       LEU  19   8.881   0.561   1.170
  165    HB2  LEU  19           2HB      LEU  19   6.342  -0.544   0.361
  166    HB3  LEU  19           1HB      LEU  19   7.632  -1.549  -0.270
  167    HG   LEU  19           HG       LEU  19   7.037  -2.355   1.913
  168   HD11  LEU  19          1HD1      LEU  19   9.188  -2.616   2.652
  169   HD12  LEU  19          2HD1      LEU  19   9.508  -0.883   2.638
  170   HD13  LEU  19          3HD1      LEU  19   9.571  -1.802   1.135
  171   HD21  LEU  19          3HD2      LEU  19   7.720   0.396   2.965
  172   HD22  LEU  19          1HD2      LEU  19   7.082  -0.961   3.889
  173   HD23  LEU  19          2HD2      LEU  19   6.073  -0.160   2.688
  174    H    ALA  20           H        ALA  20   7.658   0.962  -2.039
  175    HA   ALA  20           HA       ALA  20   9.657  -0.582  -3.390
  176    HB1  ALA  20           1HB      ALA  20   7.460   0.206  -4.388
  177    HB2  ALA  20           2HB      ALA  20   8.876   0.424  -5.415
  178    HB3  ALA  20           3HB      ALA  20   8.198   1.799  -4.544
  179    H    LEU  21           H        LEU  21   9.268   2.920  -3.240
  180    HA   LEU  21           HA       LEU  21  11.777   3.612  -4.206
  181    HB2  LEU  21           2HB      LEU  21   9.695   4.948  -2.597
  182    HB3  LEU  21           1HB      LEU  21  11.317   5.602  -2.395
  183    HG   LEU  21           HG       LEU  21  10.165   6.765  -4.213
  184   HD11  LEU  21          1HD1      LEU  21  12.013   6.835  -5.543
  185   HD12  LEU  21          2HD1      LEU  21  12.007   5.094  -5.814
  186   HD13  LEU  21          3HD1      LEU  21  12.699   5.750  -4.331
  187   HD21  LEU  21          3HD2      LEU  21   9.154   5.702  -6.026
  188   HD22  LEU  21          1HD2      LEU  21   8.781   4.587  -4.715
  189   HD23  LEU  21          2HD2      LEU  21  10.102   4.231  -5.826
  190    H    ALA  22           H        ALA  22  10.717   3.042  -0.908
  191    HA   ALA  22           HA       ALA  22  13.097   3.596   0.439
  192    HB1  ALA  22           1HB      ALA  22  11.227   3.284   1.813
  193    HB2  ALA  22           2HB      ALA  22  12.194   1.834   2.108
  194    HB3  ALA  22           3HB      ALA  22  10.794   1.759   1.031
  195    H    LEU  23           H        LEU  23  12.063   0.686  -1.224
  196    HA   LEU  23           HA       LEU  23  14.440  -0.789  -0.398
  197    HB2  LEU  23           2HB      LEU  23  11.928  -1.399  -1.867
  198    HB3  LEU  23           1HB      LEU  23  13.338  -2.384  -2.252
  199    HG   LEU  23           HG       LEU  23  13.546  -3.164  -0.029
  200   HD11  LEU  23          1HD1      LEU  23  11.817  -0.799   0.668
  201   HD12  LEU  23          2HD1      LEU  23  13.371  -1.274   1.354
  202   HD13  LEU  23          3HD1      LEU  23  11.914  -2.180   1.758
  203   HD21  LEU  23          3HD2      LEU  23  11.104  -3.809   0.572
  204   HD22  LEU  23          1HD2      LEU  23  11.739  -4.348  -0.983
  205   HD23  LEU  23          2HD2      LEU  23  10.666  -2.946  -0.904
  206    H    LYS  24           H        LYS  24  13.083   0.605  -3.305
  207    HA   LYS  24           HA       LYS  24  15.214  -0.203  -5.014
  208    HB2  LYS  24           2HB      LYS  24  12.817   0.461  -5.656
  209    HB3  LYS  24           1HB      LYS  24  13.391   2.125  -5.551
  210    HG2  LYS  24           2HG      LYS  24  15.305   0.586  -7.042
  211    HG3  LYS  24           1HG      LYS  24  13.702   0.308  -7.719
  212    HD2  LYS  24           2HD      LYS  24  14.371   2.226  -8.867
  213    HD3  LYS  24           1HD      LYS  24  13.464   2.915  -7.525
  214    HE2  LYS  24           2HE      LYS  24  15.718   3.997  -7.971
  215    HE3  LYS  24           1HE      LYS  24  15.472   3.448  -6.321
  216    HZ1  LYS  24           3HZ      LYS  24  16.593   1.449  -8.077
  217    HZ2  LYS  24           1HZ      LYS  24  17.065   1.901  -6.507
  218    HZ3  LYS  24           2HZ      LYS  24  17.589   2.805  -7.856
  219    H    LYS  25           H        LYS  25  14.530   2.785  -3.255
  220    HA   LYS  25           HA       LYS  25  16.746   4.180  -4.451
  221    HB2  LYS  25           2HB      LYS  25  14.628   5.233  -3.466
  222    HB3  LYS  25           1HB      LYS  25  15.381   4.979  -1.893
  223    HG2  LYS  25           2HG      LYS  25  17.411   6.100  -3.466
  224    HG3  LYS  25           1HG      LYS  25  15.963   7.006  -3.906
  225    HD2  LYS  25           2HD      LYS  25  16.424   8.225  -2.036
  226    HD3  LYS  25           1HD      LYS  25  15.695   6.869  -1.180
  227    HE2  LYS  25           2HE      LYS  25  17.893   7.454  -0.225
  228    HE3  LYS  25           1HE      LYS  25  17.912   5.831  -0.910
  229    HZ1  LYS  25           3HZ      LYS  25  19.534   8.008  -1.553
  230    HZ2  LYS  25           1HZ      LYS  25  18.593   7.658  -2.916
  231    HZ3  LYS  25           2HZ      LYS  25  19.569   6.440  -2.223
  232    H    ALA  26           H        ALA  26  18.784   3.727  -4.019
  233    HA   ALA  26           HA       ALA  26  19.514   2.581  -1.422
  234    HB1  ALA  26           1HB      ALA  26  20.944   2.867  -4.066
  235    HB2  ALA  26           2HB      ALA  26  20.521   1.386  -3.204
  236    HB3  ALA  26           3HB      ALA  26  21.809   2.427  -2.593
  Start of MODEL    2
    1    H1   LYS   1           1HT      LYS   1 -21.203   5.623   3.364
    2    H2   LYS   1           2HT      LYS   1 -21.951   6.058   4.821
    3    H3   LYS   1           3HT      LYS   1 -21.190   7.240   3.876
    4    HA   LYS   1           HA       LYS   1 -23.165   5.835   2.388
    5    HB2  LYS   1           2HB      LYS   1 -23.851   7.002   5.061
    6    HB3  LYS   1           1HB      LYS   1 -24.998   7.173   3.736
    7    HG2  LYS   1           2HG      LYS   1 -23.920   4.450   3.968
    8    HG3  LYS   1           1HG      LYS   1 -24.796   4.970   5.406
    9    HD2  LYS   1           2HD      LYS   1 -26.794   5.351   4.211
   10    HD3  LYS   1           1HD      LYS   1 -25.962   5.405   2.657
   11    HE2  LYS   1           2HE      LYS   1 -26.518   2.985   4.384
   12    HE3  LYS   1           1HE      LYS   1 -27.060   3.285   2.736
   13    HZ1  LYS   1           2HZ      LYS   1 -24.430   3.464   2.416
   14    HZ2  LYS   1           3HZ      LYS   1 -25.286   2.009   2.247
   15    HZ3  LYS   1           1HZ      LYS   1 -24.482   2.350   3.701
   16    H    LYS   2           H        LYS   2 -24.038   7.242   0.927
   17    HA   LYS   2           HA       LYS   2 -24.067   8.993  -0.502
   18    HB2  LYS   2           2HB      LYS   2 -24.803  11.067   0.350
   19    HB3  LYS   2           1HB      LYS   2 -25.463   9.842   1.426
   20    HG2  LYS   2           2HG      LYS   2 -23.870  10.348   3.132
   21    HG3  LYS   2           1HG      LYS   2 -22.870  11.288   2.027
   22    HD2  LYS   2           2HD      LYS   2 -25.267  12.590   1.803
   23    HD3  LYS   2           1HD      LYS   2 -25.308  12.083   3.493
   24    HE2  LYS   2           2HE      LYS   2 -23.035  13.599   2.163
   25    HE3  LYS   2           1HE      LYS   2 -24.238  14.311   3.239
   26    HZ1  LYS   2           3HZ      LYS   2 -21.861  13.203   3.981
   27    HZ2  LYS   2           1HZ      LYS   2 -22.985  12.001   4.376
   28    HZ3  LYS   2           2HZ      LYS   2 -23.155  13.567   5.013
   29    H    ALA   3           H        ALA   3 -21.654   9.594   2.056
   30    HA   ALA   3           HA       ALA   3 -20.105  11.432   0.558
   31    HB1  ALA   3           1HB      ALA   3 -20.032  10.812   3.105
   32    HB2  ALA   3           2HB      ALA   3 -18.550  11.298   2.283
   33    HB3  ALA   3           3HB      ALA   3 -18.874   9.591   2.577
   34    H    LEU   4           H        LEU   4 -17.855  10.985  -0.184
   35    HA   LEU   4           HA       LEU   4 -17.890   8.713  -1.982
   36    HB2  LEU   4           2HB      LEU   4 -17.061  10.805  -2.857
   37    HB3  LEU   4           1HB      LEU   4 -15.905  10.954  -1.536
   38    HG   LEU   4           HG       LEU   4 -15.675   8.423  -3.050
   39   HD11  LEU   4          1HD1      LEU   4 -16.274   9.979  -4.884
   40   HD12  LEU   4          2HD1      LEU   4 -14.594   9.454  -4.998
   41   HD13  LEU   4          3HD1      LEU   4 -14.974  11.060  -4.379
   42   HD21  LEU   4          3HD2      LEU   4 -13.582  10.551  -2.544
   43   HD22  LEU   4          1HD2      LEU   4 -13.352   8.805  -2.708
   44   HD23  LEU   4          2HD2      LEU   4 -14.114   9.464  -1.261
   45    H    LEU   5           H        LEU   5 -16.467   6.980  -1.960
   46    HA   LEU   5           HA       LEU   5 -14.951   6.620   0.554
   47    HB2  LEU   5           2HB      LEU   5 -16.709   4.791  -0.998
   48    HB3  LEU   5           1HB      LEU   5 -15.244   4.088  -0.311
   49    HG   LEU   5           HG       LEU   5 -17.175   5.765   1.315
   50   HD11  LEU   5          1HD1      LEU   5 -18.523   3.938   0.782
   51   HD12  LEU   5          2HD1      LEU   5 -17.707   3.355   2.233
   52   HD13  LEU   5          3HD1      LEU   5 -17.155   2.839   0.639
   53   HD21  LEU   5          3HD2      LEU   5 -15.914   5.131   3.162
   54   HD22  LEU   5          1HD2      LEU   5 -14.646   5.192   1.942
   55   HD23  LEU   5          2HD2      LEU   5 -15.350   3.643   2.399
   56    H    ALA   6           H        ALA   6 -13.126   5.021   0.295
   57    HA   ALA   6           HA       ALA   6 -11.747   5.487  -2.286
   58    HB1  ALA   6           1HB      ALA   6  -9.685   5.709  -1.158
   59    HB2  ALA   6           2HB      ALA   6 -10.319   5.000   0.327
   60    HB3  ALA   6           3HB      ALA   6 -10.812   6.622  -0.153
   61    H    LEU   7           H        LEU   7  -9.737   3.798  -2.247
   62    HA   LEU   7           HA       LEU   7 -11.027   1.225  -2.482
   63    HB2  LEU   7           2HB      LEU   7  -8.357   2.365  -3.181
   64    HB3  LEU   7           1HB      LEU   7  -8.484   0.621  -2.998
   65    HG   LEU   7           HG       LEU   7  -8.872   1.359  -5.350
   66   HD11  LEU   7          1HD1      LEU   7 -11.571   0.450  -4.548
   67   HD12  LEU   7          2HD1      LEU   7 -10.244  -0.527  -3.926
   68   HD13  LEU   7          3HD1      LEU   7 -10.422  -0.283  -5.662
   69   HD21  LEU   7          3HD2      LEU   7 -11.440   2.595  -4.323
   70   HD22  LEU   7          1HD2      LEU   7 -10.733   2.733  -5.935
   71   HD23  LEU   7          2HD2      LEU   7  -9.977   3.552  -4.569
   72    H    ALA   8           H        ALA   8  -9.224  -0.620  -1.742
   73    HA   ALA   8           HA       ALA   8  -8.650  -0.116   1.101
   74    HB1  ALA   8           1HB      ALA   8 -10.786  -1.683   0.189
   75    HB2  ALA   8           2HB      ALA   8 -10.139  -1.633   1.830
   76    HB3  ALA   8           3HB      ALA   8  -9.546  -2.837   0.686
   77    H    LEU   9           H        LEU   9  -7.998  -1.885  -1.799
   78    HA   LEU   9           HA       LEU   9  -5.832  -3.413  -0.620
   79    HB2  LEU   9           2HB      LEU   9  -7.357  -3.426  -3.077
   80    HB3  LEU   9           1HB      LEU   9  -5.626  -3.581  -3.373
   81    HG   LEU   9           HG       LEU   9  -6.690  -5.799  -3.041
   82   HD11  LEU   9          1HD1      LEU   9  -4.975  -6.642  -1.707
   83   HD12  LEU   9          2HD1      LEU   9  -5.060  -5.299  -0.568
   84   HD13  LEU   9          3HD1      LEU   9  -4.313  -5.071  -2.150
   85   HD21  LEU   9          3HD2      LEU   9  -7.281  -4.762  -0.250
   86   HD22  LEU   9          1HD2      LEU   9  -7.664  -6.362  -0.882
   87   HD23  LEU   9          2HD2      LEU   9  -8.485  -4.943  -1.525
   88    H    HIS  10           H        HIS  10  -6.116  -1.119  -3.256
   89    HA   HIS  10           HA       HIS  10  -3.518  -0.608  -3.913
   90    HB2  HIS  10           2HB      HIS  10  -5.827   1.291  -3.547
   91    HB3  HIS  10           1HB      HIS  10  -4.242   1.866  -4.059
   92    HD1  HIS  10           1HD      HIS  10  -5.392   2.474  -6.400
   93    HD2  HIS  10           2HD      HIS  10  -5.214  -1.603  -5.516
   94    HE1  HIS  10           1HE      HIS  10  -5.897   1.248  -8.557
   95    HE2  HIS  10           2HE      HIS  10  -5.782  -1.239  -8.041
   96    H    HIS  11           H        HIS  11  -5.292   0.385  -1.156
   97    HA   HIS  11           HA       HIS  11  -3.814   2.210   0.183
   98    HB2  HIS  11           2HB      HIS  11  -5.633   0.011   0.790
   99    HB3  HIS  11           1HB      HIS  11  -4.529   0.396   2.126
  100    HD1  HIS  11           1HD      HIS  11  -4.757   2.727   3.252
  101    HD2  HIS  11           2HD      HIS  11  -7.394   2.182   0.062
  102    HE1  HIS  11           1HE      HIS  11  -6.389   4.673   3.315
  103    HE2  HIS  11           2HE      HIS  11  -8.007   4.348   1.385
  104    H    LEU  12           H        LEU  12  -3.262  -1.233  -0.062
  105    HA   LEU  12           HA       LEU  12  -0.906  -1.169   1.632
  106    HB2  LEU  12           2HB      LEU  12  -2.318  -3.300   0.041
  107    HB3  LEU  12           1HB      LEU  12  -0.693  -3.581   0.659
  108    HG   LEU  12           HG       LEU  12  -1.655  -2.757   2.940
  109   HD11  LEU  12          1HD1      LEU  12  -3.797  -1.976   2.564
  110   HD12  LEU  12          2HD1      LEU  12  -4.176  -3.661   2.912
  111   HD13  LEU  12          3HD1      LEU  12  -4.091  -3.110   1.241
  112   HD21  LEU  12          3HD2      LEU  12  -2.590  -5.116   3.338
  113   HD22  LEU  12          1HD2      LEU  12  -0.945  -5.029   2.709
  114   HD23  LEU  12          2HD2      LEU  12  -2.282  -5.412   1.628
  115    H    ALA  13           H        ALA  13  -1.723  -1.538  -1.744
  116    HA   ALA  13           HA       ALA  13   0.824  -1.881  -2.855
  117    HB1  ALA  13           1HB      ALA  13  -0.089  -1.063  -4.923
  118    HB2  ALA  13           2HB      ALA  13  -1.353  -0.165  -4.083
  119    HB3  ALA  13           3HB      ALA  13  -1.391  -1.930  -4.110
  120    H    HIS  14           H        HIS  14  -0.820   0.848  -1.549
  121    HA   HIS  14           HA       HIS  14   0.958   2.897  -2.418
  122    HB2  HIS  14           2HB      HIS  14  -1.050   3.743  -1.742
  123    HB3  HIS  14           1HB      HIS  14  -1.221   2.625  -0.406
  124    HD1  HIS  14           1HD      HIS  14   1.231   5.422  -1.328
  125    HD2  HIS  14           2HD      HIS  14  -0.830   3.903   1.964
  126    HE1  HIS  14           1HE      HIS  14   1.837   6.896   0.642
  127    HE2  HIS  14           2HE      HIS  14   0.610   5.972   2.664
  128    H    LEU  15           H        LEU  15   0.585   1.115   0.606
  129    HA   LEU  15           HA       LEU  15   2.828   2.190   1.948
  130    HB2  LEU  15           2HB      LEU  15   1.397  -0.467   2.054
  131    HB3  LEU  15           1HB      LEU  15   2.866  -0.213   2.985
  132    HG   LEU  15           HG       LEU  15   1.798   1.067   4.525
  133   HD11  LEU  15          1HD1      LEU  15   0.014   2.736   3.921
  134   HD12  LEU  15          2HD1      LEU  15   0.222   2.265   2.236
  135   HD13  LEU  15          3HD1      LEU  15   1.553   3.019   3.114
  136   HD21  LEU  15          3HD2      LEU  15   0.270  -0.947   3.952
  137   HD22  LEU  15          1HD2      LEU  15  -0.786   0.255   3.207
  138   HD23  LEU  15          2HD2      LEU  15  -0.414   0.354   4.928
  139    H    ALA  16           H        ALA  16   2.270  -0.225  -0.390
  140    HA   ALA  16           HA       ALA  16   4.906  -1.328  -0.461
  141    HB1  ALA  16           1HB      ALA  16   2.551  -2.116  -1.523
  142    HB2  ALA  16           2HB      ALA  16   4.110  -2.698  -2.101
  143    HB3  ALA  16           3HB      ALA  16   3.294  -1.386  -2.946
  144    H    LEU  17           H        LEU  17   3.339   1.368  -1.977
  145    HA   LEU  17           HA       LEU  17   5.151   1.876  -4.038
  146    HB2  LEU  17           2HB      LEU  17   3.464   3.319  -4.405
  147    HB3  LEU  17           1HB      LEU  17   2.985   3.308  -2.719
  148    HG   LEU  17           HG       LEU  17   5.496   4.778  -3.282
  149   HD11  LEU  17          1HD1      LEU  17   2.859   5.966  -4.165
  150   HD12  LEU  17          2HD1      LEU  17   4.059   5.306  -5.276
  151   HD13  LEU  17          3HD1      LEU  17   4.460   6.700  -4.273
  152   HD21  LEU  17          3HD2      LEU  17   4.798   6.110  -1.520
  153   HD22  LEU  17          1HD2      LEU  17   3.957   4.614  -1.118
  154   HD23  LEU  17          2HD2      LEU  17   3.091   5.923  -1.917
  155    H    HIS  18           H        HIS  18   5.140   3.135  -0.719
  156    HA   HIS  18           HA       HIS  18   7.671   4.462  -1.202
  157    HB2  HIS  18           2HB      HIS  18   7.644   5.082   1.095
  158    HB3  HIS  18           1HB      HIS  18   6.024   5.249   0.448
  159    HD1  HIS  18           1HD      HIS  18   8.035   3.158   2.815
  160    HD2  HIS  18           2HD      HIS  18   4.112   3.487   1.429
  161    HE1  HIS  18           1HE      HIS  18   6.611   1.745   4.367
  162    HE2  HIS  18           2HE      HIS  18   4.208   1.953   3.558
  163    H    LEU  19           H        LEU  19   6.547   1.578   0.397
  164    HA   LEU  19           HA       LEU  19   8.924   0.573   1.439
  165    HB2  LEU  19           2HB      LEU  19   6.377  -0.509   0.708
  166    HB3  LEU  19           1HB      LEU  19   7.616  -1.555   0.030
  167    HG   LEU  19           HG       LEU  19   7.142  -2.367   2.220
  168   HD11  LEU  19          1HD1      LEU  19   9.605  -0.719   2.707
  169   HD12  LEU  19          2HD1      LEU  19   9.607  -1.969   1.460
  170   HD13  LEU  19          3HD1      LEU  19   9.292  -2.397   3.143
  171   HD21  LEU  19          3HD2      LEU  19   7.850   0.254   3.482
  172   HD22  LEU  19          1HD2      LEU  19   6.867  -1.061   4.122
  173   HD23  LEU  19          2HD2      LEU  19   6.215  -0.002   2.870
  174    H    ALA  20           H        ALA  20   7.700   0.846  -1.772
  175    HA   ALA  20           HA       ALA  20   9.731  -0.680  -3.132
  176    HB1  ALA  20           1HB      ALA  20   8.191   1.576  -4.395
  177    HB2  ALA  20           2HB      ALA  20   7.399   0.047  -4.016
  178    HB3  ALA  20           3HB      ALA  20   8.760   0.085  -5.133
  179    H    LEU  21           H        LEU  21   9.091   2.764  -2.835
  180    HA   LEU  21           HA       LEU  21  11.317   3.828  -4.049
  181    HB2  LEU  21           2HB      LEU  21   9.471   4.744  -1.953
  182    HB3  LEU  21           1HB      LEU  21  11.079   5.445  -1.815
  183    HG   LEU  21           HG       LEU  21   9.741   6.885  -3.234
  184   HD11  LEU  21          1HD1      LEU  21  12.190   5.856  -3.931
  185   HD12  LEU  21          2HD1      LEU  21  11.398   7.203  -4.746
  186   HD13  LEU  21          3HD1      LEU  21  11.246   5.574  -5.395
  187   HD21  LEU  21          3HD2      LEU  21   8.106   5.102  -3.911
  188   HD22  LEU  21          1HD2      LEU  21   9.322   4.476  -5.029
  189   HD23  LEU  21          2HD2      LEU  21   8.664   6.094  -5.256
  190    H    ALA  22           H        ALA  22  10.974   2.868  -0.676
  191    HA   ALA  22           HA       ALA  22  13.641   3.310   0.110
  192    HB1  ALA  22           1HB      ALA  22  11.554   1.393   1.155
  193    HB2  ALA  22           2HB      ALA  22  12.010   2.959   1.825
  194    HB3  ALA  22           3HB      ALA  22  13.133   1.604   1.913
  195    H    LEU  23           H        LEU  23  12.048   0.564  -1.358
  196    HA   LEU  23           HA       LEU  23  14.212  -1.264  -1.215
  197    HB2  LEU  23           2HB      LEU  23  11.710  -1.673  -1.851
  198    HB3  LEU  23           1HB      LEU  23  12.239  -1.248  -3.479
  199    HG   LEU  23           HG       LEU  23  14.204  -3.003  -2.778
  200   HD11  LEU  23          1HD1      LEU  23  12.800  -3.359  -0.610
  201   HD12  LEU  23          2HD1      LEU  23  13.386  -4.783  -1.471
  202   HD13  LEU  23          3HD1      LEU  23  11.708  -4.275  -1.657
  203   HD21  LEU  23          3HD2      LEU  23  12.767  -4.716  -4.026
  204   HD22  LEU  23          1HD2      LEU  23  13.034  -3.186  -4.862
  205   HD23  LEU  23          2HD2      LEU  23  11.500  -3.493  -4.046
  206    H    LYS  24           H        LYS  24  13.066   0.945  -3.676
  207    HA   LYS  24           HA       LYS  24  15.111   0.484  -5.586
  208    HB2  LYS  24           2HB      LYS  24  12.790   1.715  -5.784
  209    HB3  LYS  24           1HB      LYS  24  13.731   3.136  -5.336
  210    HG2  LYS  24           2HG      LYS  24  15.231   1.754  -7.321
  211    HG3  LYS  24           1HG      LYS  24  13.565   1.826  -7.896
  212    HD2  LYS  24           2HD      LYS  24  14.992   4.254  -6.783
  213    HD3  LYS  24           1HD      LYS  24  15.050   3.836  -8.496
  214    HE2  LYS  24           2HE      LYS  24  12.510   4.308  -6.898
  215    HE3  LYS  24           1HE      LYS  24  13.248   5.473  -7.995
  216    HZ1  LYS  24           3HZ      LYS  24  11.606   4.405  -9.230
  217    HZ2  LYS  24           1HZ      LYS  24  12.010   2.869  -8.652
  218    HZ3  LYS  24           2HZ      LYS  24  13.049   3.664  -9.736
  219    H    LYS  25           H        LYS  25  14.638   3.032  -3.197
  220    HA   LYS  25           HA       LYS  25  17.442   3.255  -2.627
  221    HB2  LYS  25           2HB      LYS  25  17.264   4.536  -4.777
  222    HB3  LYS  25           1HB      LYS  25  16.121   5.619  -3.982
  223    HG2  LYS  25           2HG      LYS  25  18.092   5.702  -2.157
  224    HG3  LYS  25           1HG      LYS  25  19.062   5.333  -3.577
  225    HD2  LYS  25           2HD      LYS  25  18.897   7.459  -4.296
  226    HD3  LYS  25           1HD      LYS  25  17.137   7.379  -4.242
  227    HE2  LYS  25           2HE      LYS  25  18.881   7.874  -1.810
  228    HE3  LYS  25           1HE      LYS  25  18.124   9.157  -2.754
  229    HZ1  LYS  25           3HZ      LYS  25  16.987   7.469  -0.766
  230    HZ2  LYS  25           1HZ      LYS  25  16.126   7.339  -2.228
  231    HZ3  LYS  25           2HZ      LYS  25  16.333   8.856  -1.508
  232    H    ALA  26           H        ALA  26  17.607   3.861  -0.554
  233    HA   ALA  26           HA       ALA  26  15.275   4.569   0.959
  234    HB1  ALA  26           1HB      ALA  26  16.756   4.617   2.864
  235    HB2  ALA  26           2HB      ALA  26  18.173   4.705   1.817
  236    HB3  ALA  26           3HB      ALA  26  17.199   3.237   1.862
  Start of MODEL    3
    1    H1   LYS   1           1HT      LYS   1 -12.889  18.422  -0.765
    2    H2   LYS   1           2HT      LYS   1 -12.219  17.480   0.479
    3    H3   LYS   1           3HT      LYS   1 -13.339  16.797  -0.595
    4    HA   LYS   1           HA       LYS   1 -11.669  17.405  -2.408
    5    HB2  LYS   1           2HB      LYS   1  -9.565  16.949  -0.370
    6    HB3  LYS   1           1HB      LYS   1  -9.536  17.972  -1.804
    7    HG2  LYS   1           2HG      LYS   1 -11.054  19.590  -0.554
    8    HG3  LYS   1           1HG      LYS   1 -10.777  18.610   0.887
    9    HD2  LYS   1           2HD      LYS   1  -8.410  19.033   0.826
   10    HD3  LYS   1           1HD      LYS   1  -8.532  19.794  -0.760
   11    HE2  LYS   1           2HE      LYS   1  -8.339  21.474   1.059
   12    HE3  LYS   1           1HE      LYS   1  -9.868  21.626   0.192
   13    HZ1  LYS   1           2HZ      LYS   1 -11.041  20.980   1.985
   14    HZ2  LYS   1           3HZ      LYS   1  -9.660  21.453   2.857
   15    HZ3  LYS   1           1HZ      LYS   1  -9.898  19.821   2.467
   16    H    LYS   2           H        LYS   2  -9.485  15.647  -2.114
   17    HA   LYS   2           HA       LYS   2 -10.922  13.105  -2.028
   18    HB2  LYS   2           2HB      LYS   2  -8.057  13.697  -2.827
   19    HB3  LYS   2           1HB      LYS   2  -8.909  12.169  -3.060
   20    HG2  LYS   2           2HG      LYS   2 -10.652  13.556  -4.365
   21    HG3  LYS   2           1HG      LYS   2  -9.429  14.824  -4.408
   22    HD2  LYS   2           2HD      LYS   2  -8.895  11.986  -5.319
   23    HD3  LYS   2           1HD      LYS   2  -9.444  13.255  -6.412
   24    HE2  LYS   2           2HE      LYS   2  -6.869  13.192  -4.811
   25    HE3  LYS   2           1HE      LYS   2  -7.043  13.183  -6.566
   26    HZ1  LYS   2           3HZ      LYS   2  -6.548  15.382  -6.051
   27    HZ2  LYS   2           1HZ      LYS   2  -7.542  15.401  -4.683
   28    HZ3  LYS   2           2HZ      LYS   2  -8.232  15.399  -6.232
   29    H    ALA   3           H        ALA   3  -7.792  12.336  -1.415
   30    HA   ALA   3           HA       ALA   3  -6.798  11.324   0.402
   31    HB1  ALA   3           1HB      ALA   3  -7.732  13.936   1.609
   32    HB2  ALA   3           2HB      ALA   3  -6.167  13.608   0.864
   33    HB3  ALA   3           3HB      ALA   3  -6.597  12.837   2.389
   34    H    LEU   4           H        LEU   4  -9.626  10.652  -0.012
   35    HA   LEU   4           HA       LEU   4 -10.677  10.363   2.693
   36    HB2  LEU   4           2HB      LEU   4 -12.439   8.955   1.293
   37    HB3  LEU   4           1HB      LEU   4 -12.494  10.713   1.337
   38    HG   LEU   4           HG       LEU   4 -11.271  10.830  -0.787
   39   HD11  LEU   4          1HD1      LEU   4 -11.197   8.429  -1.969
   40   HD12  LEU   4          2HD1      LEU   4 -10.999   7.894  -0.305
   41   HD13  LEU   4          3HD1      LEU   4  -9.846   9.024  -1.008
   42   HD21  LEU   4          3HD2      LEU   4 -13.508   8.810  -1.057
   43   HD22  LEU   4          1HD2      LEU   4 -13.040  10.060  -2.210
   44   HD23  LEU   4          2HD2      LEU   4 -13.795  10.507  -0.683
   45    H    LEU   5           H        LEU   5 -11.659   8.054   3.092
   46    HA   LEU   5           HA       LEU   5  -9.473   6.133   2.565
   47    HB2  LEU   5           2HB      LEU   5 -10.316   6.970   5.011
   48    HB3  LEU   5           1HB      LEU   5 -11.353   5.562   4.773
   49    HG   LEU   5           HG       LEU   5  -9.197   4.328   4.052
   50   HD11  LEU   5          1HD1      LEU   5  -7.285   5.508   5.578
   51   HD12  LEU   5          2HD1      LEU   5  -8.144   6.937   5.004
   52   HD13  LEU   5          3HD1      LEU   5  -7.457   5.801   3.847
   53   HD21  LEU   5          3HD2      LEU   5  -8.767   3.664   6.307
   54   HD22  LEU   5          1HD2      LEU   5 -10.473   4.086   6.237
   55   HD23  LEU   5          2HD2      LEU   5  -9.316   5.217   6.943
   56    H    ALA   6           H        ALA   6  -9.939   4.372   1.469
   57    HA   ALA   6           HA       ALA   6 -12.516   3.102   1.496
   58    HB1  ALA   6           1HB      ALA   6 -13.289   3.592  -0.626
   59    HB2  ALA   6           2HB      ALA   6 -11.680   3.979  -1.234
   60    HB3  ALA   6           3HB      ALA   6 -12.537   5.131  -0.213
   61    H    LEU   7           H        LEU   7 -12.270   1.645  -0.860
   62    HA   LEU   7           HA       LEU   7 -11.303  -0.318  -1.569
   63    HB2  LEU   7           2HB      LEU   7  -8.622   0.997  -1.191
   64    HB3  LEU   7           1HB      LEU   7  -9.148  -0.087  -2.478
   65    HG   LEU   7           HG       LEU   7 -10.866   2.207  -2.502
   66   HD11  LEU   7          1HD1      LEU   7  -9.179   3.966  -2.978
   67   HD12  LEU   7          2HD1      LEU   7  -7.901   2.849  -2.500
   68   HD13  LEU   7          3HD1      LEU   7  -9.084   3.395  -1.315
   69   HD21  LEU   7          3HD2      LEU   7  -8.665   1.285  -4.379
   70   HD22  LEU   7          1HD2      LEU   7  -9.896   2.480  -4.780
   71   HD23  LEU   7          2HD2      LEU   7 -10.362   0.812  -4.453
   72    H    ALA   8           H        ALA   8  -8.749  -1.415  -0.909
   73    HA   ALA   8           HA       ALA   8  -8.505  -1.571   1.958
   74    HB1  ALA   8           1HB      ALA   8  -9.472  -4.056   0.541
   75    HB2  ALA   8           2HB      ALA   8 -10.511  -3.007   1.503
   76    HB3  ALA   8           3HB      ALA   8  -9.170  -3.856   2.266
   77    H    LEU   9           H        LEU   9  -7.693  -2.870  -1.189
   78    HA   LEU   9           HA       LEU   9  -5.189  -4.007  -0.169
   79    HB2  LEU   9           2HB      LEU   9  -6.387  -4.041  -2.931
   80    HB3  LEU   9           1HB      LEU   9  -4.935  -4.900  -2.433
   81    HG   LEU   9           HG       LEU   9  -6.483  -6.604  -2.177
   82   HD11  LEU   9          1HD1      LEU   9  -6.971  -6.901   0.145
   83   HD12  LEU   9          2HD1      LEU   9  -6.989  -5.161   0.429
   84   HD13  LEU   9          3HD1      LEU   9  -5.468  -5.979   0.066
   85   HD21  LEU   9          3HD2      LEU   9  -8.838  -5.912  -1.129
   86   HD22  LEU   9          1HD2      LEU   9  -8.519  -5.743  -2.853
   87   HD23  LEU   9          2HD2      LEU   9  -8.403  -4.343  -1.793
   88    H    HIS  10           H        HIS  10  -6.323  -1.713  -2.578
   89    HA   HIS  10           HA       HIS  10  -3.997  -0.778  -3.693
   90    HB2  HIS  10           2HB      HIS  10  -6.525   0.566  -2.854
   91    HB3  HIS  10           1HB      HIS  10  -5.159   1.589  -3.293
   92    HD1  HIS  10           1HD      HIS  10  -4.242   1.378  -5.757
   93    HD2  HIS  10           2HD      HIS  10  -7.732  -0.794  -5.024
   94    HE1  HIS  10           1HE      HIS  10  -5.164   0.707  -8.028
   95    HE2  HIS  10           2HE      HIS  10  -7.287  -0.631  -7.592
   96    H    HIS  11           H        HIS  11  -5.344  -0.272  -0.591
   97    HA   HIS  11           HA       HIS  11  -3.964   1.643   0.706
   98    HB2  HIS  11           2HB      HIS  11  -4.925  -1.101   1.380
   99    HB3  HIS  11           1HB      HIS  11  -3.940  -0.238   2.574
  100    HD1  HIS  11           1HD      HIS  11  -5.034   1.742   3.807
  101    HD2  HIS  11           2HD      HIS  11  -7.405   0.232   0.723
  102    HE1  HIS  11           1HE      HIS  11  -7.309   2.846   4.039
  103    HE2  HIS  11           2HE      HIS  11  -8.768   1.942   2.149
  104    H    LEU  12           H        LEU  12  -2.941  -1.620   0.037
  105    HA   LEU  12           HA       LEU  12  -0.357  -1.374   1.271
  106    HB2  LEU  12           2HB      LEU  12  -1.914  -3.488   0.495
  107    HB3  LEU  12           1HB      LEU  12  -0.716  -3.449  -0.797
  108    HG   LEU  12           HG       LEU  12   0.028  -3.384   2.139
  109   HD11  LEU  12          1HD1      LEU  12  -0.801  -5.520   2.103
  110   HD12  LEU  12          2HD1      LEU  12   0.750  -5.858   1.333
  111   HD13  LEU  12          3HD1      LEU  12  -0.693  -5.641   0.346
  112   HD21  LEU  12          3HD2      LEU  12   1.549  -3.909  -0.434
  113   HD22  LEU  12          1HD2      LEU  12   2.214  -4.199   1.171
  114   HD23  LEU  12          2HD2      LEU  12   1.780  -2.563   0.683
  115    H    ALA  13           H        ALA  13  -1.662  -1.281  -1.957
  116    HA   ALA  13           HA       ALA  13   0.667  -1.150  -3.484
  117    HB1  ALA  13           1HB      ALA  13  -0.644  -0.348  -5.227
  118    HB2  ALA  13           2HB      ALA  13  -1.590   0.698  -4.170
  119    HB3  ALA  13           3HB      ALA  13  -1.891  -1.039  -4.190
  120    H    HIS  14           H        HIS  14  -0.847   1.183  -1.447
  121    HA   HIS  14           HA       HIS  14   0.706   3.452  -2.278
  122    HB2  HIS  14           2HB      HIS  14  -1.135   4.238  -1.278
  123    HB3  HIS  14           1HB      HIS  14  -1.352   2.823  -0.276
  124    HD1  HIS  14           1HD      HIS  14   1.346   5.561  -0.411
  125    HD2  HIS  14           2HD      HIS  14  -1.064   3.545   2.341
  126    HE1  HIS  14           1HE      HIS  14   1.966   6.459   1.884
  127    HE2  HIS  14           2HE      HIS  14   0.519   5.225   3.577
  128    H    LEU  15           H        LEU  15   0.714   1.322   0.537
  129    HA   LEU  15           HA       LEU  15   3.033   2.326   1.768
  130    HB2  LEU  15           2HB      LEU  15   1.766  -0.413   1.672
  131    HB3  LEU  15           1HB      LEU  15   3.314  -0.175   2.471
  132    HG   LEU  15           HG       LEU  15   2.372   0.905   4.247
  133   HD11  LEU  15          1HD1      LEU  15   0.267   1.981   2.362
  134   HD12  LEU  15          2HD1      LEU  15   1.663   2.873   2.970
  135   HD13  LEU  15          3HD1      LEU  15   0.385   2.372   4.076
  136   HD21  LEU  15          3HD2      LEU  15   0.293  -0.089   4.842
  137   HD22  LEU  15          1HD2      LEU  15   1.070  -1.250   3.767
  138   HD23  LEU  15          2HD2      LEU  15  -0.212  -0.203   3.156
  139    H    ALA  16           H        ALA  16   2.340   0.109  -0.750
  140    HA   ALA  16           HA       ALA  16   4.940  -0.903  -1.201
  141    HB1  ALA  16           1HB      ALA  16   2.491  -1.447  -2.244
  142    HB2  ALA  16           2HB      ALA  16   4.003  -2.027  -2.937
  143    HB3  ALA  16           3HB      ALA  16   3.234  -0.578  -3.583
  144    H    LEU  17           H        LEU  17   3.343   2.005  -2.227
  145    HA   LEU  17           HA       LEU  17   5.105   2.760  -4.268
  146    HB2  LEU  17           2HB      LEU  17   3.612   4.430  -4.438
  147    HB3  LEU  17           1HB      LEU  17   2.873   3.912  -2.933
  148    HG   LEU  17           HG       LEU  17   4.623   5.288  -1.707
  149   HD11  LEU  17          1HD1      LEU  17   5.179   7.141  -3.785
  150   HD12  LEU  17          2HD1      LEU  17   5.606   5.545  -4.401
  151   HD13  LEU  17          3HD1      LEU  17   6.327   6.139  -2.904
  152   HD21  LEU  17          3HD2      LEU  17   3.390   7.317  -1.959
  153   HD22  LEU  17          1HD2      LEU  17   2.243   6.014  -2.266
  154   HD23  LEU  17          2HD2      LEU  17   2.935   6.915  -3.614
  155    H    HIS  18           H        HIS  18   5.154   3.526  -0.811
  156    HA   HIS  18           HA       HIS  18   7.737   4.810  -1.192
  157    HB2  HIS  18           2HB      HIS  18   7.747   5.207   1.180
  158    HB3  HIS  18           1HB      HIS  18   6.232   5.666   0.453
  159    HD1  HIS  18           1HD      HIS  18   7.715   3.212   2.838
  160    HD2  HIS  18           2HD      HIS  18   3.965   4.247   1.319
  161    HE1  HIS  18           1HE      HIS  18   6.000   2.127   4.357
  162    HE2  HIS  18           2HE      HIS  18   3.709   2.786   3.480
  163    H    LEU  19           H        LEU  19   6.473   1.874   0.157
  164    HA   LEU  19           HA       LEU  19   8.853   0.713   1.099
  165    HB2  LEU  19           2HB      LEU  19   6.268  -0.315   0.140
  166    HB3  LEU  19           1HB      LEU  19   7.614  -1.411  -0.136
  167    HG   LEU  19           HG       LEU  19   8.198  -1.409   2.191
  168   HD11  LEU  19          1HD1      LEU  19   6.494  -0.026   3.687
  169   HD12  LEU  19          2HD1      LEU  19   6.357   0.945   2.224
  170   HD13  LEU  19          3HD1      LEU  19   7.926   0.750   3.007
  171   HD21  LEU  19          3HD2      LEU  19   6.433  -2.949   1.772
  172   HD22  LEU  19          1HD2      LEU  19   5.239  -1.660   1.637
  173   HD23  LEU  19          2HD2      LEU  19   5.927  -2.063   3.210
  174    H    ALA  20           H        ALA  20   7.555   1.257  -2.057
  175    HA   ALA  20           HA       ALA  20   9.325  -0.407  -3.549
  176    HB1  ALA  20           1HB      ALA  20   7.358   0.566  -4.633
  177    HB2  ALA  20           2HB      ALA  20   8.816   1.070  -5.479
  178    HB3  ALA  20           3HB      ALA  20   8.003   2.186  -4.392
  179    H    LEU  21           H        LEU  21   9.390   3.062  -3.044
  180    HA   LEU  21           HA       LEU  21  11.950   3.592  -4.002
  181    HB2  LEU  21           2HB      LEU  21  10.563   4.929  -1.665
  182    HB3  LEU  21           1HB      LEU  21  11.862   5.619  -2.643
  183    HG   LEU  21           HG       LEU  21   9.163   4.783  -3.759
  184   HD11  LEU  21          1HD1      LEU  21   8.997   7.362  -4.018
  185   HD12  LEU  21          2HD1      LEU  21  10.221   7.414  -2.749
  186   HD13  LEU  21          3HD1      LEU  21   8.660   6.656  -2.438
  187   HD21  LEU  21          3HD2      LEU  21  10.041   6.292  -5.649
  188   HD22  LEU  21          1HD2      LEU  21  10.810   4.716  -5.483
  189   HD23  LEU  21          2HD2      LEU  21  11.612   6.160  -4.869
  190    H    ALA  22           H        ALA  22  10.832   2.767  -0.788
  191    HA   ALA  22           HA       ALA  22  13.251   2.841   0.600
  192    HB1  ALA  22           1HB      ALA  22  11.034   0.837   1.068
  193    HB2  ALA  22           2HB      ALA  22  10.973   2.512   1.617
  194    HB3  ALA  22           3HB      ALA  22  12.211   1.425   2.247
  195    H    LEU  23           H        LEU  23  11.775   0.190  -1.213
  196    HA   LEU  23           HA       LEU  23  13.885  -1.667  -0.681
  197    HB2  LEU  23           2HB      LEU  23  11.463  -1.608  -2.385
  198    HB3  LEU  23           1HB      LEU  23  12.772  -2.627  -2.977
  199    HG   LEU  23           HG       LEU  23  11.361  -3.994  -1.571
  200   HD11  LEU  23          1HD1      LEU  23  13.014  -4.935  -0.272
  201   HD12  LEU  23          2HD1      LEU  23  13.531  -3.386   0.387
  202   HD13  LEU  23          3HD1      LEU  23  14.019  -3.858  -1.242
  203   HD21  LEU  23          3HD2      LEU  23  11.583  -1.654   0.314
  204   HD22  LEU  23          1HD2      LEU  23  11.179  -3.261   0.921
  205   HD23  LEU  23          2HD2      LEU  23  10.131  -2.475  -0.262
  206    H    LYS  24           H        LYS  24  13.084   0.411  -3.402
  207    HA   LYS  24           HA       LYS  24  15.361  -0.356  -4.965
  208    HB2  LYS  24           2HB      LYS  24  13.128   0.728  -5.741
  209    HB3  LYS  24           1HB      LYS  24  13.907   2.252  -5.310
  210    HG2  LYS  24           2HG      LYS  24  15.845   0.806  -6.753
  211    HG3  LYS  24           1HG      LYS  24  14.341   0.566  -7.631
  212    HD2  LYS  24           2HD      LYS  24  15.101   2.558  -8.579
  213    HD3  LYS  24           1HD      LYS  24  14.053   3.164  -7.302
  214    HE2  LYS  24           2HE      LYS  24  16.373   4.238  -7.480
  215    HE3  LYS  24           1HE      LYS  24  15.896   3.667  -5.883
  216    HZ1  LYS  24           3HZ      LYS  24  18.198   3.045  -6.980
  217    HZ2  LYS  24           1HZ      LYS  24  17.279   1.770  -7.612
  218    HZ3  LYS  24           2HZ      LYS  24  17.385   1.986  -5.927
  219    H    LYS  25           H        LYS  25  14.867   1.774  -2.351
  220    HA   LYS  25           HA       LYS  25  16.180   3.271  -1.262
  221    HB2  LYS  25           2HB      LYS  25  17.787   1.514  -1.009
  222    HB3  LYS  25           1HB      LYS  25  18.302   1.643  -2.686
  223    HG2  LYS  25           2HG      LYS  25  19.854   2.663  -0.927
  224    HG3  LYS  25           1HG      LYS  25  19.444   3.687  -2.290
  225    HD2  LYS  25           2HD      LYS  25  17.425   4.325  -0.531
  226    HD3  LYS  25           1HD      LYS  25  18.750   3.981   0.575
  227    HE2  LYS  25           2HE      LYS  25  18.669   6.375  -0.110
  228    HE3  LYS  25           1HE      LYS  25  20.174   5.583  -0.568
  229    HZ1  LYS  25           3HZ      LYS  25  19.697   6.497  -2.550
  230    HZ2  LYS  25           1HZ      LYS  25  18.030   6.612  -2.237
  231    HZ3  LYS  25           2HZ      LYS  25  18.707   5.132  -2.745
  232    H    ALA  26           H        ALA  26  15.040   4.796  -2.697
  233    HA   ALA  26           HA       ALA  26  16.603   5.915  -4.896
  234    HB1  ALA  26           1HB      ALA  26  14.081   5.593  -4.971
  235    HB2  ALA  26           2HB      ALA  26  14.670   7.188  -5.429
  236    HB3  ALA  26           3HB      ALA  26  13.971   6.940  -3.831
  Start of MODEL    4
    1    H1   LYS   1           1HT      LYS   1 -26.166  -7.894   3.405
    2    H2   LYS   1           2HT      LYS   1 -26.186  -6.584   2.330
    3    H3   LYS   1           3HT      LYS   1 -25.650  -6.370   3.922
    4    HA   LYS   1           HA       LYS   1 -23.949  -8.221   3.245
    5    HB2  LYS   1           2HB      LYS   1 -23.221  -7.541   0.841
    6    HB3  LYS   1           1HB      LYS   1 -24.578  -8.655   1.016
    7    HG2  LYS   1           2HG      LYS   1 -26.156  -7.038   0.441
    8    HG3  LYS   1           1HG      LYS   1 -25.110  -5.700   0.913
    9    HD2  LYS   1           2HD      LYS   1 -23.630  -6.192  -1.017
   10    HD3  LYS   1           1HD      LYS   1 -24.715  -7.493  -1.501
   11    HE2  LYS   1           2HE      LYS   1 -24.912  -4.734  -2.167
   12    HE3  LYS   1           1HE      LYS   1 -26.031  -6.026  -2.585
   13    HZ1  LYS   1           2HZ      LYS   1 -27.160  -5.694  -0.482
   14    HZ2  LYS   1           3HZ      LYS   1 -27.132  -4.252  -1.370
   15    HZ3  LYS   1           1HZ      LYS   1 -26.072  -4.456  -0.061
   16    H    LYS   2           H        LYS   2 -22.274  -7.330   4.247
   17    HA   LYS   2           HA       LYS   2 -21.646  -4.483   3.724
   18    HB2  LYS   2           2HB      LYS   2 -21.120  -5.890   6.348
   19    HB3  LYS   2           1HB      LYS   2 -21.061  -4.159   6.006
   20    HG2  LYS   2           2HG      LYS   2 -23.549  -4.329   5.434
   21    HG3  LYS   2           1HG      LYS   2 -23.505  -5.936   6.150
   22    HD2  LYS   2           2HD      LYS   2 -24.092  -4.707   8.022
   23    HD3  LYS   2           1HD      LYS   2 -22.337  -4.636   8.160
   24    HE2  LYS   2           2HE      LYS   2 -23.486  -2.408   8.423
   25    HE3  LYS   2           1HE      LYS   2 -22.268  -2.450   7.149
   26    HZ1  LYS   2           3HZ      LYS   2 -24.973  -3.167   6.359
   27    HZ2  LYS   2           1HZ      LYS   2 -23.808  -2.246   5.541
   28    HZ3  LYS   2           2HZ      LYS   2 -24.731  -1.543   6.783
   29    H    ALA   3           H        ALA   3 -19.282  -4.130   4.739
   30    HA   ALA   3           HA       ALA   3 -17.055  -4.401   4.231
   31    HB1  ALA   3           1HB      ALA   3 -17.280  -5.948   6.122
   32    HB2  ALA   3           2HB      ALA   3 -16.112  -6.555   4.952
   33    HB3  ALA   3           3HB      ALA   3 -17.734  -7.249   5.013
   34    H    LEU   4           H        LEU   4 -17.693  -3.993   1.941
   35    HA   LEU   4           HA       LEU   4 -16.567  -6.089   0.268
   36    HB2  LEU   4           2HB      LEU   4 -18.414  -6.279  -1.246
   37    HB3  LEU   4           1HB      LEU   4 -19.047  -6.560   0.373
   38    HG   LEU   4           HG       LEU   4 -19.367  -3.861   0.207
   39   HD11  LEU   4          1HD1      LEU   4 -20.515  -3.803  -2.225
   40   HD12  LEU   4          2HD1      LEU   4 -19.218  -4.944  -2.573
   41   HD13  LEU   4          3HD1      LEU   4 -18.839  -3.333  -1.967
   42   HD21  LEU   4          3HD2      LEU   4 -21.562  -5.324  -1.112
   43   HD22  LEU   4          1HD2      LEU   4 -21.560  -4.413   0.394
   44   HD23  LEU   4          2HD2      LEU   4 -20.993  -6.082   0.379
   45    H    LEU   5           H        LEU   5 -17.777  -2.841   0.700
   46    HA   LEU   5           HA       LEU   5 -16.807  -1.865  -1.844
   47    HB2  LEU   5           2HB      LEU   5 -18.624  -0.959   0.073
   48    HB3  LEU   5           1HB      LEU   5 -17.278   0.170   0.194
   49    HG   LEU   5           HG       LEU   5 -17.381   0.218  -2.410
   50   HD11  LEU   5          1HD1      LEU   5 -19.991  -0.027  -2.944
   51   HD12  LEU   5          2HD1      LEU   5 -19.897  -1.211  -1.637
   52   HD13  LEU   5          3HD1      LEU   5 -18.890  -1.398  -3.075
   53   HD21  LEU   5          3HD2      LEU   5 -19.124   1.997  -2.300
   54   HD22  LEU   5          1HD2      LEU   5 -17.940   2.136  -1.001
   55   HD23  LEU   5          2HD2      LEU   5 -19.541   1.465  -0.673
   56    H    ALA   6           H        ALA   6 -15.631   0.509  -1.204
   57    HA   ALA   6           HA       ALA   6 -13.644   1.511  -0.659
   58    HB1  ALA   6           1HB      ALA   6 -12.784   1.171   1.439
   59    HB2  ALA   6           2HB      ALA   6 -12.936  -0.584   1.334
   60    HB3  ALA   6           3HB      ALA   6 -14.360   0.410   1.654
   61    H    LEU   7           H        LEU   7 -11.194   0.944  -0.345
   62    HA   LEU   7           HA       LEU   7 -10.513  -1.356  -2.078
   63    HB2  LEU   7           2HB      LEU   7 -10.230   1.410  -2.696
   64    HB3  LEU   7           1HB      LEU   7  -8.613   0.774  -2.420
   65    HG   LEU   7           HG       LEU   7  -9.236   0.521  -4.784
   66   HD11  LEU   7          1HD1      LEU   7  -8.074  -1.372  -3.265
   67   HD12  LEU   7          2HD1      LEU   7  -8.368  -1.592  -4.989
   68   HD13  LEU   7          3HD1      LEU   7  -9.481  -2.283  -3.810
   69   HD21  LEU   7          3HD2      LEU   7 -11.738   0.359  -4.196
   70   HD22  LEU   7          1HD2      LEU   7 -11.438  -1.349  -3.894
   71   HD23  LEU   7          2HD2      LEU   7 -11.158  -0.677  -5.498
   72    H    ALA   8           H        ALA   8  -9.979  -2.535  -0.211
   73    HA   ALA   8           HA       ALA   8  -8.134  -1.588   1.754
   74    HB1  ALA   8           1HB      ALA   8  -9.595  -3.330   2.411
   75    HB2  ALA   8           2HB      ALA   8  -7.994  -4.069   2.305
   76    HB3  ALA   8           3HB      ALA   8  -9.167  -4.313   1.012
   77    H    LEU   9           H        LEU   9  -7.810  -2.781  -1.355
   78    HA   LEU   9           HA       LEU   9  -5.228  -4.009  -1.143
   79    HB2  LEU   9           2HB      LEU   9  -7.196  -3.427  -3.188
   80    HB3  LEU   9           1HB      LEU   9  -5.539  -3.221  -3.756
   81    HG   LEU   9           HG       LEU   9  -6.557  -5.683  -2.311
   82   HD11  LEU   9          1HD1      LEU   9  -6.509  -6.788  -4.480
   83   HD12  LEU   9          2HD1      LEU   9  -5.942  -5.309  -5.256
   84   HD13  LEU   9          3HD1      LEU   9  -7.568  -5.382  -4.574
   85   HD21  LEU   9          3HD2      LEU   9  -4.351  -6.097  -2.065
   86   HD22  LEU   9          1HD2      LEU   9  -3.919  -4.700  -3.051
   87   HD23  LEU   9          2HD2      LEU   9  -4.262  -6.250  -3.820
   88    H    HIS  10           H        HIS  10  -6.212  -1.145  -2.957
   89    HA   HIS  10           HA       HIS  10  -3.882   0.007  -3.677
   90    HB2  HIS  10           2HB      HIS  10  -6.427   1.178  -2.660
   91    HB3  HIS  10           1HB      HIS  10  -5.038   2.251  -2.783
   92    HD1  HIS  10           1HD      HIS  10  -5.660   3.559  -4.849
   93    HD2  HIS  10           2HD      HIS  10  -5.897  -0.567  -5.446
   94    HE1  HIS  10           1HE      HIS  10  -6.037   3.214  -7.333
   95    HE2  HIS  10           2HE      HIS  10  -6.209   0.703  -7.714
   96    H    HIS  11           H        HIS  11  -5.350   0.070  -0.564
   97    HA   HIS  11           HA       HIS  11  -3.867   1.653   1.052
   98    HB2  HIS  11           2HB      HIS  11  -5.373  -0.851   1.237
   99    HB3  HIS  11           1HB      HIS  11  -4.149  -0.676   2.508
  100    HD1  HIS  11           1HD      HIS  11  -4.785   0.762   4.455
  101    HD2  HIS  11           2HD      HIS  11  -7.107   1.587   1.082
  102    HE1  HIS  11           1HE      HIS  11  -6.520   2.468   5.170
  103    HE2  HIS  11           2HE      HIS  11  -7.970   2.953   3.138
  104    H    LEU  12           H        LEU  12  -3.124  -1.591   0.005
  105    HA   LEU  12           HA       LEU  12  -0.575  -1.708   1.348
  106    HB2  LEU  12           2HB      LEU  12  -2.174  -3.491  -0.417
  107    HB3  LEU  12           1HB      LEU  12  -0.430  -3.729  -0.433
  108    HG   LEU  12           HG       LEU  12  -1.487  -5.160   1.267
  109   HD11  LEU  12          1HD1      LEU  12  -0.171  -3.123   2.971
  110   HD12  LEU  12          2HD1      LEU  12   0.755  -3.667   1.573
  111   HD13  LEU  12          3HD1      LEU  12   0.198  -4.836   2.769
  112   HD21  LEU  12          3HD2      LEU  12  -2.470  -3.991   3.293
  113   HD22  LEU  12          1HD2      LEU  12  -3.448  -3.885   1.835
  114   HD23  LEU  12          2HD2      LEU  12  -2.477  -2.503   2.350
  115    H    ALA  13           H        ALA  13  -1.716  -1.341  -1.944
  116    HA   ALA  13           HA       ALA  13   0.728  -1.249  -3.273
  117    HB1  ALA  13           1HB      ALA  13  -0.423  -0.149  -5.080
  118    HB2  ALA  13           2HB      ALA  13  -1.693   0.411  -3.990
  119    HB3  ALA  13           3HB      ALA  13  -1.538  -1.309  -4.362
  120    H    HIS  14           H        HIS  14  -0.950   1.203  -1.473
  121    HA   HIS  14           HA       HIS  14   0.691   3.397  -2.268
  122    HB2  HIS  14           2HB      HIS  14  -0.896   4.472  -1.179
  123    HB3  HIS  14           1HB      HIS  14  -1.578   2.968  -0.606
  124    HD1  HIS  14           1HD      HIS  14   1.404   5.190   0.353
  125    HD2  HIS  14           2HD      HIS  14  -1.601   2.914   2.146
  126    HE1  HIS  14           1HE      HIS  14   1.710   5.434   2.858
  127    HE2  HIS  14           2HE      HIS  14  -0.117   4.060   3.963
  128    H    LEU  15           H        LEU  15   0.549   1.472   0.653
  129    HA   LEU  15           HA       LEU  15   2.854   2.481   1.910
  130    HB2  LEU  15           2HB      LEU  15   1.313   1.097   3.154
  131    HB3  LEU  15           1HB      LEU  15   1.412  -0.187   1.952
  132    HG   LEU  15           HG       LEU  15   3.918  -0.316   2.561
  133   HD11  LEU  15          1HD1      LEU  15   3.044   1.835   4.229
  134   HD12  LEU  15          2HD1      LEU  15   4.664   1.158   4.066
  135   HD13  LEU  15          3HD1      LEU  15   3.548   0.495   5.253
  136   HD21  LEU  15          3HD2      LEU  15   2.081  -1.038   4.841
  137   HD22  LEU  15          1HD2      LEU  15   3.466  -1.936   4.222
  138   HD23  LEU  15          2HD2      LEU  15   1.970  -1.875   3.291
  139    H    ALA  16           H        ALA  16   2.171   0.022  -0.342
  140    HA   ALA  16           HA       ALA  16   4.798  -1.074  -0.535
  141    HB1  ALA  16           1HB      ALA  16   3.998  -2.167  -2.571
  142    HB2  ALA  16           2HB      ALA  16   2.577  -1.125  -2.582
  143    HB3  ALA  16           3HB      ALA  16   2.797  -2.302  -1.288
  144    H    LEU  17           H        LEU  17   3.143   1.548  -2.096
  145    HA   LEU  17           HA       LEU  17   4.838   1.956  -4.263
  146    HB2  LEU  17           2HB      LEU  17   3.130   3.391  -4.578
  147    HB3  LEU  17           1HB      LEU  17   2.779   3.483  -2.863
  148    HG   LEU  17           HG       LEU  17   5.261   4.881  -3.660
  149   HD11  LEU  17          1HD1      LEU  17   3.970   5.397  -5.642
  150   HD12  LEU  17          2HD1      LEU  17   3.985   6.819  -4.602
  151   HD13  LEU  17          3HD1      LEU  17   2.554   5.791  -4.667
  152   HD21  LEU  17          3HD2      LEU  17   2.813   5.924  -2.219
  153   HD22  LEU  17          1HD2      LEU  17   4.467   6.521  -2.109
  154   HD23  LEU  17          2HD2      LEU  17   4.045   4.963  -1.407
  155    H    HIS  18           H        HIS  18   5.025   3.371  -1.004
  156    HA   HIS  18           HA       HIS  18   7.569   4.596  -1.725
  157    HB2  HIS  18           2HB      HIS  18   7.647   5.430   0.496
  158    HB3  HIS  18           1HB      HIS  18   6.007   5.571  -0.097
  159    HD1  HIS  18           1HD      HIS  18   8.078   3.592   2.322
  160    HD2  HIS  18           2HD      HIS  18   4.084   4.066   1.203
  161    HE1  HIS  18           1HE      HIS  18   6.693   2.491   4.140
  162    HE2  HIS  18           2HE      HIS  18   4.252   2.760   3.464
  163    H    LEU  19           H        LEU  19   6.427   1.869   0.100
  164    HA   LEU  19           HA       LEU  19   8.824   0.900   1.160
  165    HB2  LEU  19           2HB      LEU  19   6.239  -0.209   0.579
  166    HB3  LEU  19           1HB      LEU  19   7.463  -1.325  -0.004
  167    HG   LEU  19           HG       LEU  19   7.064  -1.928   2.251
  168   HD11  LEU  19          1HD1      LEU  19   9.223  -1.900   3.048
  169   HD12  LEU  19          2HD1      LEU  19   9.416  -0.171   2.765
  170   HD13  LEU  19          3HD1      LEU  19   9.549  -1.305   1.420
  171   HD21  LEU  19          3HD2      LEU  19   6.223   0.670   2.568
  172   HD22  LEU  19          1HD2      LEU  19   7.722   0.660   3.494
  173   HD23  LEU  19          2HD2      LEU  19   6.435  -0.482   3.883
  174    H    ALA  20           H        ALA  20   7.500   0.961  -2.023
  175    HA   ALA  20           HA       ALA  20   9.352  -0.746  -3.345
  176    HB1  ALA  20           1HB      ALA  20   8.251   1.692  -4.696
  177    HB2  ALA  20           2HB      ALA  20   7.155   0.390  -4.243
  178    HB3  ALA  20           3HB      ALA  20   8.490   0.075  -5.348
  179    H    LEU  21           H        LEU  21   9.209   2.754  -3.132
  180    HA   LEU  21           HA       LEU  21  11.691   3.371  -4.229
  181    HB2  LEU  21           2HB      LEU  21   9.882   4.700  -2.256
  182    HB3  LEU  21           1HB      LEU  21  11.523   5.318  -2.410
  183    HG   LEU  21           HG       LEU  21  11.212   5.666  -4.810
  184   HD11  LEU  21          1HD1      LEU  21   8.987   5.252  -5.838
  185   HD12  LEU  21          2HD1      LEU  21   8.444   4.521  -4.333
  186   HD13  LEU  21          3HD1      LEU  21   9.731   3.763  -5.267
  187   HD21  LEU  21          3HD2      LEU  21   9.438   7.402  -4.719
  188   HD22  LEU  21          1HD2      LEU  21  10.478   7.475  -3.296
  189   HD23  LEU  21          2HD2      LEU  21   8.881   6.734  -3.183
  190    H    ALA  22           H        ALA  22  10.779   2.553  -0.945
  191    HA   ALA  22           HA       ALA  22  13.192   2.908   0.374
  192    HB1  ALA  22           1HB      ALA  22  11.724   0.472   1.147
  193    HB2  ALA  22           2HB      ALA  22  10.753   1.943   1.098
  194    HB3  ALA  22           3HB      ALA  22  12.187   1.865   2.119
  195    H    LEU  23           H        LEU  23  12.098   0.146  -1.524
  196    HA   LEU  23           HA       LEU  23  14.270  -1.573  -0.963
  197    HB2  LEU  23           2HB      LEU  23  12.170  -1.419  -3.054
  198    HB3  LEU  23           1HB      LEU  23  13.628  -2.303  -3.497
  199    HG   LEU  23           HG       LEU  23  13.370  -3.541  -1.265
  200   HD11  LEU  23          1HD1      LEU  23  10.560  -2.445  -1.508
  201   HD12  LEU  23          2HD1      LEU  23  11.740  -1.887  -0.325
  202   HD13  LEU  23          3HD1      LEU  23  11.156  -3.550  -0.270
  203   HD21  LEU  23          3HD2      LEU  23  12.676  -4.279  -3.676
  204   HD22  LEU  23          1HD2      LEU  23  11.032  -4.033  -3.091
  205   HD23  LEU  23          2HD2      LEU  23  12.085  -5.203  -2.297
  206    H    LYS  24           H        LYS  24  13.702   0.707  -3.567
  207    HA   LYS  24           HA       LYS  24  16.434   0.448  -4.563
  208    HB2  LYS  24           2HB      LYS  24  14.059   2.098  -5.448
  209    HB3  LYS  24           1HB      LYS  24  15.651   2.216  -6.198
  210    HG2  LYS  24           2HG      LYS  24  15.227   0.389  -7.440
  211    HG3  LYS  24           1HG      LYS  24  14.978  -0.563  -5.978
  212    HD2  LYS  24           2HD      LYS  24  12.918  -0.754  -7.130
  213    HD3  LYS  24           1HD      LYS  24  12.611   0.495  -5.925
  214    HE2  LYS  24           2HE      LYS  24  11.821   1.004  -8.301
  215    HE3  LYS  24           1HE      LYS  24  12.816   2.240  -7.532
  216    HZ1  LYS  24           3HZ      LYS  24  13.294   1.242  -9.945
  217    HZ2  LYS  24           1HZ      LYS  24  14.251   0.203  -9.014
  218    HZ3  LYS  24           2HZ      LYS  24  14.509   1.878  -8.942
  219    H    LYS  25           H        LYS  25  14.746   3.484  -4.353
  220    HA   LYS  25           HA       LYS  25  16.698   4.476  -2.384
  221    HB2  LYS  25           2HB      LYS  25  16.963   6.555  -3.662
  222    HB3  LYS  25           1HB      LYS  25  17.463   5.170  -4.632
  223    HG2  LYS  25           2HG      LYS  25  15.922   5.647  -6.208
  224    HG3  LYS  25           1HG      LYS  25  14.631   5.649  -5.014
  225    HD2  LYS  25           2HD      LYS  25  16.496   7.992  -5.493
  226    HD3  LYS  25           1HD      LYS  25  14.908   7.841  -6.242
  227    HE2  LYS  25           2HE      LYS  25  15.445   7.919  -3.255
  228    HE3  LYS  25           1HE      LYS  25  14.807   9.255  -4.210
  229    HZ1  LYS  25           3HZ      LYS  25  12.890   7.885  -4.771
  230    HZ2  LYS  25           1HZ      LYS  25  13.047   8.036  -3.079
  231    HZ3  LYS  25           2HZ      LYS  25  13.522   6.597  -3.855
  232    H    ALA  26           H        ALA  26  15.821   5.764  -0.841
  233    HA   ALA  26           HA       ALA  26  12.943   6.008  -0.778
  234    HB1  ALA  26           1HB      ALA  26  15.148   6.260   1.133
  235    HB2  ALA  26           2HB      ALA  26  13.478   5.764   1.398
  236    HB3  ALA  26           3HB      ALA  26  13.896   7.478   1.358
  Start of MODEL    5
    1    H1   LYS   1           1HT      LYS   1 -22.629  -2.651  -9.120
    2    H2   LYS   1           2HT      LYS   1 -21.175  -3.087  -9.876
    3    H3   LYS   1           3HT      LYS   1 -22.439  -2.411 -10.785
    4    HA   LYS   1           HA       LYS   1 -21.829  -0.339 -10.313
    5    HB2  LYS   1           2HB      LYS   1 -21.089  -1.083  -7.477
    6    HB3  LYS   1           1HB      LYS   1 -21.628   0.479  -8.094
    7    HG2  LYS   1           2HG      LYS   1 -23.743  -1.161  -8.767
    8    HG3  LYS   1           1HG      LYS   1 -23.220  -1.842  -7.225
    9    HD2  LYS   1           2HD      LYS   1 -23.157   0.712  -6.497
   10    HD3  LYS   1           1HD      LYS   1 -24.294   0.887  -7.832
   11    HE2  LYS   1           2HE      LYS   1 -25.405   0.466  -5.613
   12    HE3  LYS   1           1HE      LYS   1 -25.807  -0.732  -6.842
   13    HZ1  LYS   1           2HZ      LYS   1 -24.467  -2.315  -5.860
   14    HZ2  LYS   1           3HZ      LYS   1 -25.111  -1.523  -4.508
   15    HZ3  LYS   1           1HZ      LYS   1 -23.532  -1.176  -5.016
   16    H    LYS   2           H        LYS   2 -19.721   0.800  -9.144
   17    HA   LYS   2           HA       LYS   2 -17.459  -0.564 -10.389
   18    HB2  LYS   2           2HB      LYS   2 -18.198   2.098 -10.231
   19    HB3  LYS   2           1HB      LYS   2 -16.924   1.977  -9.017
   20    HG2  LYS   2           2HG      LYS   2 -15.400   1.011 -10.660
   21    HG3  LYS   2           1HG      LYS   2 -16.675   0.992 -11.874
   22    HD2  LYS   2           2HD      LYS   2 -16.521   3.241 -12.271
   23    HD3  LYS   2           1HD      LYS   2 -16.157   3.618 -10.583
   24    HE2  LYS   2           2HE      LYS   2 -14.143   2.163 -12.296
   25    HE3  LYS   2           1HE      LYS   2 -14.265   3.921 -12.352
   26    HZ1  LYS   2           3HZ      LYS   2 -12.662   3.376 -10.723
   27    HZ2  LYS   2           1HZ      LYS   2 -13.668   2.225  -9.997
   28    HZ3  LYS   2           2HZ      LYS   2 -14.048   3.872  -9.881
   29    H    ALA   3           H        ALA   3 -15.372   0.362  -8.848
   30    HA   ALA   3           HA       ALA   3 -15.691  -1.250  -6.402
   31    HB1  ALA   3           1HB      ALA   3 -13.825  -1.865  -7.904
   32    HB2  ALA   3           2HB      ALA   3 -13.227  -1.284  -6.351
   33    HB3  ALA   3           3HB      ALA   3 -13.179  -0.232  -7.765
   34    H    LEU   4           H        LEU   4 -13.727  -0.193  -4.824
   35    HA   LEU   4           HA       LEU   4 -14.948   2.323  -3.987
   36    HB2  LEU   4           2HB      LEU   4 -13.011   0.377  -2.771
   37    HB3  LEU   4           1HB      LEU   4 -13.051   2.038  -2.172
   38    HG   LEU   4           HG       LEU   4 -15.436   1.847  -1.695
   39   HD11  LEU   4          1HD1      LEU   4 -16.324   0.446  -3.350
   40   HD12  LEU   4          2HD1      LEU   4 -16.394  -0.565  -1.910
   41   HD13  LEU   4          3HD1      LEU   4 -15.104  -0.801  -3.085
   42   HD21  LEU   4          3HD2      LEU   4 -14.524  -0.708  -0.522
   43   HD22  LEU   4          1HD2      LEU   4 -15.083   0.758   0.278
   44   HD23  LEU   4          2HD2      LEU   4 -13.416   0.646  -0.296
   45    H    LEU   5           H        LEU   5 -13.324   4.060  -3.221
   46    HA   LEU   5           HA       LEU   5 -11.896   5.002  -5.467
   47    HB2  LEU   5           2HB      LEU   5 -12.478   5.953  -2.839
   48    HB3  LEU   5           1HB      LEU   5 -10.737   6.096  -3.089
   49    HG   LEU   5           HG       LEU   5 -11.280   7.174  -5.342
   50   HD11  LEU   5          1HD1      LEU   5 -13.934   7.969  -4.327
   51   HD12  LEU   5          2HD1      LEU   5 -13.828   6.284  -4.822
   52   HD13  LEU   5          3HD1      LEU   5 -13.444   7.567  -5.970
   53   HD21  LEU   5          3HD2      LEU   5 -12.453   8.732  -3.043
   54   HD22  LEU   5          1HD2      LEU   5 -11.461   9.325  -4.370
   55   HD23  LEU   5          2HD2      LEU   5 -10.732   8.356  -3.090
   56    H    ALA   6           H        ALA   6  -9.720   4.859  -6.022
   57    HA   ALA   6           HA       ALA   6  -7.678   3.797  -6.205
   58    HB1  ALA   6           1HB      ALA   6  -6.784   4.827  -4.326
   59    HB2  ALA   6           2HB      ALA   6  -6.714   3.143  -3.811
   60    HB3  ALA   6           3HB      ALA   6  -8.025   4.181  -3.252
   61    H    LEU   7           H        LEU   7  -8.329   2.022  -3.285
   62    HA   LEU   7           HA       LEU   7  -9.853  -0.101  -4.002
   63    HB2  LEU   7           2HB      LEU   7  -7.634  -0.193  -5.707
   64    HB3  LEU   7           1HB      LEU   7  -7.271  -1.377  -4.462
   65    HG   LEU   7           HG       LEU   7  -8.485  -2.472  -6.261
   66   HD11  LEU   7          1HD1      LEU   7 -10.620  -2.164  -4.186
   67   HD12  LEU   7          2HD1      LEU   7  -9.059  -2.817  -3.698
   68   HD13  LEU   7          3HD1      LEU   7  -9.997  -3.623  -4.952
   69   HD21  LEU   7          3HD2      LEU   7 -10.583  -0.330  -5.779
   70   HD22  LEU   7          1HD2      LEU   7 -10.826  -1.757  -6.786
   71   HD23  LEU   7          2HD2      LEU   7  -9.621  -0.552  -7.238
   72    H    ALA   8           H        ALA   8 -10.006  -1.550  -2.333
   73    HA   ALA   8           HA       ALA   8  -8.967  -0.965   0.166
   74    HB1  ALA   8           1HB      ALA   8 -10.068  -3.454  -1.079
   75    HB2  ALA   8           2HB      ALA   8 -10.712  -2.491   0.247
   76    HB3  ALA   8           3HB      ALA   8  -9.336  -3.554   0.519
   77    H    LEU   9           H        LEU   9  -7.530  -2.624  -2.480
   78    HA   LEU   9           HA       LEU   9  -5.360  -3.790  -0.963
   79    HB2  LEU   9           2HB      LEU   9  -5.306  -3.350  -3.909
   80    HB3  LEU   9           1HB      LEU   9  -4.600  -4.663  -2.973
   81    HG   LEU   9           HG       LEU   9  -7.551  -4.209  -3.509
   82   HD11  LEU   9          1HD1      LEU   9  -5.688  -6.460  -4.330
   83   HD12  LEU   9          2HD1      LEU   9  -6.242  -5.166  -5.394
   84   HD13  LEU   9          3HD1      LEU   9  -7.399  -6.320  -4.737
   85   HD21  LEU   9          3HD2      LEU   9  -7.336  -5.088  -1.270
   86   HD22  LEU   9          1HD2      LEU   9  -6.099  -6.235  -1.787
   87   HD23  LEU   9          2HD2      LEU   9  -7.769  -6.438  -2.316
   88    H    HIS  10           H        HIS  10  -5.737  -1.257  -3.367
   89    HA   HIS  10           HA       HIS  10  -3.299  -0.196  -3.768
   90    HB2  HIS  10           2HB      HIS  10  -5.933   1.084  -3.245
   91    HB3  HIS  10           1HB      HIS  10  -4.517   2.121  -3.229
   92    HD1  HIS  10           1HD      HIS  10  -4.411   3.226  -5.447
   93    HD2  HIS  10           2HD      HIS  10  -5.421  -0.807  -5.789
   94    HE1  HIS  10           1HE      HIS  10  -4.539   2.729  -7.929
   95    HE2  HIS  10           2HE      HIS  10  -5.170   0.270  -8.161
   96    H    HIS  11           H        HIS  11  -5.241   0.077  -0.936
   97    HA   HIS  11           HA       HIS  11  -4.065   1.739   0.812
   98    HB2  HIS  11           2HB      HIS  11  -5.331  -0.930   0.938
   99    HB3  HIS  11           1HB      HIS  11  -4.407  -0.466   2.370
  100    HD1  HIS  11           1HD      HIS  11  -5.321   1.419   3.850
  101    HD2  HIS  11           2HD      HIS  11  -7.556   0.860   0.367
  102    HE1  HIS  11           1HE      HIS  11  -7.445   2.781   4.122
  103    HE2  HIS  11           2HE      HIS  11  -8.810   2.457   2.005
  104    H    LEU  12           H        LEU  12  -3.057  -1.514   0.080
  105    HA   LEU  12           HA       LEU  12  -0.620  -1.291   1.655
  106    HB2  LEU  12           2HB      LEU  12  -1.899  -3.475   0.023
  107    HB3  LEU  12           1HB      LEU  12  -0.223  -3.619   0.544
  108    HG   LEU  12           HG       LEU  12  -1.719  -4.697   2.169
  109   HD11  LEU  12          1HD1      LEU  12  -0.861  -2.150   3.511
  110   HD12  LEU  12          2HD1      LEU  12   0.354  -3.244   2.842
  111   HD13  LEU  12          3HD1      LEU  12  -0.753  -3.804   4.095
  112   HD21  LEU  12          3HD2      LEU  12  -3.563  -3.678   3.128
  113   HD22  LEU  12          1HD2      LEU  12  -3.587  -2.920   1.538
  114   HD23  LEU  12          2HD2      LEU  12  -2.910  -2.052   2.919
  115    H    ALA  13           H        ALA  13  -1.568  -1.611  -1.709
  116    HA   ALA  13           HA       ALA  13   0.932  -1.636  -2.931
  117    HB1  ALA  13           1HB      ALA  13  -0.127  -0.927  -4.910
  118    HB2  ALA  13           2HB      ALA  13  -1.311   0.043  -4.038
  119    HB3  ALA  13           3HB      ALA  13  -1.427  -1.718  -4.022
  120    H    HIS  14           H        HIS  14  -0.830   0.862  -1.364
  121    HA   HIS  14           HA       HIS  14   0.697   3.107  -2.225
  122    HB2  HIS  14           2HB      HIS  14  -1.357   3.683  -1.381
  123    HB3  HIS  14           1HB      HIS  14  -1.292   2.513  -0.085
  124    HD1  HIS  14           1HD      HIS  14   0.777   5.593  -1.062
  125    HD2  HIS  14           2HD      HIS  14  -0.880   3.758   2.303
  126    HE1  HIS  14           1HE      HIS  14   1.330   7.086   0.917
  127    HE2  HIS  14           2HE      HIS  14   0.349   5.968   2.983
  128    H    LEU  15           H        LEU  15   0.612   1.254   0.786
  129    HA   LEU  15           HA       LEU  15   2.900   2.428   1.965
  130    HB2  LEU  15           2HB      LEU  15   1.557  -0.263   2.197
  131    HB3  LEU  15           1HB      LEU  15   3.106   0.007   2.980
  132    HG   LEU  15           HG       LEU  15   2.136   1.123   4.670
  133   HD11  LEU  15          1HD1      LEU  15   0.733   2.665   2.498
  134   HD12  LEU  15          2HD1      LEU  15   2.027   3.216   3.556
  135   HD13  LEU  15          3HD1      LEU  15   0.408   2.962   4.202
  136   HD21  LEU  15          3HD2      LEU  15   0.458  -0.608   4.466
  137   HD22  LEU  15          1HD2      LEU  15  -0.380   0.299   3.206
  138   HD23  LEU  15          2HD2      LEU  15  -0.357   0.904   4.862
  139    H    ALA  16           H        ALA  16   2.281  -0.055  -0.292
  140    HA   ALA  16           HA       ALA  16   4.923  -1.086  -0.528
  141    HB1  ALA  16           1HB      ALA  16   3.042  -1.118  -2.850
  142    HB2  ALA  16           2HB      ALA  16   2.621  -2.025  -1.398
  143    HB3  ALA  16           3HB      ALA  16   4.113  -2.387  -2.261
  144    H    LEU  17           H        LEU  17   3.232   1.585  -1.952
  145    HA   LEU  17           HA       LEU  17   4.925   2.121  -4.119
  146    HB2  LEU  17           2HB      LEU  17   3.210   3.545  -4.410
  147    HB3  LEU  17           1HB      LEU  17   2.779   3.503  -2.716
  148    HG   LEU  17           HG       LEU  17   5.240   5.043  -3.280
  149   HD11  LEU  17          1HD1      LEU  17   3.928   5.555  -5.306
  150   HD12  LEU  17          2HD1      LEU  17   4.071   6.954  -4.245
  151   HD13  LEU  17          3HD1      LEU  17   2.567   6.034  -4.291
  152   HD21  LEU  17          3HD2      LEU  17   2.654   5.807  -1.893
  153   HD22  LEU  17          1HD2      LEU  17   4.223   6.587  -1.710
  154   HD23  LEU  17          2HD2      LEU  17   3.970   4.959  -1.091
  155    H    HIS  18           H        HIS  18   5.011   3.448  -0.817
  156    HA   HIS  18           HA       HIS  18   7.512   4.776  -1.420
  157    HB2  HIS  18           2HB      HIS  18   7.557   5.442   0.863
  158    HB3  HIS  18           1HB      HIS  18   5.906   5.556   0.293
  159    HD1  HIS  18           1HD      HIS  18   8.098   3.545   2.568
  160    HD2  HIS  18           2HD      HIS  18   4.088   3.807   1.440
  161    HE1  HIS  18           1HE      HIS  18   6.798   2.131   4.227
  162    HE2  HIS  18           2HE      HIS  18   4.340   2.302   3.578
  163    H    LEU  19           H        LEU  19   6.460   1.892   0.207
  164    HA   LEU  19           HA       LEU  19   8.871   0.905   1.196
  165    HB2  LEU  19           2HB      LEU  19   6.312  -0.188   0.583
  166    HB3  LEU  19           1HB      LEU  19   7.508  -1.222  -0.181
  167    HG   LEU  19           HG       LEU  19   7.230  -2.098   1.988
  168   HD11  LEU  19          1HD1      LEU  19   9.544  -0.380   2.690
  169   HD12  LEU  19          2HD1      LEU  19   9.664  -1.251   1.161
  170   HD13  LEU  19          3HD1      LEU  19   9.413  -2.136   2.663
  171   HD21  LEU  19          3HD2      LEU  19   7.016  -0.830   3.973
  172   HD22  LEU  19          1HD2      LEU  19   6.096   0.091   2.781
  173   HD23  LEU  19          2HD2      LEU  19   7.725   0.602   3.227
  174    H    ALA  20           H        ALA  20   7.556   1.196  -1.965
  175    HA   ALA  20           HA       ALA  20   9.416  -0.376  -3.428
  176    HB1  ALA  20           1HB      ALA  20   8.427   2.090  -4.732
  177    HB2  ALA  20           2HB      ALA  20   7.182   0.991  -4.139
  178    HB3  ALA  20           3HB      ALA  20   8.382   0.420  -5.295
  179    H    LEU  21           H        LEU  21   9.249   3.123  -3.016
  180    HA   LEU  21           HA       LEU  21  11.702   3.829  -4.090
  181    HB2  LEU  21           2HB      LEU  21   9.962   5.000  -1.956
  182    HB3  LEU  21           1HB      LEU  21  11.599   5.632  -2.129
  183    HG   LEU  21           HG       LEU  21  11.174   6.126  -4.503
  184   HD11  LEU  21          1HD1      LEU  21   8.796   5.899  -5.321
  185   HD12  LEU  21          2HD1      LEU  21   8.460   4.931  -3.889
  186   HD13  LEU  21          3HD1      LEU  21   9.633   4.365  -5.082
  187   HD21  LEU  21          3HD2      LEU  21   8.977   7.148  -2.668
  188   HD22  LEU  21          1HD2      LEU  21   9.492   7.914  -4.170
  189   HD23  LEU  21          2HD2      LEU  21  10.596   7.830  -2.799
  190    H    ALA  22           H        ALA  22  10.917   2.801  -0.815
  191    HA   ALA  22           HA       ALA  22  13.543   2.925   0.246
  192    HB1  ALA  22           1HB      ALA  22  11.503   0.899   1.148
  193    HB2  ALA  22           2HB      ALA  22  11.285   2.613   1.498
  194    HB3  ALA  22           3HB      ALA  22  12.700   1.762   2.112
  195    H    LEU  23           H        LEU  23  11.709   0.413  -1.383
  196    HA   LEU  23           HA       LEU  23  13.570  -1.694  -1.151
  197    HB2  LEU  23           2HB      LEU  23  11.061  -1.357  -2.314
  198    HB3  LEU  23           1HB      LEU  23  12.119  -1.668  -3.686
  199    HG   LEU  23           HG       LEU  23  11.919  -3.390  -1.193
  200   HD11  LEU  23          1HD1      LEU  23  11.054  -5.042  -2.981
  201   HD12  LEU  23          2HD1      LEU  23  10.779  -3.614  -3.978
  202   HD13  LEU  23          3HD1      LEU  23   9.950  -3.784  -2.429
  203   HD21  LEU  23          3HD2      LEU  23  14.121  -3.671  -1.996
  204   HD22  LEU  23          1HD2      LEU  23  13.628  -3.521  -3.679
  205   HD23  LEU  23          2HD2      LEU  23  13.228  -4.981  -2.772
  206    H    LYS  24           H        LYS  24  13.062   0.772  -3.605
  207    HA   LYS  24           HA       LYS  24  15.040   0.014  -5.430
  208    HB2  LYS  24           2HB      LYS  24  13.228   1.833  -5.649
  209    HB3  LYS  24           1HB      LYS  24  14.365   2.887  -4.811
  210    HG2  LYS  24           2HG      LYS  24  15.859   1.585  -6.827
  211    HG3  LYS  24           1HG      LYS  24  14.348   2.073  -7.587
  212    HD2  LYS  24           2HD      LYS  24  15.602   4.008  -7.860
  213    HD3  LYS  24           1HD      LYS  24  14.787   4.356  -6.337
  214    HE2  LYS  24           2HE      LYS  24  17.324   4.782  -6.407
  215    HE3  LYS  24           1HE      LYS  24  16.727   3.826  -5.057
  216    HZ1  LYS  24           3HZ      LYS  24  17.674   1.942  -5.843
  217    HZ2  LYS  24           1HZ      LYS  24  18.738   3.049  -6.572
  218    HZ3  LYS  24           2HZ      LYS  24  17.466   2.379  -7.476
  219    H    LYS  25           H        LYS  25  15.174   1.773  -2.438
  220    HA   LYS  25           HA       LYS  25  17.737   1.188  -1.676
  221    HB2  LYS  25           2HB      LYS  25  18.074   2.762  -3.886
  222    HB3  LYS  25           1HB      LYS  25  18.049   3.979  -2.616
  223    HG2  LYS  25           2HG      LYS  25  19.650   1.983  -1.533
  224    HG3  LYS  25           1HG      LYS  25  20.106   1.980  -3.235
  225    HD2  LYS  25           2HD      LYS  25  21.530   3.614  -2.372
  226    HD3  LYS  25           1HD      LYS  25  20.176   4.581  -2.951
  227    HE2  LYS  25           2HE      LYS  25  20.728   5.337  -0.704
  228    HE3  LYS  25           1HE      LYS  25  19.189   4.483  -0.638
  229    HZ1  LYS  25           3HZ      LYS  25  20.978   2.497  -0.270
  230    HZ2  LYS  25           1HZ      LYS  25  20.149   3.304   0.982
  231    HZ3  LYS  25           2HZ      LYS  25  21.722   3.787   0.538
  232    H    ALA  26           H        ALA  26  18.050   1.893   0.362
  233    HA   ALA  26           HA       ALA  26  16.312   4.082   1.323
  234    HB1  ALA  26           1HB      ALA  26  16.491   2.751   3.563
  235    HB2  ALA  26           2HB      ALA  26  16.876   1.382   2.520
  236    HB3  ALA  26           3HB      ALA  26  15.336   2.225   2.343
  Start of MODEL    6
    1    H1   LYS   1           1HT      LYS   1 -20.118  11.506   1.049
    2    H2   LYS   1           2HT      LYS   1 -20.552  13.016   0.417
    3    H3   LYS   1           3HT      LYS   1 -21.465  12.322   1.668
    4    HA   LYS   1           HA       LYS   1 -19.198  13.985   1.829
    5    HB2  LYS   1           2HB      LYS   1 -19.844  14.064   4.194
    6    HB3  LYS   1           1HB      LYS   1 -21.260  14.220   3.159
    7    HG2  LYS   1           2HG      LYS   1 -21.593  11.701   3.436
    8    HG3  LYS   1           1HG      LYS   1 -20.352  11.760   4.687
    9    HD2  LYS   1           2HD      LYS   1 -22.274  13.860   5.162
   10    HD3  LYS   1           1HD      LYS   1 -23.124  12.327   4.961
   11    HE2  LYS   1           2HE      LYS   1 -22.571  12.529   7.298
   12    HE3  LYS   1           1HE      LYS   1 -21.495  11.310   6.617
   13    HZ1  LYS   1           2HZ      LYS   1 -19.818  13.083   6.335
   14    HZ2  LYS   1           3HZ      LYS   1 -20.230  12.812   7.957
   15    HZ3  LYS   1           1HZ      LYS   1 -20.847  14.160   7.141
   16    H    LYS   2           H        LYS   2 -19.798  10.613   2.646
   17    HA   LYS   2           HA       LYS   2 -16.910  10.238   3.033
   18    HB2  LYS   2           2HB      LYS   2 -18.715  10.332   5.206
   19    HB3  LYS   2           1HB      LYS   2 -18.373   8.623   4.945
   20    HG2  LYS   2           2HG      LYS   2 -16.161  10.675   5.017
   21    HG3  LYS   2           1HG      LYS   2 -16.771   9.939   6.498
   22    HD2  LYS   2           2HD      LYS   2 -16.236   7.698   5.625
   23    HD3  LYS   2           1HD      LYS   2 -15.683   8.410   4.109
   24    HE2  LYS   2           2HE      LYS   2 -13.930   7.814   5.993
   25    HE3  LYS   2           1HE      LYS   2 -13.752   9.305   5.069
   26    HZ1  LYS   2           3HZ      LYS   2 -14.719  10.552   6.814
   27    HZ2  LYS   2           1HZ      LYS   2 -13.567   9.545   7.539
   28    HZ3  LYS   2           2HZ      LYS   2 -15.216   9.161   7.645
   29    H    ALA   3           H        ALA   3 -16.215   8.389   2.061
   30    HA   ALA   3           HA       ALA   3 -18.178   6.762   0.664
   31    HB1  ALA   3           1HB      ALA   3 -15.511   5.706   0.482
   32    HB2  ALA   3           2HB      ALA   3 -15.449   7.455   0.283
   33    HB3  ALA   3           3HB      ALA   3 -16.471   6.482  -0.775
   34    H    LEU   4           H        LEU   4 -18.444   4.520   0.935
   35    HA   LEU   4           HA       LEU   4 -17.763   3.554   3.630
   36    HB2  LEU   4           2HB      LEU   4 -20.147   3.467   2.186
   37    HB3  LEU   4           1HB      LEU   4 -19.510   1.829   2.040
   38    HG   LEU   4           HG       LEU   4 -19.828   3.331   4.663
   39   HD11  LEU   4          1HD1      LEU   4 -21.441   1.044   3.490
   40   HD12  LEU   4          2HD1      LEU   4 -22.003   2.711   3.629
   41   HD13  LEU   4          3HD1      LEU   4 -21.679   1.758   5.082
   42   HD21  LEU   4          3HD2      LEU   4 -18.020   1.719   4.805
   43   HD22  LEU   4          1HD2      LEU   4 -18.970   0.503   3.956
   44   HD23  LEU   4          2HD2      LEU   4 -19.421   0.993   5.586
   45    H    LEU   5           H        LEU   5 -18.226   1.996   0.462
   46    HA   LEU   5           HA       LEU   5 -15.860   0.317   1.003
   47    HB2  LEU   5           2HB      LEU   5 -18.000  -0.854   0.495
   48    HB3  LEU   5           1HB      LEU   5 -18.045  -0.046  -1.073
   49    HG   LEU   5           HG       LEU   5 -15.448  -1.181  -0.816
   50   HD11  LEU   5          1HD1      LEU   5 -16.303  -3.645  -0.694
   51   HD12  LEU   5          2HD1      LEU   5 -17.687  -2.949   0.148
   52   HD13  LEU   5          3HD1      LEU   5 -16.065  -2.762   0.815
   53   HD21  LEU   5          3HD2      LEU   5 -17.906  -1.940  -2.416
   54   HD22  LEU   5          1HD2      LEU   5 -16.314  -2.628  -2.704
   55   HD23  LEU   5          2HD2      LEU   5 -16.581  -0.903  -2.935
   56    H    ALA   6           H        ALA   6 -14.042   1.138   0.127
   57    HA   ALA   6           HA       ALA   6 -14.166   2.156  -2.640
   58    HB1  ALA   6           1HB      ALA   6 -13.985   3.887  -0.553
   59    HB2  ALA   6           2HB      ALA   6 -13.278   4.190  -2.139
   60    HB3  ALA   6           3HB      ALA   6 -12.276   3.549  -0.837
   61    H    LEU   7           H        LEU   7 -11.343   2.959  -2.442
   62    HA   LEU   7           HA       LEU   7 -10.163   0.399  -3.058
   63    HB2  LEU   7           2HB      LEU   7  -9.177   3.241  -3.041
   64    HB3  LEU   7           1HB      LEU   7  -8.057   1.902  -3.234
   65    HG   LEU   7           HG       LEU   7  -9.031   2.981  -5.376
   66   HD11  LEU   7          1HD1      LEU   7  -7.793   0.797  -5.230
   67   HD12  LEU   7          2HD1      LEU   7  -8.982   0.858  -6.527
   68   HD13  LEU   7          3HD1      LEU   7  -9.348  -0.017  -5.041
   69   HD21  LEU   7          3HD2      LEU   7 -11.370   1.187  -4.625
   70   HD22  LEU   7          1HD2      LEU   7 -11.197   2.149  -6.094
   71   HD23  LEU   7          2HD2      LEU   7 -11.400   2.950  -4.539
   72    H    ALA   8           H        ALA   8  -9.791  -0.914  -1.361
   73    HA   ALA   8           HA       ALA   8  -8.554   0.224   1.079
   74    HB1  ALA   8           1HB      ALA   8 -10.686  -0.915   1.446
   75    HB2  ALA   8           2HB      ALA   8  -9.365  -1.810   2.201
   76    HB3  ALA   8           3HB      ALA   8 -10.052  -2.370   0.674
   77    H    LEU   9           H        LEU   9  -8.068  -1.877  -1.551
   78    HA   LEU   9           HA       LEU   9  -5.918  -3.417  -0.359
   79    HB2  LEU   9           2HB      LEU   9  -7.257  -3.251  -2.995
   80    HB3  LEU   9           1HB      LEU   9  -5.654  -3.972  -2.901
   81    HG   LEU   9           HG       LEU   9  -6.408  -5.620  -1.303
   82   HD11  LEU   9          1HD1      LEU   9  -8.987  -4.025  -1.324
   83   HD12  LEU   9          2HD1      LEU   9  -7.945  -4.373   0.055
   84   HD13  LEU   9          3HD1      LEU   9  -8.880  -5.664  -0.690
   85   HD21  LEU   9          3HD2      LEU   9  -6.833  -6.192  -3.613
   86   HD22  LEU   9          1HD2      LEU   9  -8.326  -5.254  -3.619
   87   HD23  LEU   9          2HD2      LEU   9  -8.215  -6.727  -2.659
   88    H    HIS  10           H        HIS  10  -6.156  -1.187  -3.097
   89    HA   HIS  10           HA       HIS  10  -3.495  -0.913  -3.732
   90    HB2  HIS  10           2HB      HIS  10  -4.101   0.907  -4.919
   91    HB3  HIS  10           1HB      HIS  10  -5.725   0.384  -4.502
   92    HD1  HIS  10           1HD      HIS  10  -3.556   3.269  -4.300
   93    HD2  HIS  10           2HD      HIS  10  -6.612   1.719  -1.906
   94    HE1  HIS  10           1HE      HIS  10  -4.334   5.164  -2.792
   95    HE2  HIS  10           2HE      HIS  10  -6.189   4.233  -1.322
   96    H    HIS  11           H        HIS  11  -5.272   0.280  -1.084
   97    HA   HIS  11           HA       HIS  11  -3.749   2.180   0.147
   98    HB2  HIS  11           2HB      HIS  11  -5.652   0.109   0.859
   99    HB3  HIS  11           1HB      HIS  11  -4.465   0.362   2.151
  100    HD1  HIS  11           1HD      HIS  11  -4.890   2.338   3.651
  101    HD2  HIS  11           2HD      HIS  11  -6.842   2.727  -0.014
  102    HE1  HIS  11           1HE      HIS  11  -6.231   4.490   3.777
  103    HE2  HIS  11           2HE      HIS  11  -7.431   4.739   1.545
  104    H    LEU  12           H        LEU  12  -3.224  -1.217  -0.221
  105    HA   LEU  12           HA       LEU  12  -0.887  -1.273   1.530
  106    HB2  LEU  12           2HB      LEU  12  -2.305  -3.318  -0.169
  107    HB3  LEU  12           1HB      LEU  12  -0.705  -3.648   0.492
  108    HG   LEU  12           HG       LEU  12  -1.714  -2.904   2.766
  109   HD11  LEU  12          1HD1      LEU  12  -4.207  -3.441   2.859
  110   HD12  LEU  12          2HD1      LEU  12  -4.202  -3.348   1.098
  111   HD13  LEU  12          3HD1      LEU  12  -3.781  -1.930   2.057
  112   HD21  LEU  12          3HD2      LEU  12  -2.728  -5.462   1.478
  113   HD22  LEU  12          1HD2      LEU  12  -2.558  -5.159   3.209
  114   HD23  LEU  12          2HD2      LEU  12  -1.125  -5.251   2.186
  115    H    ALA  13           H        ALA  13  -1.740  -1.448  -1.841
  116    HA   ALA  13           HA       ALA  13   0.827  -1.759  -2.962
  117    HB1  ALA  13           1HB      ALA  13  -1.246  -1.846  -4.327
  118    HB2  ALA  13           2HB      ALA  13  -0.080  -0.700  -4.987
  119    HB3  ALA  13           3HB      ALA  13  -1.470  -0.115  -4.075
  120    H    HIS  14           H        HIS  14  -0.849   0.898  -1.553
  121    HA   HIS  14           HA       HIS  14   0.886   2.998  -2.362
  122    HB2  HIS  14           2HB      HIS  14  -0.959   3.967  -1.559
  123    HB3  HIS  14           1HB      HIS  14  -1.359   2.618  -0.523
  124    HD1  HIS  14           1HD      HIS  14   1.705   4.910  -0.433
  125    HD2  HIS  14           2HD      HIS  14  -1.478   3.723   1.997
  126    HE1  HIS  14           1HE      HIS  14   2.063   6.023   1.818
  127    HE2  HIS  14           2HE      HIS  14   0.118   5.329   3.306
  128    H    LEU  15           H        LEU  15   0.597   1.110   0.603
  129    HA   LEU  15           HA       LEU  15   2.868   2.167   1.913
  130    HB2  LEU  15           2HB      LEU  15   1.349  -0.427   2.064
  131    HB3  LEU  15           1HB      LEU  15   2.901  -0.303   2.876
  132    HG   LEU  15           HG       LEU  15   1.909   0.702   4.609
  133   HD11  LEU  15          1HD1      LEU  15   0.671   2.910   4.239
  134   HD12  LEU  15          2HD1      LEU  15   1.064   2.723   2.533
  135   HD13  LEU  15          3HD1      LEU  15   2.357   2.866   3.727
  136   HD21  LEU  15          3HD2      LEU  15  -0.457   0.240   2.849
  137   HD22  LEU  15          1HD2      LEU  15  -0.676   1.224   4.294
  138   HD23  LEU  15          2HD2      LEU  15  -0.095  -0.437   4.436
  139    H    ALA  16           H        ALA  16   2.254  -0.189  -0.452
  140    HA   ALA  16           HA       ALA  16   4.902  -1.305  -0.550
  141    HB1  ALA  16           1HB      ALA  16   3.133  -1.328  -2.956
  142    HB2  ALA  16           2HB      ALA  16   2.602  -2.200  -1.517
  143    HB3  ALA  16           3HB      ALA  16   4.131  -2.616  -2.286
  144    H    LEU  17           H        LEU  17   3.302   1.403  -1.949
  145    HA   LEU  17           HA       LEU  17   5.032   1.960  -4.072
  146    HB2  LEU  17           2HB      LEU  17   3.581   3.633  -4.409
  147    HB3  LEU  17           1HB      LEU  17   2.751   3.106  -2.958
  148    HG   LEU  17           HG       LEU  17   4.278   4.617  -1.628
  149   HD11  LEU  17          1HD1      LEU  17   6.047   5.572  -2.658
  150   HD12  LEU  17          2HD1      LEU  17   4.946   6.429  -3.736
  151   HD13  LEU  17          3HD1      LEU  17   5.566   4.840  -4.184
  152   HD21  LEU  17          3HD2      LEU  17   3.082   6.688  -2.313
  153   HD22  LEU  17          1HD2      LEU  17   1.999   5.297  -2.219
  154   HD23  LEU  17          2HD2      LEU  17   2.555   5.877  -3.785
  155    H    HIS  18           H        HIS  18   5.077   3.219  -0.756
  156    HA   HIS  18           HA       HIS  18   7.563   4.599  -1.238
  157    HB2  HIS  18           2HB      HIS  18   7.562   5.086   1.114
  158    HB3  HIS  18           1HB      HIS  18   5.952   5.291   0.468
  159    HD1  HIS  18           1HD      HIS  18   7.938   2.954   2.644
  160    HD2  HIS  18           2HD      HIS  18   4.006   3.579   1.399
  161    HE1  HIS  18           1HE      HIS  18   6.490   1.504   4.134
  162    HE2  HIS  18           2HE      HIS  18   4.079   1.875   3.403
  163    H    LEU  19           H        LEU  19   6.554   1.626   0.250
  164    HA   LEU  19           HA       LEU  19   8.992   0.662   1.211
  165    HB2  LEU  19           2HB      LEU  19   6.450  -0.454   0.629
  166    HB3  LEU  19           1HB      LEU  19   7.624  -1.428  -0.241
  167    HG   LEU  19           HG       LEU  19   7.472  -2.444   1.869
  168   HD11  LEU  19          1HD1      LEU  19   9.677  -2.378   2.581
  169   HD12  LEU  19          2HD1      LEU  19   9.754  -0.618   2.510
  170   HD13  LEU  19          3HD1      LEU  19   9.839  -1.566   1.027
  171   HD21  LEU  19          3HD2      LEU  19   7.959   0.131   3.337
  172   HD22  LEU  19          1HD2      LEU  19   7.177  -1.345   3.908
  173   HD23  LEU  19          2HD2      LEU  19   6.325  -0.272   2.797
  174    H    ALA  20           H        ALA  20   7.677   1.005  -1.958
  175    HA   ALA  20           HA       ALA  20   9.605  -0.491  -3.445
  176    HB1  ALA  20           1HB      ALA  20   8.636   0.404  -5.348
  177    HB2  ALA  20           2HB      ALA  20   8.395   1.986  -4.607
  178    HB3  ALA  20           3HB      ALA  20   7.326   0.647  -4.192
  179    H    LEU  21           H        LEU  21   9.262   2.978  -2.989
  180    HA   LEU  21           HA       LEU  21  11.678   3.855  -4.008
  181    HB2  LEU  21           2HB      LEU  21  10.359   4.925  -1.501
  182    HB3  LEU  21           1HB      LEU  21  11.448   5.802  -2.575
  183    HG   LEU  21           HG       LEU  21   8.739   4.696  -3.373
  184   HD11  LEU  21          1HD1      LEU  21   9.646   7.315  -2.290
  185   HD12  LEU  21          2HD1      LEU  21   8.088   6.511  -2.135
  186   HD13  LEU  21          3HD1      LEU  21   8.496   7.358  -3.623
  187   HD21  LEU  21          3HD2      LEU  21  10.090   4.774  -5.321
  188   HD22  LEU  21          1HD2      LEU  21  10.879   6.266  -4.814
  189   HD23  LEU  21          2HD2      LEU  21   9.199   6.294  -5.344
  190    H    ALA  22           H        ALA  22  10.875   2.786  -0.765
  191    HA   ALA  22           HA       ALA  22  13.342   3.067   0.487
  192    HB1  ALA  22           1HB      ALA  22  10.965   2.142   1.325
  193    HB2  ALA  22           2HB      ALA  22  12.461   1.802   2.193
  194    HB3  ALA  22           3HB      ALA  22  11.790   0.602   1.090
  195    H    LEU  23           H        LEU  23  12.033   0.243  -1.182
  196    HA   LEU  23           HA       LEU  23  14.368  -1.339  -1.067
  197    HB2  LEU  23           2HB      LEU  23  11.786  -1.437  -2.445
  198    HB3  LEU  23           1HB      LEU  23  13.099  -2.095  -3.416
  199    HG   LEU  23           HG       LEU  23  12.084  -3.860  -2.046
  200   HD11  LEU  23          1HD1      LEU  23  14.795  -3.236  -2.226
  201   HD12  LEU  23          2HD1      LEU  23  14.118  -4.795  -1.761
  202   HD13  LEU  23          3HD1      LEU  23  14.562  -3.619  -0.522
  203   HD21  LEU  23          3HD2      LEU  23  12.224  -3.770   0.403
  204   HD22  LEU  23          1HD2      LEU  23  11.286  -2.408  -0.200
  205   HD23  LEU  23          2HD2      LEU  23  12.950  -2.167   0.323
  206    H    LYS  24           H        LYS  24  13.100   0.788  -3.567
  207    HA   LYS  24           HA       LYS  24  15.142   0.433  -5.460
  208    HB2  LYS  24           2HB      LYS  24  12.828   1.790  -5.496
  209    HB3  LYS  24           1HB      LYS  24  13.923   3.139  -5.209
  210    HG2  LYS  24           2HG      LYS  24  15.165   1.578  -7.201
  211    HG3  LYS  24           1HG      LYS  24  13.465   1.647  -7.656
  212    HD2  LYS  24           2HD      LYS  24  14.506   3.557  -8.649
  213    HD3  LYS  24           1HD      LYS  24  13.581   4.157  -7.271
  214    HE2  LYS  24           2HE      LYS  24  15.965   5.063  -7.499
  215    HE3  LYS  24           1HE      LYS  24  15.549   4.391  -5.927
  216    HZ1  LYS  24           3HZ      LYS  24  16.758   2.652  -7.972
  217    HZ2  LYS  24           1HZ      LYS  24  16.830   2.530  -6.279
  218    HZ3  LYS  24           2HZ      LYS  24  17.757   3.707  -7.086
  219    H    LYS  25           H        LYS  25  15.008   2.319  -2.556
  220    HA   LYS  25           HA       LYS  25  16.552   3.574  -1.441
  221    HB2  LYS  25           2HB      LYS  25  18.384   1.914  -3.173
  222    HB3  LYS  25           1HB      LYS  25  18.989   3.061  -1.978
  223    HG2  LYS  25           2HG      LYS  25  17.144   1.718  -0.483
  224    HG3  LYS  25           1HG      LYS  25  17.662   0.439  -1.578
  225    HD2  LYS  25           2HD      LYS  25  19.209   0.237   0.166
  226    HD3  LYS  25           1HD      LYS  25  20.079   1.259  -0.975
  227    HE2  LYS  25           2HE      LYS  25  20.217   2.137   1.345
  228    HE3  LYS  25           1HE      LYS  25  19.401   3.266   0.263
  229    HZ1  LYS  25           3HZ      LYS  25  17.597   1.388   1.460
  230    HZ2  LYS  25           1HZ      LYS  25  17.517   3.084   1.410
  231    HZ3  LYS  25           2HZ      LYS  25  18.425   2.310   2.621
  232    H    ALA  26           H        ALA  26  18.879   3.715  -3.969
  233    HA   ALA  26           HA       ALA  26  18.050   6.501  -4.521
  234    HB1  ALA  26           1HB      ALA  26  20.482   5.574  -3.560
  235    HB2  ALA  26           2HB      ALA  26  20.189   7.150  -4.302
  236    HB3  ALA  26           3HB      ALA  26  20.782   5.811  -5.285
  Start of MODEL    7
    1    H1   LYS   1           1HT      LYS   1 -26.405  -6.187  -3.357
    2    H2   LYS   1           2HT      LYS   1 -24.893  -5.470  -3.075
    3    H3   LYS   1           3HT      LYS   1 -25.146  -6.410  -4.465
    4    HA   LYS   1           HA       LYS   1 -26.416  -4.817  -5.504
    5    HB2  LYS   1           2HB      LYS   1 -26.617  -3.290  -2.901
    6    HB3  LYS   1           1HB      LYS   1 -27.537  -3.033  -4.379
    7    HG2  LYS   1           2HG      LYS   1 -28.489  -5.381  -4.054
    8    HG3  LYS   1           1HG      LYS   1 -27.773  -5.354  -2.441
    9    HD2  LYS   1           2HD      LYS   1 -29.002  -3.080  -2.169
   10    HD3  LYS   1           1HD      LYS   1 -29.963  -3.603  -3.555
   11    HE2  LYS   1           2HE      LYS   1 -29.572  -5.446  -1.207
   12    HE3  LYS   1           1HE      LYS   1 -30.798  -4.181  -1.145
   13    HZ1  LYS   1           2HZ      LYS   1 -30.606  -6.492  -2.943
   14    HZ2  LYS   1           3HZ      LYS   1 -31.457  -5.110  -3.434
   15    HZ3  LYS   1           1HZ      LYS   1 -31.933  -5.941  -2.036
   16    H    LYS   2           H        LYS   2 -25.150  -3.544  -6.705
   17    HA   LYS   2           HA       LYS   2 -23.446  -2.182  -7.385
   18    HB2  LYS   2           2HB      LYS   2 -23.628  -1.232  -4.516
   19    HB3  LYS   2           1HB      LYS   2 -22.632  -0.465  -5.751
   20    HG2  LYS   2           2HG      LYS   2 -25.012  -0.598  -7.064
   21    HG3  LYS   2           1HG      LYS   2 -25.577  -0.413  -5.404
   22    HD2  LYS   2           2HD      LYS   2 -23.613   1.406  -6.840
   23    HD3  LYS   2           1HD      LYS   2 -25.280   1.790  -6.439
   24    HE2  LYS   2           2HE      LYS   2 -22.945   1.422  -4.558
   25    HE3  LYS   2           1HE      LYS   2 -24.003   2.824  -4.732
   26    HZ1  LYS   2           3HZ      LYS   2 -25.777   1.682  -3.749
   27    HZ2  LYS   2           1HZ      LYS   2 -24.436   1.353  -2.763
   28    HZ3  LYS   2           2HZ      LYS   2 -24.994   0.182  -3.851
   29    H    ALA   3           H        ALA   3 -21.089  -1.605  -6.909
   30    HA   ALA   3           HA       ALA   3 -19.709  -4.048  -6.222
   31    HB1  ALA   3           1HB      ALA   3 -19.155  -2.046  -7.975
   32    HB2  ALA   3           2HB      ALA   3 -17.932  -3.147  -7.339
   33    HB3  ALA   3           3HB      ALA   3 -18.149  -1.556  -6.612
   34    H    LEU   4           H        LEU   4 -20.002  -4.396  -4.043
   35    HA   LEU   4           HA       LEU   4 -19.776  -2.412  -2.046
   36    HB2  LEU   4           2HB      LEU   4 -19.304  -5.396  -1.796
   37    HB3  LEU   4           1HB      LEU   4 -19.606  -4.279  -0.462
   38    HG   LEU   4           HG       LEU   4 -21.523  -4.690  -2.775
   39   HD11  LEU   4          1HD1      LEU   4 -21.294  -6.759  -1.463
   40   HD12  LEU   4          2HD1      LEU   4 -22.864  -6.005  -1.187
   41   HD13  LEU   4          3HD1      LEU   4 -21.588  -5.854   0.021
   42   HD21  LEU   4          3HD2      LEU   4 -22.052  -2.618  -1.827
   43   HD22  LEU   4          1HD2      LEU   4 -21.541  -3.112  -0.211
   44   HD23  LEU   4          2HD2      LEU   4 -23.060  -3.706  -0.878
   45    H    LEU   5           H        LEU   5 -17.951  -3.597  -0.232
   46    HA   LEU   5           HA       LEU   5 -15.727  -3.595   0.354
   47    HB2  LEU   5           2HB      LEU   5 -15.701  -4.607  -2.287
   48    HB3  LEU   5           1HB      LEU   5 -14.458  -3.357  -2.231
   49    HG   LEU   5           HG       LEU   5 -13.685  -4.472  -0.030
   50   HD11  LEU   5          1HD1      LEU   5 -15.345  -6.725  -1.203
   51   HD12  LEU   5          2HD1      LEU   5 -15.743  -5.828   0.262
   52   HD13  LEU   5          3HD1      LEU   5 -14.297  -6.834   0.208
   53   HD21  LEU   5          3HD2      LEU   5 -12.312  -4.695  -1.973
   54   HD22  LEU   5          1HD2      LEU   5 -13.455  -5.786  -2.753
   55   HD23  LEU   5          2HD2      LEU   5 -12.523  -6.332  -1.358
   56    H    ALA   6           H        ALA   6 -13.766  -2.129   0.183
   57    HA   ALA   6           HA       ALA   6 -14.371   0.489  -1.009
   58    HB1  ALA   6           1HB      ALA   6 -13.284   0.746   1.691
   59    HB2  ALA   6           2HB      ALA   6 -14.874  -0.014   1.678
   60    HB3  ALA   6           3HB      ALA   6 -14.651   1.572   0.945
   61    H    LEU   7           H        LEU   7 -12.229   1.786   0.404
   62    HA   LEU   7           HA       LEU   7 -10.030   0.834  -1.198
   63    HB2  LEU   7           2HB      LEU   7 -10.747   3.278   0.028
   64    HB3  LEU   7           1HB      LEU   7  -9.223   2.789   0.758
   65    HG   LEU   7           HG       LEU   7  -9.835   3.251  -2.170
   66   HD11  LEU   7          1HD1      LEU   7  -8.138   4.891  -2.030
   67   HD12  LEU   7          2HD1      LEU   7  -7.515   4.238  -0.515
   68   HD13  LEU   7          3HD1      LEU   7  -9.062   5.086  -0.541
   69   HD21  LEU   7          3HD2      LEU   7  -7.247   2.574  -2.263
   70   HD22  LEU   7          1HD2      LEU   7  -8.523   1.378  -2.485
   71   HD23  LEU   7          2HD2      LEU   7  -7.724   1.537  -0.920
   72    H    ALA   8           H        ALA   8  -8.285  -0.313  -0.532
   73    HA   ALA   8           HA       ALA   8  -7.339  -0.581   2.095
   74    HB1  ALA   8           1HB      ALA   8  -8.112  -3.066   2.353
   75    HB2  ALA   8           2HB      ALA   8  -9.432  -2.579   1.290
   76    HB3  ALA   8           3HB      ALA   8  -9.203  -1.770   2.838
   77    H    LEU   9           H        LEU   9  -7.792  -1.969  -1.034
   78    HA   LEU   9           HA       LEU   9  -5.511  -3.712  -0.928
   79    HB2  LEU   9           2HB      LEU   9  -7.688  -3.632  -2.461
   80    HB3  LEU   9           1HB      LEU   9  -6.584  -2.740  -3.510
   81    HG   LEU   9           HG       LEU   9  -6.087  -5.496  -2.330
   82   HD11  LEU   9          1HD1      LEU   9  -6.592  -6.406  -4.394
   83   HD12  LEU   9          2HD1      LEU   9  -6.249  -4.909  -5.263
   84   HD13  LEU   9          3HD1      LEU   9  -7.743  -5.071  -4.339
   85   HD21  LEU   9          3HD2      LEU   9  -4.141  -5.395  -4.044
   86   HD22  LEU   9          1HD2      LEU   9  -3.941  -4.512  -2.530
   87   HD23  LEU   9          2HD2      LEU   9  -4.378  -3.646  -4.005
   88    H    HIS  10           H        HIS  10  -6.222  -0.852  -2.880
   89    HA   HIS  10           HA       HIS  10  -3.625  -0.387  -3.814
   90    HB2  HIS  10           2HB      HIS  10  -5.907   1.496  -3.215
   91    HB3  HIS  10           1HB      HIS  10  -4.368   2.064  -3.853
   92    HD1  HIS  10           1HD      HIS  10  -3.579   0.772  -6.151
   93    HD2  HIS  10           2HD      HIS  10  -7.637   0.591  -5.185
   94    HE1  HIS  10           1HE      HIS  10  -4.788   0.071  -8.269
   95    HE2  HIS  10           2HE      HIS  10  -7.273  -0.024  -7.701
   96    H    HIS  11           H        HIS  11  -5.301   0.469  -0.950
   97    HA   HIS  11           HA       HIS  11  -3.761   2.188   0.461
   98    HB2  HIS  11           2HB      HIS  11  -5.571  -0.016   0.995
   99    HB3  HIS  11           1HB      HIS  11  -4.332   0.119   2.253
  100    HD1  HIS  11           1HD      HIS  11  -4.101   2.580   3.386
  101    HD2  HIS  11           2HD      HIS  11  -7.555   1.903   1.148
  102    HE1  HIS  11           1HE      HIS  11  -5.738   4.413   4.024
  103    HE2  HIS  11           2HE      HIS  11  -7.850   4.025   2.656
  104    H    LEU  12           H        LEU  12  -3.247  -1.237  -0.052
  105    HA   LEU  12           HA       LEU  12  -0.806  -1.331   1.498
  106    HB2  LEU  12           2HB      LEU  12  -1.974  -3.344  -0.445
  107    HB3  LEU  12           1HB      LEU  12  -0.660  -3.651   0.691
  108    HG   LEU  12           HG       LEU  12  -3.341  -2.648   1.652
  109   HD11  LEU  12          1HD1      LEU  12  -3.847  -5.074   2.141
  110   HD12  LEU  12          2HD1      LEU  12  -2.489  -5.503   1.103
  111   HD13  LEU  12          3HD1      LEU  12  -3.882  -4.656   0.429
  112   HD21  LEU  12          3HD2      LEU  12  -2.520  -4.018   3.675
  113   HD22  LEU  12          1HD2      LEU  12  -1.660  -2.518   3.327
  114   HD23  LEU  12          2HD2      LEU  12  -0.958  -4.066   2.859
  115    H    ALA  13           H        ALA  13  -1.733  -1.512  -1.872
  116    HA   ALA  13           HA       ALA  13   0.773  -1.725  -3.085
  117    HB1  ALA  13           1HB      ALA  13  -1.399   0.080  -4.158
  118    HB2  ALA  13           2HB      ALA  13  -1.546  -1.676  -4.211
  119    HB3  ALA  13           3HB      ALA  13  -0.231  -0.878  -5.069
  120    H    HIS  14           H        HIS  14  -0.860   0.924  -1.602
  121    HA   HIS  14           HA       HIS  14   0.872   3.026  -2.428
  122    HB2  HIS  14           2HB      HIS  14  -1.058   3.902  -1.670
  123    HB3  HIS  14           1HB      HIS  14  -1.339   2.623  -0.516
  124    HD1  HIS  14           1HD      HIS  14   1.433   5.250  -0.830
  125    HD2  HIS  14           2HD      HIS  14  -1.249   3.715   1.976
  126    HE1  HIS  14           1HE      HIS  14   1.881   6.483   1.342
  127    HE2  HIS  14           2HE      HIS  14   0.247   5.565   3.066
  128    H    LEU  15           H        LEU  15   0.569   1.155   0.547
  129    HA   LEU  15           HA       LEU  15   2.833   2.201   1.875
  130    HB2  LEU  15           2HB      LEU  15   1.386  -0.449   1.952
  131    HB3  LEU  15           1HB      LEU  15   2.882  -0.240   2.846
  132    HG   LEU  15           HG       LEU  15   1.871   0.989   4.465
  133   HD11  LEU  15          1HD1      LEU  15   0.297   2.282   2.245
  134   HD12  LEU  15          2HD1      LEU  15   1.595   3.002   3.201
  135   HD13  LEU  15          3HD1      LEU  15   0.031   2.660   3.943
  136   HD21  LEU  15          3HD2      LEU  15   0.298  -0.993   3.832
  137   HD22  LEU  15          1HD2      LEU  15  -0.776   0.270   3.228
  138   HD23  LEU  15          2HD2      LEU  15  -0.308   0.247   4.927
  139    H    ALA  16           H        ALA  16   2.215  -0.197  -0.477
  140    HA   ALA  16           HA       ALA  16   4.825  -1.340  -0.590
  141    HB1  ALA  16           1HB      ALA  16   4.044  -2.600  -2.366
  142    HB2  ALA  16           2HB      ALA  16   3.070  -1.277  -3.010
  143    HB3  ALA  16           3HB      ALA  16   2.523  -2.168  -1.588
  144    H    LEU  17           H        LEU  17   3.295   1.380  -2.106
  145    HA   LEU  17           HA       LEU  17   5.139   1.867  -4.138
  146    HB2  LEU  17           2HB      LEU  17   3.471   3.319  -4.530
  147    HB3  LEU  17           1HB      LEU  17   2.961   3.306  -2.851
  148    HG   LEU  17           HG       LEU  17   5.482   4.785  -3.303
  149   HD11  LEU  17          1HD1      LEU  17   4.349   6.731  -4.317
  150   HD12  LEU  17          2HD1      LEU  17   2.886   5.770  -4.510
  151   HD13  LEU  17          3HD1      LEU  17   4.345   5.338  -5.400
  152   HD21  LEU  17          3HD2      LEU  17   4.120   4.754  -1.191
  153   HD22  LEU  17          1HD2      LEU  17   2.827   5.572  -2.060
  154   HD23  LEU  17          2HD2      LEU  17   4.378   6.377  -1.826
  155    H    HIS  18           H        HIS  18   5.075   3.160  -0.820
  156    HA   HIS  18           HA       HIS  18   7.640   4.417  -1.289
  157    HB2  HIS  18           2HB      HIS  18   7.573   5.144   0.961
  158    HB3  HIS  18           1HB      HIS  18   5.965   5.283   0.289
  159    HD1  HIS  18           1HD      HIS  18   7.900   3.495   2.906
  160    HD2  HIS  18           2HD      HIS  18   4.046   3.494   1.306
  161    HE1  HIS  18           1HE      HIS  18   6.447   2.223   4.547
  162    HE2  HIS  18           2HE      HIS  18   4.083   2.244   3.611
  163    H    LEU  19           H        LEU  19   6.431   1.573   0.304
  164    HA   LEU  19           HA       LEU  19   8.792   0.554   1.413
  165    HB2  LEU  19           2HB      LEU  19   6.262  -0.578   0.463
  166    HB3  LEU  19           1HB      LEU  19   7.618  -1.666   0.208
  167    HG   LEU  19           HG       LEU  19   6.650  -2.087   2.380
  168   HD11  LEU  19          1HD1      LEU  19   9.032  -0.566   3.245
  169   HD12  LEU  19          2HD1      LEU  19   9.295  -1.687   1.910
  170   HD13  LEU  19          3HD1      LEU  19   8.658  -2.275   3.447
  171   HD21  LEU  19          3HD2      LEU  19   7.274   0.228   3.870
  172   HD22  LEU  19          1HD2      LEU  19   5.664  -0.379   3.471
  173   HD23  LEU  19          2HD2      LEU  19   6.450   0.793   2.417
  174    H    ALA  20           H        ALA  20   7.612   0.808  -1.813
  175    HA   ALA  20           HA       ALA  20   9.596  -0.829  -3.095
  176    HB1  ALA  20           1HB      ALA  20   8.092  -0.538  -4.741
  177    HB2  ALA  20           2HB      ALA  20   8.778   1.068  -4.970
  178    HB3  ALA  20           3HB      ALA  20   7.379   0.848  -3.924
  179    H    LEU  21           H        LEU  21   9.125   2.659  -3.033
  180    HA   LEU  21           HA       LEU  21  11.515   3.488  -4.141
  181    HB2  LEU  21           2HB      LEU  21   9.592   4.678  -2.209
  182    HB3  LEU  21           1HB      LEU  21  11.182   5.431  -2.309
  183    HG   LEU  21           HG       LEU  21   9.535   6.451  -3.889
  184   HD11  LEU  21          1HD1      LEU  21  11.520   5.019  -5.615
  185   HD12  LEU  21          2HD1      LEU  21  12.128   6.042  -4.312
  186   HD13  LEU  21          3HD1      LEU  21  11.097   6.731  -5.566
  187   HD21  LEU  21          3HD2      LEU  21   8.212   4.439  -4.379
  188   HD22  LEU  21          1HD2      LEU  21   9.608   3.689  -5.159
  189   HD23  LEU  21          2HD2      LEU  21   8.856   5.114  -5.872
  190    H    ALA  22           H        ALA  22  10.774   2.638  -0.823
  191    HA   ALA  22           HA       ALA  22  13.175   3.242   0.436
  192    HB1  ALA  22           1HB      ALA  22  12.480   0.849   1.617
  193    HB2  ALA  22           2HB      ALA  22  10.946   1.399   0.952
  194    HB3  ALA  22           3HB      ALA  22  11.836   2.423   2.074
  195    H    LEU  23           H        LEU  23  12.237   0.306  -1.256
  196    HA   LEU  23           HA       LEU  23  14.765  -1.002  -1.016
  197    HB2  LEU  23           2HB      LEU  23  12.217  -1.457  -2.429
  198    HB3  LEU  23           1HB      LEU  23  13.636  -2.071  -3.271
  199    HG   LEU  23           HG       LEU  23  14.145  -2.890  -0.702
  200   HD11  LEU  23          1HD1      LEU  23  12.069  -3.850   0.171
  201   HD12  LEU  23          2HD1      LEU  23  11.161  -3.172  -1.180
  202   HD13  LEU  23          3HD1      LEU  23  11.897  -2.104   0.014
  203   HD21  LEU  23          3HD2      LEU  23  13.462  -5.116  -1.505
  204   HD22  LEU  23          1HD2      LEU  23  14.305  -4.233  -2.778
  205   HD23  LEU  23          2HD2      LEU  23  12.545  -4.374  -2.817
  206    H    LYS  24           H        LYS  24  13.133   0.721  -3.601
  207    HA   LYS  24           HA       LYS  24  15.105   0.638  -5.556
  208    HB2  LYS  24           2HB      LYS  24  12.679   1.698  -5.552
  209    HB3  LYS  24           1HB      LYS  24  13.562   3.175  -5.166
  210    HG2  LYS  24           2HG      LYS  24  15.033   1.996  -7.240
  211    HG3  LYS  24           1HG      LYS  24  13.351   1.766  -7.704
  212    HD2  LYS  24           2HD      LYS  24  13.738   3.888  -8.575
  213    HD3  LYS  24           1HD      LYS  24  13.137   4.311  -6.973
  214    HE2  LYS  24           2HE      LYS  24  15.242   5.534  -7.609
  215    HE3  LYS  24           1HE      LYS  24  15.398   4.589  -6.131
  216    HZ1  LYS  24           3HZ      LYS  24  16.157   3.501  -8.777
  217    HZ2  LYS  24           1HZ      LYS  24  16.605   2.933  -7.240
  218    HZ3  LYS  24           2HZ      LYS  24  17.253   4.393  -7.829
  219    H    LYS  25           H        LYS  25  14.784   2.718  -2.767
  220    HA   LYS  25           HA       LYS  25  16.165   4.300  -1.836
  221    HB2  LYS  25           2HB      LYS  25  17.448   2.231  -1.457
  222    HB3  LYS  25           1HB      LYS  25  18.282   2.469  -2.989
  223    HG2  LYS  25           2HG      LYS  25  18.705   4.898  -1.816
  224    HG3  LYS  25           1HG      LYS  25  18.654   3.862  -0.392
  225    HD2  LYS  25           2HD      LYS  25  20.229   2.643  -2.529
  226    HD3  LYS  25           1HD      LYS  25  20.848   4.238  -2.102
  227    HE2  LYS  25           2HE      LYS  25  21.784   2.280  -0.754
  228    HE3  LYS  25           1HE      LYS  25  21.143   3.628   0.181
  229    HZ1  LYS  25           3HZ      LYS  25  19.921   2.105   1.200
  230    HZ2  LYS  25           1HZ      LYS  25  20.234   0.915   0.035
  231    HZ3  LYS  25           2HZ      LYS  25  18.975   2.030  -0.204
  232    H    ALA  26           H        ALA  26  18.613   3.654  -4.231
  233    HA   ALA  26           HA       ALA  26  17.964   6.169  -5.628
  234    HB1  ALA  26           1HB      ALA  26  19.793   6.475  -3.879
  235    HB2  ALA  26           2HB      ALA  26  20.219   6.929  -5.527
  236    HB3  ALA  26           3HB      ALA  26  20.784   5.397  -4.861
  Start of MODEL    8
    1    H1   LYS   1           1HT      LYS   1 -18.807  -6.959  -0.903
    2    H2   LYS   1           2HT      LYS   1 -18.692  -7.485  -2.511
    3    H3   LYS   1           3HT      LYS   1 -19.043  -8.591  -1.276
    4    HA   LYS   1           HA       LYS   1 -21.063  -8.156  -2.401
    5    HB2  LYS   1           2HB      LYS   1 -21.162  -8.265   0.084
    6    HB3  LYS   1           1HB      LYS   1 -20.981  -6.515   0.155
    7    HG2  LYS   1           2HG      LYS   1 -23.061  -6.320  -1.268
    8    HG3  LYS   1           1HG      LYS   1 -23.264  -8.066  -1.107
    9    HD2  LYS   1           2HD      LYS   1 -23.488  -7.890   1.291
   10    HD3  LYS   1           1HD      LYS   1 -23.054  -6.180   1.256
   11    HE2  LYS   1           2HE      LYS   1 -25.602  -6.982   1.338
   12    HE3  LYS   1           1HE      LYS   1 -25.113  -5.531   0.461
   13    HZ1  LYS   1           2HZ      LYS   1 -25.183  -6.640  -1.567
   14    HZ2  LYS   1           3HZ      LYS   1 -26.552  -7.233  -0.755
   15    HZ3  LYS   1           1HZ      LYS   1 -25.149  -8.177  -0.852
   16    H    LYS   2           H        LYS   2 -21.210  -5.088  -0.804
   17    HA   LYS   2           HA       LYS   2 -21.854  -3.802  -3.318
   18    HB2  LYS   2           2HB      LYS   2 -22.408  -3.337  -0.535
   19    HB3  LYS   2           1HB      LYS   2 -21.699  -1.883  -1.235
   20    HG2  LYS   2           2HG      LYS   2 -24.039  -3.407  -2.426
   21    HG3  LYS   2           1HG      LYS   2 -24.178  -1.945  -1.452
   22    HD2  LYS   2           2HD      LYS   2 -22.512  -0.912  -3.177
   23    HD3  LYS   2           1HD      LYS   2 -22.995  -2.262  -4.203
   24    HE2  LYS   2           2HE      LYS   2 -24.498   0.154  -3.457
   25    HE3  LYS   2           1HE      LYS   2 -24.694  -0.906  -4.851
   26    HZ1  LYS   2           3HZ      LYS   2 -25.732  -2.531  -3.274
   27    HZ2  LYS   2           1HZ      LYS   2 -26.625  -1.121  -3.550
   28    HZ3  LYS   2           2HZ      LYS   2 -25.748  -1.297  -2.112
   29    H    ALA   3           H        ALA   3 -20.666  -2.315  -4.388
   30    HA   ALA   3           HA       ALA   3 -18.843  -1.114  -5.086
   31    HB1  ALA   3           1HB      ALA   3 -18.673   0.418  -3.426
   32    HB2  ALA   3           2HB      ALA   3 -17.264  -0.523  -2.943
   33    HB3  ALA   3           3HB      ALA   3 -18.813  -0.793  -2.152
   34    H    LEU   4           H        LEU   4 -17.238  -2.026  -6.189
   35    HA   LEU   4           HA       LEU   4 -16.071  -4.501  -5.434
   36    HB2  LEU   4           2HB      LEU   4 -14.452  -4.028  -7.302
   37    HB3  LEU   4           1HB      LEU   4 -16.150  -3.958  -7.766
   38    HG   LEU   4           HG       LEU   4 -15.883  -1.387  -7.160
   39   HD11  LEU   4          1HD1      LEU   4 -13.631  -1.385  -6.336
   40   HD12  LEU   4          2HD1      LEU   4 -13.571  -0.657  -7.940
   41   HD13  LEU   4          3HD1      LEU   4 -13.058  -2.330  -7.713
   42   HD21  LEU   4          3HD2      LEU   4 -14.538  -2.243  -9.700
   43   HD22  LEU   4          1HD2      LEU   4 -15.753  -0.990  -9.449
   44   HD23  LEU   4          2HD2      LEU   4 -16.223  -2.689  -9.428
   45    H    LEU   5           H        LEU   5 -13.464  -4.509  -5.622
   46    HA   LEU   5           HA       LEU   5 -12.664  -2.948  -3.284
   47    HB2  LEU   5           2HB      LEU   5 -12.206  -5.537  -3.833
   48    HB3  LEU   5           1HB      LEU   5 -10.751  -4.825  -4.538
   49    HG   LEU   5           HG       LEU   5 -10.614  -3.480  -2.299
   50   HD11  LEU   5          1HD1      LEU   5 -12.790  -4.079  -1.408
   51   HD12  LEU   5          2HD1      LEU   5 -11.549  -4.799  -0.386
   52   HD13  LEU   5          3HD1      LEU   5 -12.419  -5.796  -1.547
   53   HD21  LEU   5          3HD2      LEU   5  -8.934  -4.901  -1.804
   54   HD22  LEU   5          1HD2      LEU   5  -9.456  -5.835  -3.200
   55   HD23  LEU   5          2HD2      LEU   5 -10.037  -6.255  -1.592
   56    H    ALA   6           H        ALA   6 -11.564  -1.192  -3.407
   57    HA   ALA   6           HA       ALA   6  -9.722  -0.707  -5.662
   58    HB1  ALA   6           1HB      ALA   6 -10.478   1.729  -5.530
   59    HB2  ALA   6           2HB      ALA   6 -11.855   1.151  -4.589
   60    HB3  ALA   6           3HB      ALA   6 -11.634   0.605  -6.251
   61    H    LEU   7           H        LEU   7 -10.849   1.050  -2.772
   62    HA   LEU   7           HA       LEU   7  -8.129   1.667  -2.028
   63    HB2  LEU   7           2HB      LEU   7  -9.222   2.607   0.061
   64    HB3  LEU   7           1HB      LEU   7  -9.742   3.344  -1.452
   65    HG   LEU   7           HG       LEU   7 -11.693   1.686  -1.426
   66   HD11  LEU   7          1HD1      LEU   7 -11.236   0.030   0.127
   67   HD12  LEU   7          2HD1      LEU   7 -12.158   1.136   1.146
   68   HD13  LEU   7          3HD1      LEU   7 -10.399   1.139   1.213
   69   HD21  LEU   7          3HD2      LEU   7 -13.012   3.126  -0.019
   70   HD22  LEU   7          1HD2      LEU   7 -11.772   4.134  -0.770
   71   HD23  LEU   7          2HD2      LEU   7 -11.590   3.613   0.906
   72    H    ALA   8           H        ALA   8  -7.724   1.190   0.511
   73    HA   ALA   8           HA       ALA   8  -7.273  -0.386   2.113
   74    HB1  ALA   8           1HB      ALA   8  -9.268  -2.287   0.924
   75    HB2  ALA   8           2HB      ALA   8  -9.827  -0.858   1.793
   76    HB3  ALA   8           3HB      ALA   8  -8.824  -2.053   2.615
   77    H    LEU   9           H        LEU   9  -7.602  -1.285  -1.171
   78    HA   LEU   9           HA       LEU   9  -5.679  -3.480  -0.965
   79    HB2  LEU   9           2HB      LEU   9  -7.866  -3.291  -2.474
   80    HB3  LEU   9           1HB      LEU   9  -6.744  -2.486  -3.563
   81    HG   LEU   9           HG       LEU   9  -6.355  -5.251  -2.370
   82   HD11  LEU   9          1HD1      LEU   9  -6.591  -4.777  -5.299
   83   HD12  LEU   9          2HD1      LEU   9  -8.076  -4.671  -4.356
   84   HD13  LEU   9          3HD1      LEU   9  -7.122  -6.155  -4.340
   85   HD21  LEU   9          3HD2      LEU   9  -4.498  -5.290  -4.150
   86   HD22  LEU   9          1HD2      LEU   9  -4.191  -4.303  -2.723
   87   HD23  LEU   9          2HD2      LEU   9  -4.687  -3.541  -4.235
   88    H    HIS  10           H        HIS  10  -6.173  -0.611  -2.965
   89    HA   HIS  10           HA       HIS  10  -3.523  -0.377  -3.915
   90    HB2  HIS  10           2HB      HIS  10  -5.769   1.590  -3.487
   91    HB3  HIS  10           1HB      HIS  10  -4.164   2.164  -3.938
   92    HD1  HIS  10           1HD      HIS  10  -3.793   2.298  -6.397
   93    HD2  HIS  10           2HD      HIS  10  -6.650  -0.589  -5.434
   94    HE1  HIS  10           1HE      HIS  10  -4.653   1.372  -8.597
   95    HE2  HIS  10           2HE      HIS  10  -6.383  -0.401  -8.025
   96    H    HIS  11           H        HIS  11  -5.212   0.563  -1.102
   97    HA   HIS  11           HA       HIS  11  -3.625   2.247   0.322
   98    HB2  HIS  11           2HB      HIS  11  -5.485   0.039   0.889
   99    HB3  HIS  11           1HB      HIS  11  -4.367   0.412   2.199
  100    HD1  HIS  11           1HD      HIS  11  -6.127   1.569   3.708
  101    HD2  HIS  11           2HD      HIS  11  -5.831   3.281  -0.089
  102    HE1  HIS  11           1HE      HIS  11  -7.451   3.726   3.785
  103    HE2  HIS  11           2HE      HIS  11  -7.250   4.802   1.491
  104    H    LEU  12           H        LEU  12  -3.256  -1.190  -0.174
  105    HA   LEU  12           HA       LEU  12  -0.907  -1.379   1.512
  106    HB2  LEU  12           2HB      LEU  12  -2.076  -3.360  -0.464
  107    HB3  LEU  12           1HB      LEU  12  -0.821  -3.710   0.726
  108    HG   LEU  12           HG       LEU  12  -3.438  -2.544   1.637
  109   HD11  LEU  12          1HD1      LEU  12  -3.938  -4.513   0.157
  110   HD12  LEU  12          2HD1      LEU  12  -4.409  -4.754   1.840
  111   HD13  LEU  12          3HD1      LEU  12  -2.940  -5.504   1.215
  112   HD21  LEU  12          3HD2      LEU  12  -2.853  -3.585   3.710
  113   HD22  LEU  12          1HD2      LEU  12  -1.357  -2.868   3.105
  114   HD23  LEU  12          2HD2      LEU  12  -1.636  -4.600   2.941
  115    H    ALA  13           H        ALA  13  -1.723  -1.504  -1.875
  116    HA   ALA  13           HA       ALA  13   0.827  -1.864  -2.988
  117    HB1  ALA  13           1HB      ALA  13  -1.006   0.085  -4.316
  118    HB2  ALA  13           2HB      ALA  13  -1.601  -1.563  -4.095
  119    HB3  ALA  13           3HB      ALA  13  -0.121  -1.276  -5.010
  120    H    HIS  14           H        HIS  14  -0.791   0.873  -1.647
  121    HA   HIS  14           HA       HIS  14   1.010   2.920  -2.406
  122    HB2  HIS  14           2HB      HIS  14  -0.902   3.845  -1.665
  123    HB3  HIS  14           1HB      HIS  14  -1.240   2.556  -0.540
  124    HD1  HIS  14           1HD      HIS  14   1.624   5.089  -0.735
  125    HD2  HIS  14           2HD      HIS  14  -1.237   3.681   1.953
  126    HE1  HIS  14           1HE      HIS  14   2.042   6.284   1.456
  127    HE2  HIS  14           2HE      HIS  14   0.300   5.455   3.099
  128    H    LEU  15           H        LEU  15   0.632   1.039   0.562
  129    HA   LEU  15           HA       LEU  15   2.870   2.074   1.927
  130    HB2  LEU  15           2HB      LEU  15   1.394  -0.548   2.012
  131    HB3  LEU  15           1HB      LEU  15   2.904  -0.372   2.897
  132    HG   LEU  15           HG       LEU  15   1.982   1.016   4.459
  133   HD11  LEU  15          1HD1      LEU  15   0.188   2.032   2.247
  134   HD12  LEU  15          2HD1      LEU  15   1.486   2.905   3.059
  135   HD13  LEU  15          3HD1      LEU  15   0.002   2.527   3.930
  136   HD21  LEU  15          3HD2      LEU  15   0.577  -1.060   4.286
  137   HD22  LEU  15          1HD2      LEU  15  -0.566  -0.134   3.311
  138   HD23  LEU  15          2HD2      LEU  15  -0.266   0.322   4.989
  139    H    ALA  16           H        ALA  16   2.284  -0.334  -0.415
  140    HA   ALA  16           HA       ALA  16   4.904  -1.480  -0.483
  141    HB1  ALA  16           1HB      ALA  16   3.369  -1.487  -3.004
  142    HB2  ALA  16           2HB      ALA  16   2.515  -2.153  -1.610
  143    HB3  ALA  16           3HB      ALA  16   4.063  -2.838  -2.104
  144    H    LEU  17           H        LEU  17   3.394   1.264  -1.960
  145    HA   LEU  17           HA       LEU  17   5.226   1.785  -4.012
  146    HB2  LEU  17           2HB      LEU  17   3.742   3.409  -4.436
  147    HB3  LEU  17           1HB      LEU  17   2.931   3.016  -2.931
  148    HG   LEU  17           HG       LEU  17   4.594   4.531  -1.756
  149   HD11  LEU  17          1HD1      LEU  17   5.076   6.134  -4.152
  150   HD12  LEU  17          2HD1      LEU  17   5.849   4.550  -4.262
  151   HD13  LEU  17          3HD1      LEU  17   6.209   5.618  -2.904
  152   HD21  LEU  17          3HD2      LEU  17   3.089   6.183  -3.718
  153   HD22  LEU  17          1HD2      LEU  17   3.123   6.269  -1.960
  154   HD23  LEU  17          2HD2      LEU  17   2.168   5.022  -2.762
  155    H    HIS  18           H        HIS  18   5.161   3.014  -0.679
  156    HA   HIS  18           HA       HIS  18   7.704   4.322  -1.104
  157    HB2  HIS  18           2HB      HIS  18   7.668   4.886   1.233
  158    HB3  HIS  18           1HB      HIS  18   6.126   5.211   0.488
  159    HD1  HIS  18           1HD      HIS  18   7.731   3.052   3.064
  160    HD2  HIS  18           2HD      HIS  18   3.978   3.585   1.315
  161    HE1  HIS  18           1HE      HIS  18   6.054   1.928   4.604
  162    HE2  HIS  18           2HE      HIS  18   3.758   2.275   3.578
  163    H    LEU  19           H        LEU  19   6.535   1.435   0.431
  164    HA   LEU  19           HA       LEU  19   8.941   0.415   1.470
  165    HB2  LEU  19           2HB      LEU  19   6.404  -0.733   0.526
  166    HB3  LEU  19           1HB      LEU  19   7.783  -1.800   0.299
  167    HG   LEU  19           HG       LEU  19   8.299  -1.819   2.600
  168   HD11  LEU  19          1HD1      LEU  19   8.223   0.259   3.533
  169   HD12  LEU  19          2HD1      LEU  19   6.593  -0.213   4.009
  170   HD13  LEU  19          3HD1      LEU  19   6.843   0.755   2.557
  171   HD21  LEU  19          3HD2      LEU  19   6.466  -3.247   2.416
  172   HD22  LEU  19          1HD2      LEU  19   5.362  -1.940   1.992
  173   HD23  LEU  19          2HD2      LEU  19   5.902  -2.131   3.659
  174    H    ALA  20           H        ALA  20   7.666   0.747  -1.709
  175    HA   ALA  20           HA       ALA  20   9.674  -0.812  -3.087
  176    HB1  ALA  20           1HB      ALA  20   7.938  -0.650  -4.548
  177    HB2  ALA  20           2HB      ALA  20   8.687   0.881  -4.994
  178    HB3  ALA  20           3HB      ALA  20   7.362   0.856  -3.837
  179    H    LEU  21           H        LEU  21   8.964   2.637  -3.016
  180    HA   LEU  21           HA       LEU  21  11.275   3.571  -4.228
  181    HB2  LEU  21           2HB      LEU  21   9.217   4.708  -2.474
  182    HB3  LEU  21           1HB      LEU  21  10.786   5.488  -2.296
  183    HG   LEU  21           HG       LEU  21   9.429   6.588  -4.045
  184   HD11  LEU  21          1HD1      LEU  21  11.206   6.851  -5.503
  185   HD12  LEU  21          2HD1      LEU  21  11.548   5.122  -5.564
  186   HD13  LEU  21          3HD1      LEU  21  12.035   6.070  -4.156
  187   HD21  LEU  21          3HD2      LEU  21   9.699   4.107  -5.724
  188   HD22  LEU  21          1HD2      LEU  21   8.592   5.465  -5.925
  189   HD23  LEU  21          2HD2      LEU  21   8.321   4.287  -4.640
  190    H    ALA  22           H        ALA  22  10.665   2.827  -0.858
  191    HA   ALA  22           HA       ALA  22  13.129   3.625   0.219
  192    HB1  ALA  22           1HB      ALA  22  12.643   2.066   2.053
  193    HB2  ALA  22           2HB      ALA  22  11.382   1.309   1.078
  194    HB3  ALA  22           3HB      ALA  22  11.202   2.982   1.607
  195    H    LEU  23           H        LEU  23  12.109   0.640  -1.301
  196    HA   LEU  23           HA       LEU  23  14.596  -0.744  -0.911
  197    HB2  LEU  23           2HB      LEU  23  12.155  -1.252  -2.607
  198    HB3  LEU  23           1HB      LEU  23  13.599  -2.252  -2.750
  199    HG   LEU  23           HG       LEU  23  12.321  -1.732  -0.061
  200   HD11  LEU  23          1HD1      LEU  23  11.113  -3.876  -0.349
  201   HD12  LEU  23          2HD1      LEU  23  11.689  -3.970  -2.016
  202   HD13  LEU  23          3HD1      LEU  23  10.586  -2.676  -1.537
  203   HD21  LEU  23          3HD2      LEU  23  14.330  -3.644  -1.239
  204   HD22  LEU  23          1HD2      LEU  23  13.395  -4.135   0.171
  205   HD23  LEU  23          2HD2      LEU  23  14.429  -2.710   0.255
  206    H    LYS  24           H        LYS  24  12.950   0.611  -3.709
  207    HA   LYS  24           HA       LYS  24  15.008   0.335  -5.581
  208    HB2  LYS  24           2HB      LYS  24  12.457   1.312  -5.647
  209    HB3  LYS  24           1HB      LYS  24  13.387   2.801  -5.798
  210    HG2  LYS  24           2HG      LYS  24  13.639   0.344  -7.567
  211    HG3  LYS  24           1HG      LYS  24  12.888   1.871  -8.014
  212    HD2  LYS  24           2HD      LYS  24  15.810   1.536  -7.255
  213    HD3  LYS  24           1HD      LYS  24  15.204   1.664  -8.901
  214    HE2  LYS  24           2HE      LYS  24  15.057   3.915  -8.764
  215    HE3  LYS  24           1HE      LYS  24  14.177   3.831  -7.243
  216    HZ1  LYS  24           3HZ      LYS  24  16.045   4.715  -6.394
  217    HZ2  LYS  24           1HZ      LYS  24  16.999   4.241  -7.718
  218    HZ3  LYS  24           2HZ      LYS  24  16.656   3.125  -6.481
  219    H    LYS  25           H        LYS  25  14.327   2.827  -3.238
  220    HA   LYS  25           HA       LYS  25  15.810   4.274  -2.183
  221    HB2  LYS  25           2HB      LYS  25  17.733   2.817  -2.985
  222    HB3  LYS  25           1HB      LYS  25  17.778   3.820  -4.435
  223    HG2  LYS  25           2HG      LYS  25  17.692   5.670  -2.341
  224    HG3  LYS  25           1HG      LYS  25  18.773   4.409  -1.753
  225    HD2  LYS  25           2HD      LYS  25  20.318   5.630  -2.932
  226    HD3  LYS  25           1HD      LYS  25  19.725   4.634  -4.262
  227    HE2  LYS  25           2HE      LYS  25  19.700   6.936  -5.008
  228    HE3  LYS  25           1HE      LYS  25  18.028   6.443  -4.749
  229    HZ1  LYS  25           3HZ      LYS  25  19.425   8.549  -3.547
  230    HZ2  LYS  25           1HZ      LYS  25  19.032   7.436  -2.331
  231    HZ3  LYS  25           2HZ      LYS  25  17.800   8.099  -3.313
  232    H    ALA  26           H        ALA  26  14.772   6.139  -2.414
  233    HA   ALA  26           HA       ALA  26  14.157   7.297  -4.964
  234    HB1  ALA  26           1HB      ALA  26  12.827   8.719  -3.782
  235    HB2  ALA  26           2HB      ALA  26  14.060   9.015  -2.558
  236    HB3  ALA  26           3HB      ALA  26  13.083   7.548  -2.483
  Start of MODEL    9
    1    H1   LYS   1           1HT      LYS   1 -25.784  -3.619  -0.954
    2    H2   LYS   1           2HT      LYS   1 -27.298  -3.031  -0.463
    3    H3   LYS   1           3HT      LYS   1 -26.238  -3.707   0.670
    4    HA   LYS   1           HA       LYS   1 -26.100  -1.100  -0.682
    5    HB2  LYS   1           2HB      LYS   1 -26.023  -2.156   2.140
    6    HB3  LYS   1           1HB      LYS   1 -25.361  -0.566   1.771
    7    HG2  LYS   1           2HG      LYS   1 -27.968  -0.933   0.521
    8    HG3  LYS   1           1HG      LYS   1 -28.056  -1.183   2.265
    9    HD2  LYS   1           2HD      LYS   1 -26.390   1.097   1.785
   10    HD3  LYS   1           1HD      LYS   1 -27.865   1.294   0.843
   11    HE2  LYS   1           2HE      LYS   1 -27.655   0.798   3.828
   12    HE3  LYS   1           1HE      LYS   1 -28.279   2.238   3.027
   13    HZ1  LYS   1           2HZ      LYS   1 -29.822   0.362   1.946
   14    HZ2  LYS   1           3HZ      LYS   1 -30.234   1.214   3.354
   15    HZ3  LYS   1           1HZ      LYS   1 -29.554  -0.333   3.473
   16    H    LYS   2           H        LYS   2 -24.304  -1.151  -1.966
   17    HA   LYS   2           HA       LYS   2 -21.837  -2.353  -0.971
   18    HB2  LYS   2           2HB      LYS   2 -22.951  -1.983  -3.520
   19    HB3  LYS   2           1HB      LYS   2 -21.570  -0.892  -3.463
   20    HG2  LYS   2           2HG      LYS   2 -21.252  -3.704  -2.450
   21    HG3  LYS   2           1HG      LYS   2 -21.232  -3.402  -4.187
   22    HD2  LYS   2           2HD      LYS   2 -19.548  -1.626  -2.474
   23    HD3  LYS   2           1HD      LYS   2 -18.993  -3.284  -2.720
   24    HE2  LYS   2           2HE      LYS   2 -18.967  -3.022  -5.104
   25    HE3  LYS   2           1HE      LYS   2 -19.833  -1.488  -5.016
   26    HZ1  LYS   2           3HZ      LYS   2 -17.600  -0.924  -5.328
   27    HZ2  LYS   2           1HZ      LYS   2 -17.049  -2.070  -4.204
   28    HZ3  LYS   2           2HZ      LYS   2 -17.863  -0.679  -3.666
   29    H    ALA   3           H        ALA   3 -20.133  -1.255  -0.209
   30    HA   ALA   3           HA       ALA   3 -20.454   1.593   0.283
   31    HB1  ALA   3           1HB      ALA   3 -18.950   1.317   1.952
   32    HB2  ALA   3           2HB      ALA   3 -17.894   0.300   0.977
   33    HB3  ALA   3           3HB      ALA   3 -19.317  -0.394   1.751
   34    H    LEU   4           H        LEU   4 -19.075   3.207  -0.483
   35    HA   LEU   4           HA       LEU   4 -18.083   2.837  -3.127
   36    HB2  LEU   4           2HB      LEU   4 -17.648   5.084  -1.138
   37    HB3  LEU   4           1HB      LEU   4 -17.159   5.142  -2.831
   38    HG   LEU   4           HG       LEU   4 -20.002   4.605  -1.937
   39   HD11  LEU   4          1HD1      LEU   4 -20.295   7.015  -2.835
   40   HD12  LEU   4          2HD1      LEU   4 -18.558   7.173  -2.579
   41   HD13  LEU   4          3HD1      LEU   4 -19.621   6.817  -1.217
   42   HD21  LEU   4          3HD2      LEU   4 -18.593   5.073  -4.552
   43   HD22  LEU   4          1HD2      LEU   4 -20.294   5.491  -4.383
   44   HD23  LEU   4          2HD2      LEU   4 -19.768   3.827  -4.135
   45    H    LEU   5           H        LEU   5 -16.156   4.206  -0.547
   46    HA   LEU   5           HA       LEU   5 -13.810   4.107  -0.338
   47    HB2  LEU   5           2HB      LEU   5 -15.155   1.612   0.579
   48    HB3  LEU   5           1HB      LEU   5 -13.390   1.623   0.552
   49    HG   LEU   5           HG       LEU   5 -13.291   3.541   1.998
   50   HD11  LEU   5          1HD1      LEU   5 -15.586   4.421   2.895
   51   HD12  LEU   5          2HD1      LEU   5 -16.238   3.740   1.409
   52   HD13  LEU   5          3HD1      LEU   5 -15.002   4.993   1.332
   53   HD21  LEU   5          3HD2      LEU   5 -15.503   1.789   3.102
   54   HD22  LEU   5          1HD2      LEU   5 -14.265   2.659   4.010
   55   HD23  LEU   5          2HD2      LEU   5 -13.816   1.272   3.013
   56    H    ALA   6           H        ALA   6 -14.073   0.723  -1.163
   57    HA   ALA   6           HA       ALA   6 -13.101  -0.581  -2.768
   58    HB1  ALA   6           1HB      ALA   6 -12.735   0.352  -5.009
   59    HB2  ALA   6           2HB      ALA   6 -12.994   1.978  -4.384
   60    HB3  ALA   6           3HB      ALA   6 -14.318   0.815  -4.388
   61    H    LEU   7           H        LEU   7 -11.501   2.597  -2.691
   62    HA   LEU   7           HA       LEU   7  -8.893   1.509  -3.153
   63    HB2  LEU   7           2HB      LEU   7  -9.980   4.201  -2.389
   64    HB3  LEU   7           1HB      LEU   7  -8.255   3.885  -2.197
   65    HG   LEU   7           HG       LEU   7  -8.872   4.866  -4.446
   66   HD11  LEU   7          1HD1      LEU   7  -6.886   3.265  -3.903
   67   HD12  LEU   7          2HD1      LEU   7  -7.292   3.562  -5.594
   68   HD13  LEU   7          3HD1      LEU   7  -7.812   2.073  -4.807
   69   HD21  LEU   7          3HD2      LEU   7 -10.114   3.604  -6.024
   70   HD22  LEU   7          1HD2      LEU   7 -11.032   3.429  -4.523
   71   HD23  LEU   7          2HD2      LEU   7  -9.980   2.126  -5.071
   72    H    ALA   8           H        ALA   8  -9.464  -0.157  -1.444
   73    HA   ALA   8           HA       ALA   8  -8.495   0.730   1.221
   74    HB1  ALA   8           1HB      ALA   8 -10.520  -0.181   1.792
   75    HB2  ALA   8           2HB      ALA   8  -9.581  -1.673   1.738
   76    HB3  ALA   8           3HB      ALA   8 -10.579  -1.207   0.359
   77    H    LEU   9           H        LEU   9  -8.070  -1.314  -1.482
   78    HA   LEU   9           HA       LEU   9  -6.097  -3.033  -0.181
   79    HB2  LEU   9           2HB      LEU   9  -6.665  -3.045  -3.104
   80    HB3  LEU   9           1HB      LEU   9  -6.221  -4.383  -2.047
   81    HG   LEU   9           HG       LEU   9  -8.896  -2.946  -2.119
   82   HD11  LEU   9          1HD1      LEU   9  -9.161  -4.471  -3.797
   83   HD12  LEU   9          2HD1      LEU   9  -9.423  -5.581  -2.459
   84   HD13  LEU   9          3HD1      LEU   9  -7.841  -5.491  -3.225
   85   HD21  LEU   9          3HD2      LEU   9  -9.470  -4.869  -0.474
   86   HD22  LEU   9          1HD2      LEU   9  -8.584  -3.481   0.158
   87   HD23  LEU   9          2HD2      LEU   9  -7.730  -4.976  -0.216
   88    H    HIS  10           H        HIS  10  -6.286  -0.881  -2.967
   89    HA   HIS  10           HA       HIS  10  -3.682  -0.775  -3.832
   90    HB2  HIS  10           2HB      HIS  10  -5.845   1.251  -3.588
   91    HB3  HIS  10           1HB      HIS  10  -4.220   1.863  -3.872
   92    HD1  HIS  10           1HD      HIS  10  -3.009   1.073  -6.086
   93    HD2  HIS  10           2HD      HIS  10  -7.026  -0.034  -5.788
   94    HE1  HIS  10           1HE      HIS  10  -3.741   0.387  -8.416
   95    HE2  HIS  10           2HE      HIS  10  -6.192  -0.309  -8.250
   96    H    HIS  11           H        HIS  11  -5.149   0.476  -1.002
   97    HA   HIS  11           HA       HIS  11  -3.422   2.170   0.220
   98    HB2  HIS  11           2HB      HIS  11  -5.295   0.053   1.009
   99    HB3  HIS  11           1HB      HIS  11  -4.026   0.344   2.205
  100    HD1  HIS  11           1HD      HIS  11  -4.974   1.895   3.940
  101    HD2  HIS  11           2HD      HIS  11  -6.102   3.030   0.081
  102    HE1  HIS  11           1HE      HIS  11  -6.266   4.064   4.168
  103    HE2  HIS  11           2HE      HIS  11  -6.939   4.779   1.830
  104    H    LEU  12           H        LEU  12  -3.255  -1.301   0.019
  105    HA   LEU  12           HA       LEU  12  -0.828  -1.649   1.477
  106    HB2  LEU  12           2HB      LEU  12  -1.952  -3.486  -0.646
  107    HB3  LEU  12           1HB      LEU  12  -0.898  -3.920   0.698
  108    HG   LEU  12           HG       LEU  12  -3.656  -2.738   1.118
  109   HD11  LEU  12          1HD1      LEU  12  -3.081  -5.671   1.430
  110   HD12  LEU  12          2HD1      LEU  12  -3.478  -5.033  -0.167
  111   HD13  LEU  12          3HD1      LEU  12  -4.626  -4.856   1.160
  112   HD21  LEU  12          3HD2      LEU  12  -3.339  -3.948   3.345
  113   HD22  LEU  12          1HD2      LEU  12  -2.270  -2.567   3.082
  114   HD23  LEU  12          2HD2      LEU  12  -1.664  -4.208   2.869
  115    H    ALA  13           H        ALA  13  -1.708  -1.610  -1.902
  116    HA   ALA  13           HA       ALA  13   0.857  -1.909  -3.025
  117    HB1  ALA  13           1HB      ALA  13  -1.345  -0.176  -4.166
  118    HB2  ALA  13           2HB      ALA  13  -1.340  -1.934  -4.286
  119    HB3  ALA  13           3HB      ALA  13  -0.060  -0.994  -5.050
  120    H    HIS  14           H        HIS  14  -0.781   0.770  -1.589
  121    HA   HIS  14           HA       HIS  14   1.012   2.819  -2.453
  122    HB2  HIS  14           2HB      HIS  14  -0.803   3.905  -1.792
  123    HB3  HIS  14           1HB      HIS  14  -1.373   2.580  -0.808
  124    HD1  HIS  14           1HD      HIS  14   1.444   5.166  -0.569
  125    HD2  HIS  14           2HD      HIS  14  -1.417   3.315   1.838
  126    HE1  HIS  14           1HE      HIS  14   1.715   6.146   1.752
  127    HE2  HIS  14           2HE      HIS  14  -0.033   5.040   3.232
  128    H    LEU  15           H        LEU  15   0.617   0.986   0.535
  129    HA   LEU  15           HA       LEU  15   2.835   2.083   1.922
  130    HB2  LEU  15           2HB      LEU  15   1.343  -0.529   2.015
  131    HB3  LEU  15           1HB      LEU  15   2.878  -0.408   2.861
  132    HG   LEU  15           HG       LEU  15   1.865   0.606   4.579
  133   HD11  LEU  15          1HD1      LEU  15   0.492   2.741   4.176
  134   HD12  LEU  15          2HD1      LEU  15   0.955   2.574   2.485
  135   HD13  LEU  15          3HD1      LEU  15   2.194   2.790   3.720
  136   HD21  LEU  15          3HD2      LEU  15  -0.576   0.656   4.669
  137   HD22  LEU  15          1HD2      LEU  15  -0.039  -0.822   3.874
  138   HD23  LEU  15          2HD2      LEU  15  -0.658   0.519   2.914
  139    H    ALA  16           H        ALA  16   2.313  -0.265  -0.467
  140    HA   ALA  16           HA       ALA  16   4.977  -1.349  -0.513
  141    HB1  ALA  16           1HB      ALA  16   2.689  -2.271  -1.520
  142    HB2  ALA  16           2HB      ALA  16   4.245  -2.700  -2.230
  143    HB3  ALA  16           3HB      ALA  16   3.271  -1.423  -2.954
  144    H    LEU  17           H        LEU  17   3.333   1.301  -2.022
  145    HA   LEU  17           HA       LEU  17   5.119   1.866  -4.101
  146    HB2  LEU  17           2HB      LEU  17   3.383   3.248  -4.453
  147    HB3  LEU  17           1HB      LEU  17   2.918   3.218  -2.766
  148    HG   LEU  17           HG       LEU  17   5.367   4.789  -3.325
  149   HD11  LEU  17          1HD1      LEU  17   2.649   5.685  -4.331
  150   HD12  LEU  17          2HD1      LEU  17   4.043   5.299  -5.341
  151   HD13  LEU  17          3HD1      LEU  17   4.096   6.690  -4.258
  152   HD21  LEU  17          3HD2      LEU  17   3.874   6.428  -1.940
  153   HD22  LEU  17          1HD2      LEU  17   4.503   4.988  -1.139
  154   HD23  LEU  17          2HD2      LEU  17   2.836   5.023  -1.707
  155    H    HIS  18           H        HIS  18   5.075   3.143  -0.773
  156    HA   HIS  18           HA       HIS  18   7.551   4.553  -1.267
  157    HB2  HIS  18           2HB      HIS  18   7.543   5.131   1.055
  158    HB3  HIS  18           1HB      HIS  18   5.920   5.274   0.421
  159    HD1  HIS  18           1HD      HIS  18   7.959   3.286   2.822
  160    HD2  HIS  18           2HD      HIS  18   4.057   3.399   1.357
  161    HE1  HIS  18           1HE      HIS  18   6.576   1.839   4.372
  162    HE2  HIS  18           2HE      HIS  18   4.190   1.900   3.510
  163    H    LEU  19           H        LEU  19   6.569   1.610   0.287
  164    HA   LEU  19           HA       LEU  19   9.018   0.654   1.247
  165    HB2  LEU  19           2HB      LEU  19   6.468  -0.496   0.508
  166    HB3  LEU  19           1HB      LEU  19   7.775  -1.536  -0.044
  167    HG   LEU  19           HG       LEU  19   7.124  -2.160   2.203
  168   HD11  LEU  19          1HD1      LEU  19   9.741  -1.421   1.424
  169   HD12  LEU  19          2HD1      LEU  19   9.289  -2.577   2.675
  170   HD13  LEU  19          3HD1      LEU  19   9.553  -0.885   3.091
  171   HD21  LEU  19          3HD2      LEU  19   6.151  -0.041   2.928
  172   HD22  LEU  19          1HD2      LEU  19   7.739   0.721   2.886
  173   HD23  LEU  19          2HD2      LEU  19   7.395  -0.531   4.075
  174    H    ALA  20           H        ALA  20   7.683   0.987  -1.898
  175    HA   ALA  20           HA       ALA  20   9.590  -0.536  -3.389
  176    HB1  ALA  20           1HB      ALA  20   8.469   1.861  -4.698
  177    HB2  ALA  20           2HB      ALA  20   7.268   0.750  -4.044
  178    HB3  ALA  20           3HB      ALA  20   8.444   0.180  -5.226
  179    H    LEU  21           H        LEU  21   9.203   2.951  -3.029
  180    HA   LEU  21           HA       LEU  21  11.638   3.764  -4.095
  181    HB2  LEU  21           2HB      LEU  21   9.754   4.929  -2.091
  182    HB3  LEU  21           1HB      LEU  21  11.357   5.647  -2.228
  183    HG   LEU  21           HG       LEU  21   9.749   6.792  -3.716
  184   HD11  LEU  21          1HD1      LEU  21  11.497   5.187  -5.561
  185   HD12  LEU  21          2HD1      LEU  21  12.252   6.212  -4.338
  186   HD13  LEU  21          3HD1      LEU  21  11.181   6.923  -5.548
  187   HD21  LEU  21          3HD2      LEU  21   8.292   4.765  -4.075
  188   HD22  LEU  21          1HD2      LEU  21   9.523   4.139  -5.169
  189   HD23  LEU  21          2HD2      LEU  21   8.681   5.636  -5.554
  190    H    ALA  22           H        ALA  22  10.754   2.792  -0.852
  191    HA   ALA  22           HA       ALA  22  13.219   3.195   0.433
  192    HB1  ALA  22           1HB      ALA  22  11.506   0.833   1.116
  193    HB2  ALA  22           2HB      ALA  22  10.879   2.454   1.392
  194    HB3  ALA  22           3HB      ALA  22  12.358   1.935   2.196
  195    H    LEU  23           H        LEU  23  11.918   0.488  -1.389
  196    HA   LEU  23           HA       LEU  23  14.179  -1.223  -1.057
  197    HB2  LEU  23           2HB      LEU  23  11.847  -1.918  -1.827
  198    HB3  LEU  23           1HB      LEU  23  12.273  -1.247  -3.396
  199    HG   LEU  23           HG       LEU  23  14.402  -2.737  -3.213
  200   HD11  LEU  23          1HD1      LEU  23  12.728  -4.619  -1.626
  201   HD12  LEU  23          2HD1      LEU  23  13.464  -3.294  -0.726
  202   HD13  LEU  23          3HD1      LEU  23  14.476  -4.406  -1.643
  203   HD21  LEU  23          3HD2      LEU  23  13.266  -4.538  -4.327
  204   HD22  LEU  23          1HD2      LEU  23  12.418  -3.057  -4.764
  205   HD23  LEU  23          2HD2      LEU  23  11.734  -4.143  -3.555
  206    H    LYS  24           H        LYS  24  13.052   0.867  -3.657
  207    HA   LYS  24           HA       LYS  24  15.176   0.589  -5.441
  208    HB2  LYS  24           2HB      LYS  24  13.047   1.883  -5.843
  209    HB3  LYS  24           1HB      LYS  24  13.717   3.176  -4.851
  210    HG2  LYS  24           2HG      LYS  24  15.520   2.190  -6.982
  211    HG3  LYS  24           1HG      LYS  24  14.057   2.989  -7.556
  212    HD2  LYS  24           2HD      LYS  24  14.779   5.025  -6.891
  213    HD3  LYS  24           1HD      LYS  24  15.322   4.417  -5.329
  214    HE2  LYS  24           2HE      LYS  24  17.190   5.289  -6.735
  215    HE3  LYS  24           1HE      LYS  24  17.385   3.595  -6.301
  216    HZ1  LYS  24           3HZ      LYS  24  17.271   4.715  -8.860
  217    HZ2  LYS  24           1HZ      LYS  24  15.912   3.719  -8.676
  218    HZ3  LYS  24           2HZ      LYS  24  17.465   3.086  -8.428
  219    H    LYS  25           H        LYS  25  14.755   2.687  -2.674
  220    HA   LYS  25           HA       LYS  25  16.190   4.071  -1.514
  221    HB2  LYS  25           2HB      LYS  25  16.831   1.492  -1.189
  222    HB3  LYS  25           1HB      LYS  25  18.352   2.075  -1.861
  223    HG2  LYS  25           2HG      LYS  25  17.896   4.049  -0.077
  224    HG3  LYS  25           1HG      LYS  25  17.046   2.739   0.739
  225    HD2  LYS  25           2HD      LYS  25  18.965   1.548   1.144
  226    HD3  LYS  25           1HD      LYS  25  19.750   2.095  -0.337
  227    HE2  LYS  25           2HE      LYS  25  19.336   3.752   2.173
  228    HE3  LYS  25           1HE      LYS  25  20.865   3.059   1.634
  229    HZ1  LYS  25           3HZ      LYS  25  20.784   5.326   0.957
  230    HZ2  LYS  25           1HZ      LYS  25  19.257   5.140   0.255
  231    HZ3  LYS  25           2HZ      LYS  25  20.615   4.375  -0.445
  232    H    ALA  26           H        ALA  26  19.075   3.982  -1.636
  233    HA   ALA  26           HA       ALA  26  19.825   4.923  -4.293
  234    HB1  ALA  26           1HB      ALA  26  20.213   6.765  -1.930
  235    HB2  ALA  26           2HB      ALA  26  18.784   6.874  -2.957
  236    HB3  ALA  26           3HB      ALA  26  20.387   7.139  -3.643
  Start of MODEL   10
    1    H1   LYS   1           1HT      LYS   1 -19.709   8.006 -12.281
    2    H2   LYS   1           2HT      LYS   1 -18.953   7.316 -10.928
    3    H3   LYS   1           3HT      LYS   1 -20.648   7.408 -11.006
    4    HA   LYS   1           HA       LYS   1 -20.556   5.319 -11.701
    5    HB2  LYS   1           2HB      LYS   1 -20.213   5.098 -14.158
    6    HB3  LYS   1           1HB      LYS   1 -21.203   6.500 -13.756
    7    HG2  LYS   1           2HG      LYS   1 -19.439   8.021 -14.175
    8    HG3  LYS   1           1HG      LYS   1 -18.211   6.754 -14.107
    9    HD2  LYS   1           2HD      LYS   1 -18.954   5.814 -16.199
   10    HD3  LYS   1           1HD      LYS   1 -20.385   6.846 -16.214
   11    HE2  LYS   1           2HE      LYS   1 -18.266   7.496 -17.650
   12    HE3  LYS   1           1HE      LYS   1 -19.177   8.746 -16.807
   13    HZ1  LYS   1           2HZ      LYS   1 -16.825   8.994 -16.411
   14    HZ2  LYS   1           3HZ      LYS   1 -16.715   7.409 -15.816
   15    HZ3  LYS   1           1HZ      LYS   1 -17.599   8.576 -14.967
   16    H    LYS   2           H        LYS   2 -18.559   4.524 -13.922
   17    HA   LYS   2           HA       LYS   2 -16.597   3.346 -14.013
   18    HB2  LYS   2           2HB      LYS   2 -15.943   5.904 -13.203
   19    HB3  LYS   2           1HB      LYS   2 -15.182   4.920 -11.962
   20    HG2  LYS   2           2HG      LYS   2 -14.839   4.501 -14.948
   21    HG3  LYS   2           1HG      LYS   2 -13.684   5.342 -13.920
   22    HD2  LYS   2           2HD      LYS   2 -13.308   3.322 -12.607
   23    HD3  LYS   2           1HD      LYS   2 -14.559   2.462 -13.502
   24    HE2  LYS   2           2HE      LYS   2 -12.013   3.595 -14.702
   25    HE3  LYS   2           1HE      LYS   2 -12.300   1.896 -14.338
   26    HZ1  LYS   2           3HZ      LYS   2 -14.395   3.055 -15.912
   27    HZ2  LYS   2           1HZ      LYS   2 -13.495   1.648 -16.184
   28    HZ3  LYS   2           2HZ      LYS   2 -12.887   3.156 -16.678
   29    H    ALA   3           H        ALA   3 -14.797   3.391 -11.476
   30    HA   ALA   3           HA       ALA   3 -16.224   1.180 -10.153
   31    HB1  ALA   3           1HB      ALA   3 -13.967   0.643  -9.207
   32    HB2  ALA   3           2HB      ALA   3 -13.298   1.956 -10.179
   33    HB3  ALA   3           3HB      ALA   3 -14.037   0.559 -10.967
   34    H    LEU   4           H        LEU   4 -17.551   2.223  -8.687
   35    HA   LEU   4           HA       LEU   4 -16.845   4.435  -7.103
   36    HB2  LEU   4           2HB      LEU   4 -19.170   3.360  -7.441
   37    HB3  LEU   4           1HB      LEU   4 -18.688   2.212  -6.197
   38    HG   LEU   4           HG       LEU   4 -20.008   4.244  -5.390
   39   HD11  LEU   4          1HD1      LEU   4 -19.026   4.013  -3.349
   40   HD12  LEU   4          2HD1      LEU   4 -17.416   4.393  -3.967
   41   HD13  LEU   4          3HD1      LEU   4 -18.079   2.767  -4.161
   42   HD21  LEU   4          3HD2      LEU   4 -18.477   5.755  -6.938
   43   HD22  LEU   4          1HD2      LEU   4 -17.422   5.767  -5.524
   44   HD23  LEU   4          2HD2      LEU   4 -19.073   6.375  -5.400
   45    H    LEU   5           H        LEU   5 -15.685   4.605  -5.234
   46    HA   LEU   5           HA       LEU   5 -14.268   4.030  -3.516
   47    HB2  LEU   5           2HB      LEU   5 -15.762   2.713  -2.351
   48    HB3  LEU   5           1HB      LEU   5 -16.054   1.642  -3.713
   49    HG   LEU   5           HG       LEU   5 -13.812   0.632  -3.387
   50   HD11  LEU   5          1HD1      LEU   5 -13.681   2.751  -1.266
   51   HD12  LEU   5          2HD1      LEU   5 -12.441   2.225  -2.397
   52   HD13  LEU   5          3HD1      LEU   5 -12.839   1.226  -1.008
   53   HD21  LEU   5          3HD2      LEU   5 -15.608   0.706  -0.943
   54   HD22  LEU   5          1HD2      LEU   5 -14.344  -0.496  -1.216
   55   HD23  LEU   5          2HD2      LEU   5 -15.729  -0.410  -2.305
   56    H    ALA   6           H        ALA   6 -14.565   1.179  -5.611
   57    HA   ALA   6           HA       ALA   6 -13.048  -0.071  -6.771
   58    HB1  ALA   6           1HB      ALA   6 -11.534   2.541  -6.932
   59    HB2  ALA   6           2HB      ALA   6 -12.847   2.062  -8.001
   60    HB3  ALA   6           3HB      ALA   6 -11.343   1.148  -7.997
   61    H    LEU   7           H        LEU   7 -10.919   2.187  -5.017
   62    HA   LEU   7           HA       LEU   7  -8.855   0.359  -4.705
   63    HB2  LEU   7           2HB      LEU   7  -7.915   1.827  -3.026
   64    HB3  LEU   7           1HB      LEU   7  -8.566   2.775  -4.359
   65    HG   LEU   7           HG       LEU   7 -10.681   3.064  -2.974
   66   HD11  LEU   7          1HD1      LEU   7  -9.867   2.823  -0.402
   67   HD12  LEU   7          2HD1      LEU   7  -9.014   1.464  -1.120
   68   HD13  LEU   7          3HD1      LEU   7 -10.764   1.567  -1.246
   69   HD21  LEU   7          3HD2      LEU   7  -9.805   4.934  -1.850
   70   HD22  LEU   7          1HD2      LEU   7  -8.648   4.671  -3.154
   71   HD23  LEU   7          2HD2      LEU   7  -8.271   4.130  -1.517
   72    H    ALA   8           H        ALA   8  -7.951  -0.427  -2.677
   73    HA   ALA   8           HA       ALA   8  -9.251  -1.027  -0.328
   74    HB1  ALA   8           1HB      ALA   8  -9.505  -3.564  -1.815
   75    HB2  ALA   8           2HB      ALA   8 -10.663  -2.329  -2.285
   76    HB3  ALA   8           3HB      ALA   8 -10.576  -2.859  -0.611
   77    H    LEU   9           H        LEU   9  -7.422  -2.491  -2.919
   78    HA   LEU   9           HA       LEU   9  -5.533  -3.733  -1.063
   79    HB2  LEU   9           2HB      LEU   9  -5.916  -3.779  -4.029
   80    HB3  LEU   9           1HB      LEU   9  -4.439  -4.378  -3.286
   81    HG   LEU   9           HG       LEU   9  -5.521  -6.178  -2.266
   82   HD11  LEU   9          1HD1      LEU   9  -8.008  -6.267  -1.971
   83   HD12  LEU   9          2HD1      LEU   9  -8.101  -4.620  -2.599
   84   HD13  LEU   9          3HD1      LEU   9  -7.258  -4.941  -1.083
   85   HD21  LEU   9          3HD2      LEU   9  -7.461  -5.870  -4.531
   86   HD22  LEU   9          1HD2      LEU   9  -6.555  -7.297  -4.026
   87   HD23  LEU   9          2HD2      LEU   9  -5.741  -5.992  -4.889
   88    H    HIS  10           H        HIS  10  -5.575  -1.443  -3.737
   89    HA   HIS  10           HA       HIS  10  -3.000  -0.601  -3.991
   90    HB2  HIS  10           2HB      HIS  10  -5.612   0.736  -4.147
   91    HB3  HIS  10           1HB      HIS  10  -4.265   1.827  -3.852
   92    HD1  HIS  10           1HD      HIS  10  -2.328   1.863  -5.660
   93    HD2  HIS  10           2HD      HIS  10  -5.684  -0.375  -6.743
   94    HE1  HIS  10           1HE      HIS  10  -2.116   1.396  -8.144
   95    HE2  HIS  10           2HE      HIS  10  -4.147   0.027  -8.817
   96    H    HIS  11           H        HIS  11  -5.225  -0.018  -1.448
   97    HA   HIS  11           HA       HIS  11  -4.201   1.857   0.206
   98    HB2  HIS  11           2HB      HIS  11  -5.587  -0.738   0.468
   99    HB3  HIS  11           1HB      HIS  11  -4.754  -0.203   1.928
  100    HD1  HIS  11           1HD      HIS  11  -5.301   2.510   2.512
  101    HD2  HIS  11           2HD      HIS  11  -8.084   0.361   0.271
  102    HE1  HIS  11           1HE      HIS  11  -7.497   3.768   2.688
  103    HE2  HIS  11           2HE      HIS  11  -9.209   2.462   1.339
  104    H    LEU  12           H        LEU  12  -3.204  -1.463  -0.137
  105    HA   LEU  12           HA       LEU  12  -0.954  -1.251   1.655
  106    HB2  LEU  12           2HB      LEU  12  -1.617  -3.392  -0.385
  107    HB3  LEU  12           1HB      LEU  12  -0.466  -3.538   0.945
  108    HG   LEU  12           HG       LEU  12  -3.157  -2.668   1.789
  109   HD11  LEU  12          1HD1      LEU  12  -4.398  -4.517   1.228
  110   HD12  LEU  12          2HD1      LEU  12  -2.995  -5.579   1.178
  111   HD13  LEU  12          3HD1      LEU  12  -3.328  -4.499  -0.175
  112   HD21  LEU  12          3HD2      LEU  12  -1.444  -5.010   2.673
  113   HD22  LEU  12          1HD2      LEU  12  -2.717  -4.209   3.594
  114   HD23  LEU  12          2HD2      LEU  12  -1.208  -3.362   3.255
  115    H    ALA  13           H        ALA  13  -1.490  -1.521  -1.794
  116    HA   ALA  13           HA       ALA  13   1.094  -1.473  -2.777
  117    HB1  ALA  13           1HB      ALA  13   0.213  -0.697  -4.826
  118    HB2  ALA  13           2HB      ALA  13  -1.048   0.238  -4.029
  119    HB3  ALA  13           3HB      ALA  13  -1.153  -1.524  -4.080
  120    H    HIS  14           H        HIS  14  -0.824   1.073  -1.402
  121    HA   HIS  14           HA       HIS  14   0.825   3.280  -2.067
  122    HB2  HIS  14           2HB      HIS  14  -1.210   3.984  -1.365
  123    HB3  HIS  14           1HB      HIS  14  -1.396   2.700  -0.197
  124    HD1  HIS  14           1HD      HIS  14   0.993   5.675  -0.565
  125    HD2  HIS  14           2HD      HIS  14  -1.336   3.752   2.315
  126    HE1  HIS  14           1HE      HIS  14   1.328   6.949   1.603
  127    HE2  HIS  14           2HE      HIS  14  -0.054   5.764   3.380
  128    H    LEU  15           H        LEU  15   0.486   1.415   0.914
  129    HA   LEU  15           HA       LEU  15   2.750   2.523   2.231
  130    HB2  LEU  15           2HB      LEU  15   1.321  -0.139   2.438
  131    HB3  LEU  15           1HB      LEU  15   2.733   0.226   3.421
  132    HG   LEU  15           HG       LEU  15   1.166   0.977   4.884
  133   HD11  LEU  15          1HD1      LEU  15   2.382   3.017   4.149
  134   HD12  LEU  15          2HD1      LEU  15   0.741   3.369   4.686
  135   HD13  LEU  15          3HD1      LEU  15   1.111   3.315   2.964
  136   HD21  LEU  15          3HD2      LEU  15  -0.619   0.212   3.133
  137   HD22  LEU  15          1HD2      LEU  15  -0.731   1.929   2.765
  138   HD23  LEU  15          2HD2      LEU  15  -1.090   1.354   4.387
  139    H    ALA  16           H        ALA  16   2.168   0.078  -0.053
  140    HA   ALA  16           HA       ALA  16   4.806  -1.070  -0.016
  141    HB1  ALA  16           1HB      ALA  16   3.165  -1.194  -2.499
  142    HB2  ALA  16           2HB      ALA  16   2.493  -1.942  -1.049
  143    HB3  ALA  16           3HB      ALA  16   4.052  -2.474  -1.675
  144    H    LEU  17           H        LEU  17   3.296   1.613  -1.544
  145    HA   LEU  17           HA       LEU  17   5.040   2.068  -3.685
  146    HB2  LEU  17           2HB      LEU  17   3.686   3.816  -4.064
  147    HB3  LEU  17           1HB      LEU  17   2.778   3.271  -2.664
  148    HG   LEU  17           HG       LEU  17   4.350   4.729  -1.260
  149   HD11  LEU  17          1HD1      LEU  17   5.980   5.930  -2.262
  150   HD12  LEU  17          2HD1      LEU  17   4.850   6.556  -3.459
  151   HD13  LEU  17          3HD1      LEU  17   5.661   5.018  -3.736
  152   HD21  LEU  17          3HD2      LEU  17   1.971   5.261  -2.011
  153   HD22  LEU  17          1HD2      LEU  17   2.699   6.247  -3.277
  154   HD23  LEU  17          2HD2      LEU  17   2.975   6.645  -1.583
  155    H    HIS  18           H        HIS  18   5.134   3.382  -0.389
  156    HA   HIS  18           HA       HIS  18   7.634   4.731  -0.964
  157    HB2  HIS  18           2HB      HIS  18   7.690   5.368   1.330
  158    HB3  HIS  18           1HB      HIS  18   6.047   5.509   0.743
  159    HD1  HIS  18           1HD      HIS  18   8.104   3.723   3.244
  160    HD2  HIS  18           2HD      HIS  18   4.249   3.509   1.663
  161    HE1  HIS  18           1HE      HIS  18   6.734   2.351   4.886
  162    HE2  HIS  18           2HE      HIS  18   4.385   2.173   3.921
  163    H    LEU  19           H        LEU  19   6.662   1.825   0.684
  164    HA   LEU  19           HA       LEU  19   9.232   0.950   1.509
  165    HB2  LEU  19           2HB      LEU  19   6.853  -0.695   0.594
  166    HB3  LEU  19           1HB      LEU  19   8.261  -1.331   1.443
  167    HG   LEU  19           HG       LEU  19   6.549   0.886   2.555
  168   HD11  LEU  19          1HD1      LEU  19   6.399  -2.060   3.226
  169   HD12  LEU  19          2HD1      LEU  19   5.257  -1.240   2.162
  170   HD13  LEU  19          3HD1      LEU  19   5.375  -0.771   3.856
  171   HD21  LEU  19          3HD2      LEU  19   7.658   0.247   4.650
  172   HD22  LEU  19          1HD2      LEU  19   8.857   0.641   3.421
  173   HD23  LEU  19          2HD2      LEU  19   8.519  -1.044   3.810
  174    H    ALA  20           H        ALA  20   7.517   1.064  -1.451
  175    HA   ALA  20           HA       ALA  20   9.159  -0.736  -2.979
  176    HB1  ALA  20           1HB      ALA  20   7.317  -0.396  -4.260
  177    HB2  ALA  20           2HB      ALA  20   8.191   1.015  -4.847
  178    HB3  ALA  20           3HB      ALA  20   7.009   1.189  -3.559
  179    H    LEU  21           H        LEU  21   8.919   2.778  -2.962
  180    HA   LEU  21           HA       LEU  21  11.124   3.409  -4.499
  181    HB2  LEU  21           2HB      LEU  21   9.418   5.004  -3.429
  182    HB3  LEU  21           1HB      LEU  21  10.431   4.933  -1.987
  183    HG   LEU  21           HG       LEU  21  12.389   5.616  -3.417
  184   HD11  LEU  21          1HD1      LEU  21  11.765   5.049  -5.631
  185   HD12  LEU  21          2HD1      LEU  21  11.611   6.808  -5.600
  186   HD13  LEU  21          3HD1      LEU  21  10.170   5.794  -5.464
  187   HD21  LEU  21          3HD2      LEU  21  10.098   7.599  -3.551
  188   HD22  LEU  21          1HD2      LEU  21  11.814   7.956  -3.398
  189   HD23  LEU  21          2HD2      LEU  21  10.946   7.215  -2.051
  190    H    ALA  22           H        ALA  22  10.962   2.911  -1.030
  191    HA   ALA  22           HA       ALA  22  13.678   3.219  -0.431
  192    HB1  ALA  22           1HB      ALA  22  12.123   3.129   1.378
  193    HB2  ALA  22           2HB      ALA  22  13.156   1.710   1.543
  194    HB3  ALA  22           3HB      ALA  22  11.535   1.546   0.875
  195    H    LEU  23           H        LEU  23  11.887   0.498  -1.675
  196    HA   LEU  23           HA       LEU  23  13.804  -1.518  -1.340
  197    HB2  LEU  23           2HB      LEU  23  11.288  -1.429  -2.396
  198    HB3  LEU  23           1HB      LEU  23  12.262  -1.622  -3.849
  199    HG   LEU  23           HG       LEU  23  11.629  -3.819  -2.956
  200   HD11  LEU  23          1HD1      LEU  23  13.739  -4.814  -3.118
  201   HD12  LEU  23          2HD1      LEU  23  14.544  -3.493  -2.270
  202   HD13  LEU  23          3HD1      LEU  23  13.989  -3.271  -3.930
  203   HD21  LEU  23          3HD2      LEU  23  12.236  -2.546  -0.442
  204   HD22  LEU  23          1HD2      LEU  23  13.229  -3.993  -0.617
  205   HD23  LEU  23          2HD2      LEU  23  11.473  -4.108  -0.731
  206    H    LYS  24           H        LYS  24  13.234   0.710  -4.010
  207    HA   LYS  24           HA       LYS  24  15.696  -0.148  -5.323
  208    HB2  LYS  24           2HB      LYS  24  14.847   2.010  -6.778
  209    HB3  LYS  24           1HB      LYS  24  14.421   0.332  -7.114
  210    HG2  LYS  24           2HG      LYS  24  12.747   1.771  -5.101
  211    HG3  LYS  24           1HG      LYS  24  12.575   2.264  -6.782
  212    HD2  LYS  24           2HD      LYS  24  12.398  -0.289  -7.280
  213    HD3  LYS  24           1HD      LYS  24  12.051  -0.440  -5.557
  214    HE2  LYS  24           2HE      LYS  24   9.937   0.291  -5.856
  215    HE3  LYS  24           1HE      LYS  24  10.504   1.733  -6.692
  216    HZ1  LYS  24           3HZ      LYS  24   9.622  -0.827  -7.778
  217    HZ2  LYS  24           1HZ      LYS  24  10.885  -0.045  -8.594
  218    HZ3  LYS  24           2HZ      LYS  24   9.395   0.741  -8.381
  219    H    LYS  25           H        LYS  25  14.344   2.997  -4.419
  220    HA   LYS  25           HA       LYS  25  17.072   4.023  -4.041
  221    HB2  LYS  25           2HB      LYS  25  15.074   5.188  -5.395
  222    HB3  LYS  25           1HB      LYS  25  14.707   5.822  -3.789
  223    HG2  LYS  25           2HG      LYS  25  17.528   5.916  -4.847
  224    HG3  LYS  25           1HG      LYS  25  16.363   7.145  -5.323
  225    HD2  LYS  25           2HD      LYS  25  16.420   8.154  -3.293
  226    HD3  LYS  25           1HD      LYS  25  16.357   6.618  -2.432
  227    HE2  LYS  25           2HE      LYS  25  18.852   7.676  -3.797
  228    HE3  LYS  25           1HE      LYS  25  18.500   7.911  -2.084
  229    HZ1  LYS  25           3HZ      LYS  25  18.532   5.222  -3.317
  230    HZ2  LYS  25           1HZ      LYS  25  18.607   5.623  -1.666
  231    HZ3  LYS  25           2HZ      LYS  25  19.934   5.941  -2.690
  232    H    ALA  26           H        ALA  26  17.551   3.100  -2.045
  233    HA   ALA  26           HA       ALA  26  15.774   3.599   0.215
  234    HB1  ALA  26           1HB      ALA  26  18.507   2.363   0.409
  235    HB2  ALA  26           2HB      ALA  26  17.153   1.435  -0.228
  236    HB3  ALA  26           3HB      ALA  26  17.089   2.072   1.414
  Start of MODEL   11
    1    H1   LYS   1           1HT      LYS   1 -21.056   7.692  -6.552
    2    H2   LYS   1           2HT      LYS   1 -20.903   6.716  -7.932
    3    H3   LYS   1           3HT      LYS   1 -20.683   8.392  -8.049
    4    HA   LYS   1           HA       LYS   1 -18.829   6.349  -7.275
    5    HB2  LYS   1           2HB      LYS   1 -18.912   8.845  -8.745
    6    HB3  LYS   1           1HB      LYS   1 -17.598   8.893  -7.571
    7    HG2  LYS   1           2HG      LYS   1 -17.282   6.377  -8.556
    8    HG3  LYS   1           1HG      LYS   1 -17.932   7.189  -9.978
    9    HD2  LYS   1           2HD      LYS   1 -16.112   8.648 -10.145
   10    HD3  LYS   1           1HD      LYS   1 -15.732   8.527  -8.427
   11    HE2  LYS   1           2HE      LYS   1 -14.167   7.317 -10.111
   12    HE3  LYS   1           1HE      LYS   1 -14.684   6.434  -8.675
   13    HZ1  LYS   1           2HZ      LYS   1 -15.928   6.265 -11.370
   14    HZ2  LYS   1           3HZ      LYS   1 -16.450   5.422  -9.987
   15    HZ3  LYS   1           1HZ      LYS   1 -14.929   5.094 -10.656
   16    H    LYS   2           H        LYS   2 -16.850   7.769  -6.035
   17    HA   LYS   2           HA       LYS   2 -16.075   8.443  -3.994
   18    HB2  LYS   2           2HB      LYS   2 -18.338  10.083  -4.500
   19    HB3  LYS   2           1HB      LYS   2 -18.437   9.592  -2.808
   20    HG2  LYS   2           2HG      LYS   2 -15.708  10.321  -3.587
   21    HG3  LYS   2           1HG      LYS   2 -16.842  11.639  -3.844
   22    HD2  LYS   2           2HD      LYS   2 -16.160  11.946  -1.616
   23    HD3  LYS   2           1HD      LYS   2 -17.702  11.102  -1.452
   24    HE2  LYS   2           2HE      LYS   2 -15.826   9.044  -1.698
   25    HE3  LYS   2           1HE      LYS   2 -15.020  10.232  -0.676
   26    HZ1  LYS   2           3HZ      LYS   2 -16.222   9.382   0.968
   27    HZ2  LYS   2           1HZ      LYS   2 -17.244   8.529  -0.086
   28    HZ3  LYS   2           2HZ      LYS   2 -17.572  10.157   0.285
   29    H    ALA   3           H        ALA   3 -19.467   7.922  -3.081
   30    HA   ALA   3           HA       ALA   3 -20.393   6.548  -1.495
   31    HB1  ALA   3           1HB      ALA   3 -19.470   4.933  -3.360
   32    HB2  ALA   3           2HB      ALA   3 -20.050   4.282  -1.827
   33    HB3  ALA   3           3HB      ALA   3 -18.320   4.471  -2.104
   34    H    LEU   4           H        LEU   4 -19.307   4.622   0.198
   35    HA   LEU   4           HA       LEU   4 -17.498   6.285   1.839
   36    HB2  LEU   4           2HB      LEU   4 -18.340   4.631   3.694
   37    HB3  LEU   4           1HB      LEU   4 -19.350   5.983   3.195
   38    HG   LEU   4           HG       LEU   4 -20.563   3.771   3.390
   39   HD11  LEU   4          1HD1      LEU   4 -20.757   5.780   1.410
   40   HD12  LEU   4          2HD1      LEU   4 -22.023   4.691   1.969
   41   HD13  LEU   4          3HD1      LEU   4 -21.024   4.247   0.585
   42   HD21  LEU   4          3HD2      LEU   4 -19.183   3.042   0.804
   43   HD22  LEU   4          1HD2      LEU   4 -20.196   2.031   1.831
   44   HD23  LEU   4          2HD2      LEU   4 -18.581   2.492   2.370
   45    H    LEU   5           H        LEU   5 -17.328   3.827  -0.249
   46    HA   LEU   5           HA       LEU   5 -15.507   2.142   1.304
   47    HB2  LEU   5           2HB      LEU   5 -17.234   1.705  -0.933
   48    HB3  LEU   5           1HB      LEU   5 -15.583   1.393  -1.458
   49    HG   LEU   5           HG       LEU   5 -16.616  -0.654  -0.555
   50   HD11  LEU   5          1HD1      LEU   5 -14.154  -0.161  -0.228
   51   HD12  LEU   5          2HD1      LEU   5 -14.842  -1.277   0.949
   52   HD13  LEU   5          3HD1      LEU   5 -14.554   0.399   1.396
   53   HD21  LEU   5          3HD2      LEU   5 -16.749   0.802   2.103
   54   HD22  LEU   5          1HD2      LEU   5 -17.338  -0.818   1.735
   55   HD23  LEU   5          2HD2      LEU   5 -18.141   0.588   1.042
   56    H    ALA   6           H        ALA   6 -13.418   1.539   0.308
   57    HA   ALA   6           HA       ALA   6 -12.233   3.537  -1.470
   58    HB1  ALA   6           1HB      ALA   6 -11.958   4.105   1.102
   59    HB2  ALA   6           2HB      ALA   6 -10.612   4.307  -0.016
   60    HB3  ALA   6           3HB      ALA   6 -10.698   2.874   1.008
   61    H    LEU   7           H        LEU   7  -9.926   2.850  -2.030
   62    HA   LEU   7           HA       LEU   7 -10.007   0.059  -2.739
   63    HB2  LEU   7           2HB      LEU   7  -8.295   2.393  -3.390
   64    HB3  LEU   7           1HB      LEU   7  -7.522   0.814  -3.468
   65    HG   LEU   7           HG       LEU   7  -8.589   1.583  -5.630
   66   HD11  LEU   7          1HD1      LEU   7  -9.235  -0.590  -6.214
   67   HD12  LEU   7          2HD1      LEU   7  -9.949  -0.911  -4.635
   68   HD13  LEU   7          3HD1      LEU   7  -8.197  -0.864  -4.817
   69   HD21  LEU   7          3HD2      LEU   7 -10.666   2.363  -4.092
   70   HD22  LEU   7          1HD2      LEU   7 -11.242   0.763  -4.562
   71   HD23  LEU   7          2HD2      LEU   7 -10.844   1.957  -5.797
   72    H    ALA   8           H        ALA   8 -10.100  -0.636  -0.450
   73    HA   ALA   8           HA       ALA   8  -8.118  -0.375   1.456
   74    HB1  ALA   8           1HB      ALA   8  -9.562  -2.955   0.821
   75    HB2  ALA   8           2HB      ALA   8 -10.294  -1.611   1.697
   76    HB3  ALA   8           3HB      ALA   8  -8.906  -2.458   2.378
   77    H    LEU   9           H        LEU   9  -7.982  -1.928  -1.549
   78    HA   LEU   9           HA       LEU   9  -5.761  -3.674  -0.971
   79    HB2  LEU   9           2HB      LEU   9  -7.276  -2.817  -3.397
   80    HB3  LEU   9           1HB      LEU   9  -5.719  -3.621  -3.582
   81    HG   LEU   9           HG       LEU   9  -6.606  -5.449  -2.042
   82   HD11  LEU   9          1HD1      LEU   9  -9.279  -5.419  -2.362
   83   HD12  LEU   9          2HD1      LEU   9  -8.992  -3.679  -2.296
   84   HD13  LEU   9          3HD1      LEU   9  -8.488  -4.708  -0.957
   85   HD21  LEU   9          3HD2      LEU   9  -7.676  -6.603  -3.846
   86   HD22  LEU   9          1HD2      LEU   9  -6.497  -5.519  -4.589
   87   HD23  LEU   9          2HD2      LEU   9  -8.211  -5.095  -4.586
   88    H    HIS  10           H        HIS  10  -6.101  -0.979  -3.227
   89    HA   HIS  10           HA       HIS  10  -3.449  -0.491  -3.797
   90    HB2  HIS  10           2HB      HIS  10  -5.795   1.355  -3.521
   91    HB3  HIS  10           1HB      HIS  10  -4.191   2.011  -3.804
   92    HD1  HIS  10           1HD      HIS  10  -4.986   2.747  -6.234
   93    HD2  HIS  10           2HD      HIS  10  -4.960  -1.372  -5.563
   94    HE1  HIS  10           1HE      HIS  10  -5.134   1.647  -8.511
   95    HE2  HIS  10           2HE      HIS  10  -5.073  -0.862  -8.126
   96    H    HIS  11           H        HIS  11  -5.337   0.299  -1.051
   97    HA   HIS  11           HA       HIS  11  -3.937   2.055   0.464
   98    HB2  HIS  11           2HB      HIS  11  -5.689  -0.215   0.853
   99    HB3  HIS  11           1HB      HIS  11  -4.528  -0.078   2.181
  100    HD1  HIS  11           1HD      HIS  11  -4.905   1.785   3.864
  101    HD2  HIS  11           2HD      HIS  11  -7.329   2.186   0.489
  102    HE1  HIS  11           1HE      HIS  11  -6.544   3.650   4.373
  103    HE2  HIS  11           2HE      HIS  11  -8.009   3.929   2.314
  104    H    LEU  12           H        LEU  12  -3.298  -1.349  -0.048
  105    HA   LEU  12           HA       LEU  12  -0.897  -1.348   1.571
  106    HB2  LEU  12           2HB      LEU  12  -2.170  -3.383  -0.255
  107    HB3  LEU  12           1HB      LEU  12  -0.602  -3.653   0.505
  108    HG   LEU  12           HG       LEU  12  -1.869  -2.982   2.715
  109   HD11  LEU  12          1HD1      LEU  12  -4.080  -3.650   0.777
  110   HD12  LEU  12          2HD1      LEU  12  -3.969  -2.290   1.889
  111   HD13  LEU  12          3HD1      LEU  12  -4.273  -3.912   2.511
  112   HD21  LEU  12          3HD2      LEU  12  -1.952  -5.576   1.196
  113   HD22  LEU  12          1HD2      LEU  12  -2.767  -5.460   2.758
  114   HD23  LEU  12          2HD2      LEU  12  -1.031  -5.161   2.641
  115    H    ALA  13           H        ALA  13  -1.712  -1.518  -1.839
  116    HA   ALA  13           HA       ALA  13   0.831  -1.649  -2.968
  117    HB1  ALA  13           1HB      ALA  13  -1.328   0.130  -4.094
  118    HB2  ALA  13           2HB      ALA  13  -1.463  -1.624  -4.157
  119    HB3  ALA  13           3HB      ALA  13  -0.124  -0.812  -4.968
  120    H    HIS  14           H        HIS  14  -0.873   0.927  -1.437
  121    HA   HIS  14           HA       HIS  14   0.780   3.104  -2.219
  122    HB2  HIS  14           2HB      HIS  14  -1.099   3.969  -1.366
  123    HB3  HIS  14           1HB      HIS  14  -1.419   2.589  -0.350
  124    HD1  HIS  14           1HD      HIS  14   1.502   5.073  -0.255
  125    HD2  HIS  14           2HD      HIS  14  -1.578   3.625   2.168
  126    HE1  HIS  14           1HE      HIS  14   1.757   6.210   1.997
  127    HE2  HIS  14           2HE      HIS  14  -0.116   5.349   3.485
  128    H    LEU  15           H        LEU  15   0.575   1.234   0.768
  129    HA   LEU  15           HA       LEU  15   2.911   2.278   1.978
  130    HB2  LEU  15           2HB      LEU  15   1.379  -0.309   2.208
  131    HB3  LEU  15           1HB      LEU  15   2.917  -0.126   3.037
  132    HG   LEU  15           HG       LEU  15   1.874   0.917   4.711
  133   HD11  LEU  15          1HD1      LEU  15   0.632   3.105   4.250
  134   HD12  LEU  15          2HD1      LEU  15   1.059   2.861   2.561
  135   HD13  LEU  15          3HD1      LEU  15   2.325   3.054   3.769
  136   HD21  LEU  15          3HD2      LEU  15  -0.444   0.782   4.910
  137   HD22  LEU  15          1HD2      LEU  15  -0.124  -0.414   3.656
  138   HD23  LEU  15          2HD2      LEU  15  -0.708   1.191   3.218
  139    H    ALA  16           H        ALA  16   2.178  -0.156  -0.296
  140    HA   ALA  16           HA       ALA  16   4.783  -1.352  -0.423
  141    HB1  ALA  16           1HB      ALA  16   2.884  -1.377  -2.739
  142    HB2  ALA  16           2HB      ALA  16   2.457  -2.241  -1.262
  143    HB3  ALA  16           3HB      ALA  16   3.926  -2.666  -2.140
  144    H    LEU  17           H        LEU  17   3.257   1.374  -1.853
  145    HA   LEU  17           HA       LEU  17   4.947   1.748  -4.065
  146    HB2  LEU  17           2HB      LEU  17   3.535   3.439  -4.487
  147    HB3  LEU  17           1HB      LEU  17   2.694   2.987  -3.012
  148    HG   LEU  17           HG       LEU  17   4.290   4.513  -1.762
  149   HD11  LEU  17          1HD1      LEU  17   4.897   6.313  -3.853
  150   HD12  LEU  17          2HD1      LEU  17   5.404   4.727  -4.434
  151   HD13  LEU  17          3HD1      LEU  17   6.046   5.357  -2.916
  152   HD21  LEU  17          3HD2      LEU  17   2.019   5.203  -2.196
  153   HD22  LEU  17          1HD2      LEU  17   2.414   5.631  -3.857
  154   HD23  LEU  17          2HD2      LEU  17   3.076   6.579  -2.524
  155    H    HIS  18           H        HIS  18   5.077   3.190  -0.823
  156    HA   HIS  18           HA       HIS  18   7.603   4.453  -1.472
  157    HB2  HIS  18           2HB      HIS  18   7.644   5.236   0.772
  158    HB3  HIS  18           1HB      HIS  18   6.001   5.335   0.184
  159    HD1  HIS  18           1HD      HIS  18   8.058   3.743   2.801
  160    HD2  HIS  18           2HD      HIS  18   4.216   3.370   1.215
  161    HE1  HIS  18           1HE      HIS  18   6.730   2.361   4.469
  162    HE2  HIS  18           2HE      HIS  18   4.364   2.167   3.548
  163    H    LEU  19           H        LEU  19   6.512   1.607   0.179
  164    HA   LEU  19           HA       LEU  19   8.912   0.630   1.252
  165    HB2  LEU  19           2HB      LEU  19   6.385  -0.539   0.315
  166    HB3  LEU  19           1HB      LEU  19   7.760  -1.614   0.085
  167    HG   LEU  19           HG       LEU  19   6.813  -2.032   2.248
  168   HD11  LEU  19          1HD1      LEU  19   9.141  -0.378   3.075
  169   HD12  LEU  19          2HD1      LEU  19   9.436  -1.567   1.808
  170   HD13  LEU  19          3HD1      LEU  19   8.814  -2.085   3.374
  171   HD21  LEU  19          3HD2      LEU  19   5.638  -0.255   3.074
  172   HD22  LEU  19          1HD2      LEU  19   6.742   0.921   2.357
  173   HD23  LEU  19          2HD2      LEU  19   7.169   0.121   3.868
  174    H    ALA  20           H        ALA  20   7.668   0.914  -1.939
  175    HA   ALA  20           HA       ALA  20   9.591  -0.697  -3.322
  176    HB1  ALA  20           1HB      ALA  20   8.406  -0.131  -5.160
  177    HB2  ALA  20           2HB      ALA  20   8.586   1.593  -4.840
  178    HB3  ALA  20           3HB      ALA  20   7.298   0.680  -4.055
  179    H    LEU  21           H        LEU  21   9.245   2.789  -2.999
  180    HA   LEU  21           HA       LEU  21  11.663   3.591  -4.134
  181    HB2  LEU  21           2HB      LEU  21  10.234   4.837  -1.773
  182    HB3  LEU  21           1HB      LEU  21  11.448   5.633  -2.775
  183    HG   LEU  21           HG       LEU  21   8.826   4.516  -3.820
  184   HD11  LEU  21          1HD1      LEU  21   8.801   6.578  -2.210
  185   HD12  LEU  21          2HD1      LEU  21   7.906   6.668  -3.726
  186   HD13  LEU  21          3HD1      LEU  21   9.484   7.443  -3.585
  187   HD21  LEU  21          3HD2      LEU  21  11.106   6.076  -5.054
  188   HD22  LEU  21          1HD2      LEU  21   9.493   6.075  -5.767
  189   HD23  LEU  21          2HD2      LEU  21  10.386   4.565  -5.607
  190    H    ALA  22           H        ALA  22  10.881   2.860  -0.789
  191    HA   ALA  22           HA       ALA  22  13.363   3.247   0.394
  192    HB1  ALA  22           1HB      ALA  22  12.425   2.308   2.232
  193    HB2  ALA  22           2HB      ALA  22  11.940   0.857   1.359
  194    HB3  ALA  22           3HB      ALA  22  10.945   2.308   1.274
  195    H    LEU  23           H        LEU  23  12.176   0.627  -1.545
  196    HA   LEU  23           HA       LEU  23  14.409  -1.140  -1.073
  197    HB2  LEU  23           2HB      LEU  23  12.059  -1.848  -1.764
  198    HB3  LEU  23           1HB      LEU  23  12.437  -1.217  -3.361
  199    HG   LEU  23           HG       LEU  23  14.482  -2.717  -3.370
  200   HD11  LEU  23          1HD1      LEU  23  13.600  -4.732  -1.620
  201   HD12  LEU  23          2HD1      LEU  23  13.490  -3.239  -0.689
  202   HD13  LEU  23          3HD1      LEU  23  15.021  -3.716  -1.424
  203   HD21  LEU  23          3HD2      LEU  23  12.625  -3.416  -4.686
  204   HD22  LEU  23          1HD2      LEU  23  11.675  -3.835  -3.257
  205   HD23  LEU  23          2HD2      LEU  23  13.054  -4.826  -3.722
  206    H    LYS  24           H        LYS  24  13.266   0.937  -3.650
  207    HA   LYS  24           HA       LYS  24  15.261   0.530  -5.537
  208    HB2  LYS  24           2HB      LYS  24  13.201   1.839  -5.937
  209    HB3  LYS  24           1HB      LYS  24  13.857   3.141  -4.945
  210    HG2  LYS  24           2HG      LYS  24  15.661   2.171  -7.086
  211    HG3  LYS  24           1HG      LYS  24  14.194   2.967  -7.654
  212    HD2  LYS  24           2HD      LYS  24  14.784   5.007  -6.750
  213    HD3  LYS  24           1HD      LYS  24  15.693   4.282  -5.431
  214    HE2  LYS  24           2HE      LYS  24  17.002   5.487  -7.331
  215    HE3  LYS  24           1HE      LYS  24  17.592   3.928  -6.759
  216    HZ1  LYS  24           3HZ      LYS  24  15.647   3.917  -8.936
  217    HZ2  LYS  24           1HZ      LYS  24  16.965   2.889  -8.654
  218    HZ3  LYS  24           2HZ      LYS  24  17.217   4.435  -9.304
  219    H    LYS  25           H        LYS  25  15.194   2.914  -2.923
  220    HA   LYS  25           HA       LYS  25  18.109   3.281  -3.317
  221    HB2  LYS  25           2HB      LYS  25  17.844   5.550  -2.385
  222    HB3  LYS  25           1HB      LYS  25  16.866   5.338  -3.831
  223    HG2  LYS  25           2HG      LYS  25  14.949   5.700  -2.702
  224    HG3  LYS  25           1HG      LYS  25  15.392   4.565  -1.435
  225    HD2  LYS  25           2HD      LYS  25  16.500   7.387  -1.616
  226    HD3  LYS  25           1HD      LYS  25  15.099   6.955  -0.644
  227    HE2  LYS  25           2HE      LYS  25  17.921   5.897  -0.327
  228    HE3  LYS  25           1HE      LYS  25  17.053   6.947   0.785
  229    HZ1  LYS  25           3HZ      LYS  25  17.040   4.630   1.502
  230    HZ2  LYS  25           1HZ      LYS  25  16.250   4.183   0.065
  231    HZ3  LYS  25           2HZ      LYS  25  15.466   5.201   1.177
  232    H    ALA  26           H        ALA  26  19.432   3.003  -1.610
  233    HA   ALA  26           HA       ALA  26  18.432   1.668   0.714
  234    HB1  ALA  26           1HB      ALA  26  20.668   1.145  -0.117
  235    HB2  ALA  26           2HB      ALA  26  20.787   1.810   1.513
  236    HB3  ALA  26           3HB      ALA  26  21.173   2.816   0.117
  Start of MODEL   12
    1    H1   LYS   1           1HT      LYS   1 -17.250   2.966   1.109
    2    H2   LYS   1           2HT      LYS   1 -16.945   4.304   2.107
    3    H3   LYS   1           3HT      LYS   1 -16.570   4.367   0.454
    4    HA   LYS   1           HA       LYS   1 -19.336   3.805   1.186
    5    HB2  LYS   1           2HB      LYS   1 -18.103   5.943   2.411
    6    HB3  LYS   1           1HB      LYS   1 -18.712   6.678   0.929
    7    HG2  LYS   1           2HG      LYS   1 -20.921   5.356   1.539
    8    HG3  LYS   1           1HG      LYS   1 -20.245   5.389   3.169
    9    HD2  LYS   1           2HD      LYS   1 -19.870   7.944   2.666
   10    HD3  LYS   1           1HD      LYS   1 -21.106   7.690   1.432
   11    HE2  LYS   1           2HE      LYS   1 -21.360   7.222   4.415
   12    HE3  LYS   1           1HE      LYS   1 -22.249   8.384   3.431
   13    HZ1  LYS   1           2HZ      LYS   1 -23.395   6.642   2.332
   14    HZ2  LYS   1           3HZ      LYS   1 -23.471   6.292   3.996
   15    HZ3  LYS   1           1HZ      LYS   1 -22.386   5.452   3.003
   16    H    LYS   2           H        LYS   2 -17.532   6.356  -0.575
   17    HA   LYS   2           HA       LYS   2 -19.183   6.137  -2.885
   18    HB2  LYS   2           2HB      LYS   2 -17.523   7.623  -3.957
   19    HB3  LYS   2           1HB      LYS   2 -17.979   8.211  -2.360
   20    HG2  LYS   2           2HG      LYS   2 -15.728   8.343  -2.027
   21    HG3  LYS   2           1HG      LYS   2 -15.865   6.618  -1.712
   22    HD2  LYS   2           2HD      LYS   2 -14.076   6.926  -3.303
   23    HD3  LYS   2           1HD      LYS   2 -15.435   6.206  -4.159
   24    HE2  LYS   2           2HE      LYS   2 -14.242   8.192  -5.297
   25    HE3  LYS   2           1HE      LYS   2 -16.002   8.250  -5.222
   26    HZ1  LYS   2           3HZ      LYS   2 -15.869   9.679  -3.310
   27    HZ2  LYS   2           1HZ      LYS   2 -14.949  10.351  -4.561
   28    HZ3  LYS   2           2HZ      LYS   2 -14.179   9.564  -3.271
   29    H    ALA   3           H        ALA   3 -18.452   5.511  -5.042
   30    HA   ALA   3           HA       ALA   3 -17.084   2.952  -4.938
   31    HB1  ALA   3           1HB      ALA   3 -19.068   3.103  -6.301
   32    HB2  ALA   3           2HB      ALA   3 -17.682   2.858  -7.358
   33    HB3  ALA   3           3HB      ALA   3 -18.399   4.459  -7.203
   34    H    LEU   4           H        LEU   4 -15.194   2.432  -6.040
   35    HA   LEU   4           HA       LEU   4 -13.762   4.334  -7.628
   36    HB2  LEU   4           2HB      LEU   4 -13.396   4.502  -4.809
   37    HB3  LEU   4           1HB      LEU   4 -11.930   3.799  -5.490
   38    HG   LEU   4           HG       LEU   4 -13.256   6.338  -6.503
   39   HD11  LEU   4          1HD1      LEU   4 -10.595   6.203  -5.104
   40   HD12  LEU   4          2HD1      LEU   4 -12.081   6.304  -4.157
   41   HD13  LEU   4          3HD1      LEU   4 -11.675   7.581  -5.304
   42   HD21  LEU   4          3HD2      LEU   4 -11.262   6.597  -7.853
   43   HD22  LEU   4          1HD2      LEU   4 -11.921   4.994  -8.169
   44   HD23  LEU   4          2HD2      LEU   4 -10.520   5.180  -7.113
   45    H    LEU   5           H        LEU   5 -11.181   3.332  -7.272
   46    HA   LEU   5           HA       LEU   5 -11.433   0.784  -8.608
   47    HB2  LEU   5           2HB      LEU   5  -8.873   2.075  -7.656
   48    HB3  LEU   5           1HB      LEU   5  -9.086   0.930  -8.983
   49    HG   LEU   5           HG       LEU   5 -10.148   3.776  -8.888
   50   HD11  LEU   5          1HD1      LEU   5  -7.785   3.768  -9.364
   51   HD12  LEU   5          2HD1      LEU   5  -8.629   4.010 -10.892
   52   HD13  LEU   5          3HD1      LEU   5  -7.964   2.427 -10.496
   53   HD21  LEU   5          3HD2      LEU   5 -10.835   3.299 -11.253
   54   HD22  LEU   5          1HD2      LEU   5 -11.724   2.334 -10.071
   55   HD23  LEU   5          2HD2      LEU   5 -10.408   1.605 -10.995
   56    H    ALA   6           H        ALA   6  -8.914  -0.262  -7.497
   57    HA   ALA   6           HA       ALA   6  -9.999  -1.972  -5.521
   58    HB1  ALA   6           1HB      ALA   6  -7.041  -1.557  -5.785
   59    HB2  ALA   6           2HB      ALA   6  -7.936  -2.279  -7.121
   60    HB3  ALA   6           3HB      ALA   6  -7.940  -3.053  -5.536
   61    H    LEU   7           H        LEU   7 -10.799   0.128  -4.321
   62    HA   LEU   7           HA       LEU   7  -8.999   1.567  -2.684
   63    HB2  LEU   7           2HB      LEU   7 -11.830   1.414  -3.062
   64    HB3  LEU   7           1HB      LEU   7 -11.501   1.279  -1.336
   65    HG   LEU   7           HG       LEU   7 -11.775   3.651  -2.131
   66   HD11  LEU   7          1HD1      LEU   7 -10.085   4.486  -0.740
   67   HD12  LEU   7          2HD1      LEU   7  -8.924   3.261  -1.246
   68   HD13  LEU   7          3HD1      LEU   7 -10.254   2.824  -0.170
   69   HD21  LEU   7          3HD2      LEU   7 -10.442   4.574  -3.756
   70   HD22  LEU   7          1HD2      LEU   7 -10.357   2.902  -4.307
   71   HD23  LEU   7          2HD2      LEU   7  -9.053   3.578  -3.334
   72    H    ALA   8           H        ALA   8  -8.534   1.311  -0.457
   73    HA   ALA   8           HA       ALA   8  -8.064   0.188   1.490
   74    HB1  ALA   8           1HB      ALA   8  -9.800  -2.094   0.590
   75    HB2  ALA   8           2HB      ALA   8 -10.510  -0.600   1.207
   76    HB3  ALA   8           3HB      ALA   8  -9.443  -1.560   2.232
   77    H    LEU   9           H        LEU   9  -7.938  -1.316  -1.567
   78    HA   LEU   9           HA       LEU   9  -5.992  -3.332  -0.751
   79    HB2  LEU   9           2HB      LEU   9  -7.636  -2.736  -3.117
   80    HB3  LEU   9           1HB      LEU   9  -6.036  -3.389  -3.459
   81    HG   LEU   9           HG       LEU   9  -6.542  -5.239  -1.800
   82   HD11  LEU   9          1HD1      LEU   9  -8.354  -4.889  -0.481
   83   HD12  LEU   9          2HD1      LEU   9  -9.337  -5.260  -1.897
   84   HD13  LEU   9          3HD1      LEU   9  -8.935  -3.586  -1.518
   85   HD21  LEU   9          3HD2      LEU   9  -6.727  -5.647  -4.191
   86   HD22  LEU   9          1HD2      LEU   9  -8.314  -4.881  -4.232
   87   HD23  LEU   9          2HD2      LEU   9  -8.097  -6.412  -3.389
   88    H    HIS  10           H        HIS  10  -6.191  -0.813  -3.214
   89    HA   HIS  10           HA       HIS  10  -3.518  -0.549  -3.916
   90    HB2  HIS  10           2HB      HIS  10  -5.762   1.428  -3.670
   91    HB3  HIS  10           1HB      HIS  10  -4.131   2.023  -3.971
   92    HD1  HIS  10           1HD      HIS  10  -5.011   2.754  -6.400
   93    HD2  HIS  10           2HD      HIS  10  -4.972  -1.358  -5.677
   94    HE1  HIS  10           1HE      HIS  10  -5.279   1.623  -8.656
   95    HE2  HIS  10           2HE      HIS  10  -5.188  -0.884  -8.240
   96    H    HIS  11           H        HIS  11  -5.284   0.545  -1.195
   97    HA   HIS  11           HA       HIS  11  -3.738   2.262   0.205
   98    HB2  HIS  11           2HB      HIS  11  -5.607   0.075   0.784
   99    HB3  HIS  11           1HB      HIS  11  -4.521   0.469   2.124
  100    HD1  HIS  11           1HD      HIS  11  -5.957   1.922   3.635
  101    HD2  HIS  11           2HD      HIS  11  -6.236   3.048  -0.375
  102    HE1  HIS  11           1HE      HIS  11  -7.368   4.036   3.574
  103    HE2  HIS  11           2HE      HIS  11  -7.559   4.728   1.128
  104    H    LEU  12           H        LEU  12  -3.353  -1.203  -0.083
  105    HA   LEU  12           HA       LEU  12  -1.027  -1.300   1.641
  106    HB2  LEU  12           2HB      LEU  12  -2.129  -3.371  -0.284
  107    HB3  LEU  12           1HB      LEU  12  -0.937  -3.666   0.981
  108    HG   LEU  12           HG       LEU  12  -3.731  -2.613   1.505
  109   HD11  LEU  12          1HD1      LEU  12  -3.500  -5.011   0.545
  110   HD12  LEU  12          2HD1      LEU  12  -4.421  -4.803   2.039
  111   HD13  LEU  12          3HD1      LEU  12  -2.759  -5.404   2.096
  112   HD21  LEU  12          3HD2      LEU  12  -2.876  -3.743   3.818
  113   HD22  LEU  12          1HD2      LEU  12  -2.593  -2.041   3.429
  114   HD23  LEU  12          2HD2      LEU  12  -1.325  -3.235   3.153
  115    H    ALA  13           H        ALA  13  -1.756  -1.590  -1.756
  116    HA   ALA  13           HA       ALA  13   0.829  -1.969  -2.777
  117    HB1  ALA  13           1HB      ALA  13  -0.010  -1.052  -4.882
  118    HB2  ALA  13           2HB      ALA  13  -1.393  -0.345  -4.049
  119    HB3  ALA  13           3HB      ALA  13  -1.232  -2.098  -4.164
  120    H    HIS  14           H        HIS  14  -0.812   0.781  -1.554
  121    HA   HIS  14           HA       HIS  14   0.958   2.811  -2.450
  122    HB2  HIS  14           2HB      HIS  14  -1.031   3.664  -1.777
  123    HB3  HIS  14           1HB      HIS  14  -1.224   2.534  -0.459
  124    HD1  HIS  14           1HD      HIS  14   1.224   5.360  -1.308
  125    HD2  HIS  14           2HD      HIS  14  -0.830   3.771   1.964
  126    HE1  HIS  14           1HE      HIS  14   1.826   6.802   0.694
  127    HE2  HIS  14           2HE      HIS  14   0.616   5.822   2.703
  128    H    LEU  15           H        LEU  15   0.614   1.058   0.596
  129    HA   LEU  15           HA       LEU  15   2.858   2.159   1.910
  130    HB2  LEU  15           2HB      LEU  15   1.419  -0.486   2.075
  131    HB3  LEU  15           1HB      LEU  15   2.908  -0.245   2.974
  132    HG   LEU  15           HG       LEU  15   1.905   1.127   4.500
  133   HD11  LEU  15          1HD1      LEU  15  -0.027   2.642   3.902
  134   HD12  LEU  15          2HD1      LEU  15   0.178   2.118   2.232
  135   HD13  LEU  15          3HD1      LEU  15   1.475   2.994   3.046
  136   HD21  LEU  15          3HD2      LEU  15  -0.724   0.168   3.401
  137   HD22  LEU  15          1HD2      LEU  15  -0.202   0.277   5.081
  138   HD23  LEU  15          2HD2      LEU  15   0.434  -0.997   4.042
  139    H    ALA  16           H        ALA  16   2.273  -0.318  -0.357
  140    HA   ALA  16           HA       ALA  16   4.899  -1.450  -0.405
  141    HB1  ALA  16           1HB      ALA  16   4.096  -2.838  -2.041
  142    HB2  ALA  16           2HB      ALA  16   3.243  -1.537  -2.873
  143    HB3  ALA  16           3HB      ALA  16   2.548  -2.263  -1.421
  144    H    LEU  17           H        LEU  17   3.374   1.250  -1.928
  145    HA   LEU  17           HA       LEU  17   5.177   1.695  -4.026
  146    HB2  LEU  17           2HB      LEU  17   3.727   3.335  -4.489
  147    HB3  LEU  17           1HB      LEU  17   2.892   2.965  -2.990
  148    HG   LEU  17           HG       LEU  17   4.596   4.507  -1.833
  149   HD11  LEU  17          1HD1      LEU  17   4.935   5.848  -4.476
  150   HD12  LEU  17          2HD1      LEU  17   5.948   4.442  -4.160
  151   HD13  LEU  17          3HD1      LEU  17   6.008   5.829  -3.079
  152   HD21  LEU  17          3HD2      LEU  17   3.057   6.158  -3.768
  153   HD22  LEU  17          1HD2      LEU  17   3.082   6.212  -2.004
  154   HD23  LEU  17          2HD2      LEU  17   2.131   4.982  -2.835
  155    H    HIS  18           H        HIS  18   5.141   3.076  -0.748
  156    HA   HIS  18           HA       HIS  18   7.670   4.374  -1.248
  157    HB2  HIS  18           2HB      HIS  18   7.663   5.008   1.070
  158    HB3  HIS  18           1HB      HIS  18   6.089   5.257   0.355
  159    HD1  HIS  18           1HD      HIS  18   7.816   3.337   3.007
  160    HD2  HIS  18           2HD      HIS  18   4.044   3.502   1.230
  161    HE1  HIS  18           1HE      HIS  18   6.234   2.105   4.565
  162    HE2  HIS  18           2HE      HIS  18   3.922   2.226   3.518
  163    H    LEU  19           H        LEU  19   6.581   1.500   0.356
  164    HA   LEU  19           HA       LEU  19   9.009   0.532   1.390
  165    HB2  LEU  19           2HB      LEU  19   6.480  -0.645   0.447
  166    HB3  LEU  19           1HB      LEU  19   7.867  -1.714   0.261
  167    HG   LEU  19           HG       LEU  19   8.339  -1.695   2.570
  168   HD11  LEU  19          1HD1      LEU  19   8.325   0.440   3.391
  169   HD12  LEU  19          2HD1      LEU  19   6.725  -0.035   3.965
  170   HD13  LEU  19          3HD1      LEU  19   6.889   0.885   2.469
  171   HD21  LEU  19          3HD2      LEU  19   5.320  -1.523   2.327
  172   HD22  LEU  19          1HD2      LEU  19   6.202  -2.287   3.646
  173   HD23  LEU  19          2HD2      LEU  19   6.286  -2.966   2.024
  174    H    ALA  20           H        ALA  20   7.708   0.813  -1.782
  175    HA   ALA  20           HA       ALA  20   9.678  -0.734  -3.181
  176    HB1  ALA  20           1HB      ALA  20   8.442   1.553  -4.600
  177    HB2  ALA  20           2HB      ALA  20   7.318   0.365  -3.948
  178    HB3  ALA  20           3HB      ALA  20   8.568  -0.137  -5.080
  179    H    LEU  21           H        LEU  21   9.140   2.734  -2.970
  180    HA   LEU  21           HA       LEU  21  11.503   3.657  -4.074
  181    HB2  LEU  21           2HB      LEU  21  10.016   4.814  -1.702
  182    HB3  LEU  21           1HB      LEU  21  11.196   5.677  -2.690
  183    HG   LEU  21           HG       LEU  21   8.612   4.471  -3.722
  184   HD11  LEU  21          1HD1      LEU  21   9.385   7.376  -3.324
  185   HD12  LEU  21          2HD1      LEU  21   8.341   6.466  -2.229
  186   HD13  LEU  21          3HD1      LEU  21   7.830   6.761  -3.891
  187   HD21  LEU  21          3HD2      LEU  21   9.310   6.046  -5.692
  188   HD22  LEU  21          1HD2      LEU  21  10.100   4.477  -5.545
  189   HD23  LEU  21          2HD2      LEU  21  10.923   5.936  -4.990
  190    H    ALA  22           H        ALA  22  10.789   2.838  -0.740
  191    HA   ALA  22           HA       ALA  22  13.238   3.376   0.457
  192    HB1  ALA  22           1HB      ALA  22  11.198   1.225   1.026
  193    HB2  ALA  22           2HB      ALA  22  11.415   2.760   1.868
  194    HB3  ALA  22           3HB      ALA  22  12.616   1.477   2.043
  195    H    LEU  23           H        LEU  23  12.240   0.675  -1.506
  196    HA   LEU  23           HA       LEU  23  14.720  -0.783  -1.100
  197    HB2  LEU  23           2HB      LEU  23  12.116  -1.459  -1.981
  198    HB3  LEU  23           1HB      LEU  23  13.197  -1.737  -3.346
  199    HG   LEU  23           HG       LEU  23  13.936  -2.714  -0.585
  200   HD11  LEU  23          1HD1      LEU  23  11.744  -3.682  -0.990
  201   HD12  LEU  23          2HD1      LEU  23  12.960  -4.925  -1.276
  202   HD13  LEU  23          3HD1      LEU  23  12.196  -4.112  -2.639
  203   HD21  LEU  23          3HD2      LEU  23  15.752  -2.875  -2.088
  204   HD22  LEU  23          1HD2      LEU  23  14.714  -3.336  -3.436
  205   HD23  LEU  23          2HD2      LEU  23  15.035  -4.483  -2.139
  206    H    LYS  24           H        LYS  24  13.022   0.777  -3.774
  207    HA   LYS  24           HA       LYS  24  14.940   0.598  -5.767
  208    HB2  LYS  24           2HB      LYS  24  12.510   1.751  -5.609
  209    HB3  LYS  24           1HB      LYS  24  13.508   3.196  -5.494
  210    HG2  LYS  24           2HG      LYS  24  14.192   1.208  -7.622
  211    HG3  LYS  24           1HG      LYS  24  12.756   2.204  -7.861
  212    HD2  LYS  24           2HD      LYS  24  14.265   3.692  -8.726
  213    HD3  LYS  24           1HD      LYS  24  14.504   4.108  -7.031
  214    HE2  LYS  24           2HE      LYS  24  16.182   1.940  -7.340
  215    HE3  LYS  24           1HE      LYS  24  16.324   2.746  -8.898
  216    HZ1  LYS  24           3HZ      LYS  24  17.220   3.607  -6.287
  217    HZ2  LYS  24           1HZ      LYS  24  16.436   4.822  -7.186
  218    HZ3  LYS  24           2HZ      LYS  24  17.798   4.021  -7.830
  219    H    LYS  25           H        LYS  25  14.475   3.136  -3.400
  220    HA   LYS  25           HA       LYS  25  15.817   4.735  -2.497
  221    HB2  LYS  25           2HB      LYS  25  17.329   2.299  -2.542
  222    HB3  LYS  25           1HB      LYS  25  18.418   3.663  -2.795
  223    HG2  LYS  25           2HG      LYS  25  16.386   3.422  -0.554
  224    HG3  LYS  25           1HG      LYS  25  18.125   3.203  -0.384
  225    HD2  LYS  25           2HD      LYS  25  17.592   5.714  -1.714
  226    HD3  LYS  25           1HD      LYS  25  16.673   5.631  -0.212
  227    HE2  LYS  25           2HE      LYS  25  19.055   6.566  -0.056
  228    HE3  LYS  25           1HE      LYS  25  18.627   5.299   1.093
  229    HZ1  LYS  25           3HZ      LYS  25  20.163   3.963   0.239
  230    HZ2  LYS  25           1HZ      LYS  25  20.735   5.281  -0.659
  231    HZ3  LYS  25           2HZ      LYS  25  19.613   4.214  -1.349
  232    H    ALA  26           H        ALA  26  15.957   6.556  -3.566
  233    HA   ALA  26           HA       ALA  26  16.629   8.179  -5.034
  234    HB1  ALA  26           1HB      ALA  26  19.129   6.505  -5.303
  235    HB2  ALA  26           2HB      ALA  26  18.822   7.613  -3.970
  236    HB3  ALA  26           3HB      ALA  26  18.970   8.230  -5.614
  Start of MODEL   13
    1    H1   LYS   1           1HT      LYS   1 -12.417   6.991  12.533
    2    H2   LYS   1           2HT      LYS   1 -12.448   6.558  14.172
    3    H3   LYS   1           3HT      LYS   1 -13.480   7.778  13.600
    4    HA   LYS   1           HA       LYS   1 -14.521   5.536  14.007
    5    HB2  LYS   1           2HB      LYS   1 -15.088   7.541  12.225
    6    HB3  LYS   1           1HB      LYS   1 -14.966   6.157  11.144
    7    HG2  LYS   1           2HG      LYS   1 -16.548   5.862  13.674
    8    HG3  LYS   1           1HG      LYS   1 -17.262   6.741  12.323
    9    HD2  LYS   1           2HD      LYS   1 -17.060   4.834  10.864
   10    HD3  LYS   1           1HD      LYS   1 -16.058   3.974  12.033
   11    HE2  LYS   1           2HE      LYS   1 -18.680   3.493  11.806
   12    HE3  LYS   1           1HE      LYS   1 -17.855   3.413  13.363
   13    HZ1  LYS   1           2HZ      LYS   1 -18.560   5.624  13.865
   14    HZ2  LYS   1           3HZ      LYS   1 -19.920   4.734  13.380
   15    HZ3  LYS   1           1HZ      LYS   1 -19.206   5.837  12.309
   16    H    LYS   2           H        LYS   2 -13.153   5.708  10.722
   17    HA   LYS   2           HA       LYS   2 -11.554   3.365  10.954
   18    HB2  LYS   2           2HB      LYS   2 -14.375   2.971  10.340
   19    HB3  LYS   2           1HB      LYS   2 -13.348   2.410   9.024
   20    HG2  LYS   2           2HG      LYS   2 -12.006   1.098  10.681
   21    HG3  LYS   2           1HG      LYS   2 -13.133   1.595  11.942
   22    HD2  LYS   2           2HD      LYS   2 -14.076  -0.436  11.334
   23    HD3  LYS   2           1HD      LYS   2 -14.942   0.649  10.250
   24    HE2  LYS   2           2HE      LYS   2 -14.172  -1.182   8.894
   25    HE3  LYS   2           1HE      LYS   2 -13.117   0.183   8.521
   26    HZ1  LYS   2           3HZ      LYS   2 -12.481  -1.916  10.521
   27    HZ2  LYS   2           1HZ      LYS   2 -11.452  -0.681   9.978
   28    HZ3  LYS   2           2HZ      LYS   2 -11.921  -1.927   8.921
   29    H    ALA   3           H        ALA   3 -10.309   3.058   9.092
   30    HA   ALA   3           HA       ALA   3 -10.258   5.329   7.283
   31    HB1  ALA   3           1HB      ALA   3  -8.148   4.591   6.635
   32    HB2  ALA   3           2HB      ALA   3  -8.528   2.897   6.942
   33    HB3  ALA   3           3HB      ALA   3  -8.234   3.996   8.291
   34    H    LEU   4           H        LEU   4 -12.640   4.155   6.885
   35    HA   LEU   4           HA       LEU   4 -12.610   2.118   4.875
   36    HB2  LEU   4           2HB      LEU   4 -15.036   3.432   4.559
   37    HB3  LEU   4           1HB      LEU   4 -14.740   2.032   5.583
   38    HG   LEU   4           HG       LEU   4 -14.133   3.610   7.451
   39   HD11  LEU   4          1HD1      LEU   4 -13.560   5.543   5.983
   40   HD12  LEU   4          2HD1      LEU   4 -14.756   5.973   7.203
   41   HD13  LEU   4          3HD1      LEU   4 -15.255   5.685   5.538
   42   HD21  LEU   4          3HD2      LEU   4 -16.605   4.522   7.598
   43   HD22  LEU   4          1HD2      LEU   4 -16.312   2.783   7.655
   44   HD23  LEU   4          2HD2      LEU   4 -16.846   3.539   6.155
   45    H    LEU   5           H        LEU   5 -14.260   2.968   2.874
   46    HA   LEU   5           HA       LEU   5 -14.273   4.046   0.843
   47    HB2  LEU   5           2HB      LEU   5 -12.675   6.237   2.189
   48    HB3  LEU   5           1HB      LEU   5 -13.613   6.367   0.705
   49    HG   LEU   5           HG       LEU   5 -14.648   5.983   3.523
   50   HD11  LEU   5          1HD1      LEU   5 -16.045   7.995   2.695
   51   HD12  LEU   5          2HD1      LEU   5 -14.880   8.091   1.378
   52   HD13  LEU   5          3HD1      LEU   5 -14.341   8.285   3.046
   53   HD21  LEU   5          3HD2      LEU   5 -15.969   5.496   0.857
   54   HD22  LEU   5          1HD2      LEU   5 -16.922   6.068   2.227
   55   HD23  LEU   5          2HD2      LEU   5 -16.062   4.532   2.334
   56    H    ALA   6           H        ALA   6 -12.602   5.174  -0.747
   57    HA   ALA   6           HA       ALA   6 -10.732   4.881  -2.036
   58    HB1  ALA   6           1HB      ALA   6  -8.696   5.121  -0.992
   59    HB2  ALA   6           2HB      ALA   6  -9.128   4.054   0.344
   60    HB3  ALA   6           3HB      ALA   6  -9.769   5.699   0.283
   61    H    LEU   7           H        LEU   7  -8.604   3.113  -1.871
   62    HA   LEU   7           HA       LEU   7 -10.004   0.527  -2.151
   63    HB2  LEU   7           2HB      LEU   7  -7.944   1.913  -3.701
   64    HB3  LEU   7           1HB      LEU   7  -7.520   0.244  -3.334
   65    HG   LEU   7           HG       LEU   7  -8.863   0.686  -5.495
   66   HD11  LEU   7          1HD1      LEU   7  -9.526  -1.349  -3.385
   67   HD12  LEU   7          2HD1      LEU   7  -8.648  -1.564  -4.898
   68   HD13  LEU   7          3HD1      LEU   7 -10.400  -1.351  -4.916
   69   HD21  LEU   7          3HD2      LEU   7 -11.125   1.194  -5.375
   70   HD22  LEU   7          1HD2      LEU   7 -10.526   2.142  -4.015
   71   HD23  LEU   7          2HD2      LEU   7 -11.288   0.577  -3.733
   72    H    ALA   8           H        ALA   8  -9.859  -0.347  -0.120
   73    HA   ALA   8           HA       ALA   8  -7.825  -0.185   1.742
   74    HB1  ALA   8           1HB      ALA   8 -10.109  -1.427   1.842
   75    HB2  ALA   8           2HB      ALA   8  -8.753  -2.076   2.763
   76    HB3  ALA   8           3HB      ALA   8  -9.200  -2.803   1.219
   77    H    LEU   9           H        LEU   9  -7.876  -1.715  -1.256
   78    HA   LEU   9           HA       LEU   9  -5.681  -3.548  -0.842
   79    HB2  LEU   9           2HB      LEU   9  -7.527  -2.782  -2.983
   80    HB3  LEU   9           1HB      LEU   9  -5.898  -3.149  -3.536
   81    HG   LEU   9           HG       LEU   9  -6.023  -5.297  -2.206
   82   HD11  LEU   9          1HD1      LEU   9  -8.462  -6.018  -1.793
   83   HD12  LEU   9          2HD1      LEU   9  -8.846  -4.296  -1.873
   84   HD13  LEU   9          3HD1      LEU   9  -7.737  -4.896  -0.642
   85   HD21  LEU   9          3HD2      LEU   9  -7.960  -4.780  -4.475
   86   HD22  LEU   9          1HD2      LEU   9  -7.596  -6.395  -3.863
   87   HD23  LEU   9          2HD2      LEU   9  -6.320  -5.416  -4.578
   88    H    HIS  10           H        HIS  10  -6.141  -0.805  -3.002
   89    HA   HIS  10           HA       HIS  10  -3.530  -0.306  -3.754
   90    HB2  HIS  10           2HB      HIS  10  -5.853   1.540  -3.257
   91    HB3  HIS  10           1HB      HIS  10  -4.269   2.195  -3.662
   92    HD1  HIS  10           1HD      HIS  10  -5.238   3.010  -5.970
   93    HD2  HIS  10           2HD      HIS  10  -5.234  -1.135  -5.465
   94    HE1  HIS  10           1HE      HIS  10  -5.655   2.003  -8.260
   95    HE2  HIS  10           2HE      HIS  10  -5.627  -0.525  -7.976
   96    H    HIS  11           H        HIS  11  -5.273   0.482  -0.895
   97    HA   HIS  11           HA       HIS  11  -3.733   2.172   0.569
   98    HB2  HIS  11           2HB      HIS  11  -5.586  -0.007   1.041
   99    HB3  HIS  11           1HB      HIS  11  -4.363   0.082   2.318
  100    HD1  HIS  11           1HD      HIS  11  -4.550   1.989   3.987
  101    HD2  HIS  11           2HD      HIS  11  -7.089   2.469   0.707
  102    HE1  HIS  11           1HE      HIS  11  -6.040   3.974   4.515
  103    HE2  HIS  11           2HE      HIS  11  -7.578   4.300   2.511
  104    H    LEU  12           H        LEU  12  -3.224  -1.235  -0.044
  105    HA   LEU  12           HA       LEU  12  -0.768  -1.334   1.512
  106    HB2  LEU  12           2HB      LEU  12  -2.409  -3.304  -0.037
  107    HB3  LEU  12           1HB      LEU  12  -0.710  -3.666   0.238
  108    HG   LEU  12           HG       LEU  12  -2.352  -4.530   2.000
  109   HD11  LEU  12          1HD1      LEU  12   0.202  -3.124   2.331
  110   HD12  LEU  12          2HD1      LEU  12  -0.319  -4.684   2.964
  111   HD13  LEU  12          3HD1      LEU  12  -0.746  -3.204   3.817
  112   HD21  LEU  12          3HD2      LEU  12  -3.619  -2.287   1.996
  113   HD22  LEU  12          1HD2      LEU  12  -2.284  -1.664   2.972
  114   HD23  LEU  12          2HD2      LEU  12  -3.270  -2.996   3.570
  115    H    ALA  13           H        ALA  13  -1.782  -1.458  -1.838
  116    HA   ALA  13           HA       ALA  13   0.704  -1.779  -3.086
  117    HB1  ALA  13           1HB      ALA  13  -1.684  -1.630  -4.140
  118    HB2  ALA  13           2HB      ALA  13  -0.309  -1.031  -5.067
  119    HB3  ALA  13           3HB      ALA  13  -1.361   0.101  -4.211
  120    H    HIS  14           H        HIS  14  -0.819   0.890  -1.559
  121    HA   HIS  14           HA       HIS  14   0.972   2.944  -2.434
  122    HB2  HIS  14           2HB      HIS  14  -0.919   3.929  -1.716
  123    HB3  HIS  14           1HB      HIS  14  -1.302   2.656  -0.579
  124    HD1  HIS  14           1HD      HIS  14   1.577   5.177  -0.799
  125    HD2  HIS  14           2HD      HIS  14  -1.218   3.719   1.933
  126    HE1  HIS  14           1HE      HIS  14   2.025   6.377   1.391
  127    HE2  HIS  14           2HE      HIS  14   0.312   5.510   3.068
  128    H    LEU  15           H        LEU  15   0.571   1.080   0.536
  129    HA   LEU  15           HA       LEU  15   2.814   2.112   1.909
  130    HB2  LEU  15           2HB      LEU  15   1.352  -0.529   1.953
  131    HB3  LEU  15           1HB      LEU  15   2.846  -0.337   2.862
  132    HG   LEU  15           HG       LEU  15   1.851   0.935   4.455
  133   HD11  LEU  15          1HD1      LEU  15   1.542   2.939   3.162
  134   HD12  LEU  15          2HD1      LEU  15  -0.016   2.585   3.900
  135   HD13  LEU  15          3HD1      LEU  15   0.264   2.187   2.211
  136   HD21  LEU  15          3HD2      LEU  15   0.343  -0.949   4.349
  137   HD22  LEU  15          1HD2      LEU  15  -0.555  -0.204   3.028
  138   HD23  LEU  15          2HD2      LEU  15  -0.617   0.502   4.637
  139    H    ALA  16           H        ALA  16   2.225  -0.239  -0.481
  140    HA   ALA  16           HA       ALA  16   4.852  -1.370  -0.597
  141    HB1  ALA  16           1HB      ALA  16   2.395  -1.931  -1.795
  142    HB2  ALA  16           2HB      ALA  16   3.915  -2.776  -2.087
  143    HB3  ALA  16           3HB      ALA  16   3.431  -1.442  -3.134
  144    H    LEU  17           H        LEU  17   3.287   1.362  -2.074
  145    HA   LEU  17           HA       LEU  17   5.110   1.902  -4.116
  146    HB2  LEU  17           2HB      LEU  17   3.410   3.347  -4.449
  147    HB3  LEU  17           1HB      LEU  17   2.961   3.341  -2.755
  148    HG   LEU  17           HG       LEU  17   5.477   4.782  -3.321
  149   HD11  LEU  17          1HD1      LEU  17   4.370   6.739  -4.306
  150   HD12  LEU  17          2HD1      LEU  17   2.838   5.872  -4.342
  151   HD13  LEU  17          3HD1      LEU  17   4.176   5.337  -5.361
  152   HD21  LEU  17          3HD2      LEU  17   2.967   5.802  -1.977
  153   HD22  LEU  17          1HD2      LEU  17   4.637   6.290  -1.694
  154   HD23  LEU  17          2HD2      LEU  17   4.078   4.710  -1.152
  155    H    HIS  18           H        HIS  18   5.099   3.084  -0.759
  156    HA   HIS  18           HA       HIS  18   7.655   4.370  -1.205
  157    HB2  HIS  18           2HB      HIS  18   7.652   4.911   1.132
  158    HB3  HIS  18           1HB      HIS  18   6.070   5.207   0.451
  159    HD1  HIS  18           1HD      HIS  18   7.859   2.973   2.849
  160    HD2  HIS  18           2HD      HIS  18   4.004   3.564   1.372
  161    HE1  HIS  18           1HE      HIS  18   6.312   1.671   4.369
  162    HE2  HIS  18           2HE      HIS  18   3.946   2.049   3.519
  163    H    LEU  19           H        LEU  19   6.493   1.494   0.377
  164    HA   LEU  19           HA       LEU  19   8.887   0.419   1.333
  165    HB2  LEU  19           2HB      LEU  19   6.285  -0.619   0.617
  166    HB3  LEU  19           1HB      LEU  19   7.535  -1.718   0.052
  167    HG   LEU  19           HG       LEU  19   6.969  -2.367   2.274
  168   HD11  LEU  19          1HD1      LEU  19   9.522  -1.739   1.520
  169   HD12  LEU  19          2HD1      LEU  19   9.112  -2.576   3.015
  170   HD13  LEU  19          3HD1      LEU  19   9.376  -0.831   3.022
  171   HD21  LEU  19          3HD2      LEU  19   5.926  -0.179   2.912
  172   HD22  LEU  19          1HD2      LEU  19   7.550   0.485   3.118
  173   HD23  LEU  19          2HD2      LEU  19   6.988  -0.817   4.162
  174    H    ALA  20           H        ALA  20   7.570   0.749  -1.821
  175    HA   ALA  20           HA       ALA  20   9.520  -0.868  -3.195
  176    HB1  ALA  20           1HB      ALA  20   7.601  -0.641  -4.480
  177    HB2  ALA  20           2HB      ALA  20   8.635   0.595  -5.198
  178    HB3  ALA  20           3HB      ALA  20   7.387   1.047  -4.039
  179    H    LEU  21           H        LEU  21   8.921   2.606  -3.175
  180    HA   LEU  21           HA       LEU  21  11.252   3.449  -4.412
  181    HB2  LEU  21           2HB      LEU  21   9.286   4.632  -2.578
  182    HB3  LEU  21           1HB      LEU  21  10.875   5.385  -2.503
  183    HG   LEU  21           HG       LEU  21   9.277   6.386  -4.206
  184   HD11  LEU  21          1HD1      LEU  21  11.321   7.112  -4.837
  185   HD12  LEU  21          2HD1      LEU  21  11.228   5.878  -6.092
  186   HD13  LEU  21          3HD1      LEU  21  12.064   5.535  -4.578
  187   HD21  LEU  21          3HD2      LEU  21   8.543   5.187  -6.037
  188   HD22  LEU  21          1HD2      LEU  21   8.653   3.861  -4.882
  189   HD23  LEU  21          2HD2      LEU  21   9.952   4.127  -6.045
  190    H    ALA  22           H        ALA  22  10.632   2.703  -1.057
  191    HA   ALA  22           HA       ALA  22  13.095   3.365   0.074
  192    HB1  ALA  22           1HB      ALA  22  12.487   1.976   1.912
  193    HB2  ALA  22           2HB      ALA  22  11.421   0.998   0.900
  194    HB3  ALA  22           3HB      ALA  22  10.984   2.661   1.291
  195    H    LEU  23           H        LEU  23  12.016   0.439  -1.522
  196    HA   LEU  23           HA       LEU  23  14.227  -1.214  -1.042
  197    HB2  LEU  23           2HB      LEU  23  11.879  -1.392  -2.498
  198    HB3  LEU  23           1HB      LEU  23  13.127  -1.460  -3.743
  199    HG   LEU  23           HG       LEU  23  13.129  -3.190  -1.249
  200   HD11  LEU  23          1HD1      LEU  23  11.515  -3.394  -3.606
  201   HD12  LEU  23          2HD1      LEU  23  11.646  -4.543  -2.275
  202   HD13  LEU  23          3HD1      LEU  23  12.723  -4.679  -3.664
  203   HD21  LEU  23          3HD2      LEU  23  14.714  -3.313  -3.838
  204   HD22  LEU  23          1HD2      LEU  23  14.837  -4.462  -2.511
  205   HD23  LEU  23          2HD2      LEU  23  15.343  -2.791  -2.276
  206    H    LYS  24           H        LYS  24  13.615   1.168  -3.512
  207    HA   LYS  24           HA       LYS  24  16.176   0.751  -4.806
  208    HB2  LYS  24           2HB      LYS  24  14.417   3.093  -5.408
  209    HB3  LYS  24           1HB      LYS  24  15.413   2.134  -6.503
  210    HG2  LYS  24           2HG      LYS  24  13.773   0.181  -5.841
  211    HG3  LYS  24           1HG      LYS  24  12.697   1.496  -5.368
  212    HD2  LYS  24           2HD      LYS  24  13.894   0.992  -8.108
  213    HD3  LYS  24           1HD      LYS  24  12.186   0.958  -7.657
  214    HE2  LYS  24           2HE      LYS  24  12.520   3.428  -6.946
  215    HE3  LYS  24           1HE      LYS  24  14.018   3.350  -7.868
  216    HZ1  LYS  24           3HZ      LYS  24  12.087   4.164  -9.154
  217    HZ2  LYS  24           1HZ      LYS  24  11.356   2.647  -8.979
  218    HZ3  LYS  24           2HZ      LYS  24  12.819   2.790  -9.831
  219    H    LYS  25           H        LYS  25  14.639   3.253  -2.839
  220    HA   LYS  25           HA       LYS  25  17.330   4.389  -2.363
  221    HB2  LYS  25           2HB      LYS  25  14.782   5.796  -3.094
  222    HB3  LYS  25           1HB      LYS  25  16.020   6.622  -2.153
  223    HG2  LYS  25           2HG      LYS  25  16.903   5.142  -4.597
  224    HG3  LYS  25           1HG      LYS  25  16.039   6.659  -4.831
  225    HD2  LYS  25           2HD      LYS  25  18.435   6.376  -2.986
  226    HD3  LYS  25           1HD      LYS  25  18.563   6.895  -4.666
  227    HE2  LYS  25           2HE      LYS  25  17.211   8.304  -2.369
  228    HE3  LYS  25           1HE      LYS  25  18.428   8.933  -3.475
  229    HZ1  LYS  25           3HZ      LYS  25  16.605   9.839  -4.427
  230    HZ2  LYS  25           1HZ      LYS  25  15.546   8.658  -3.832
  231    HZ3  LYS  25           2HZ      LYS  25  16.504   8.332  -5.197
  232    H    ALA  26           H        ALA  26  17.867   4.313  -0.292
  233    HA   ALA  26           HA       ALA  26  15.852   4.881   1.759
  234    HB1  ALA  26           1HB      ALA  26  17.672   2.492   2.036
  235    HB2  ALA  26           2HB      ALA  26  16.042   2.354   1.379
  236    HB3  ALA  26           3HB      ALA  26  16.279   2.926   3.030
  Start of MODEL   14
    1    H1   LYS   1           1HT      LYS   1 -15.595   6.085  -1.162
    2    H2   LYS   1           2HT      LYS   1 -17.248   6.465  -1.124
    3    H3   LYS   1           3HT      LYS   1 -16.250   6.896   0.174
    4    HA   LYS   1           HA       LYS   1 -16.932   8.664  -1.569
    5    HB2  LYS   1           2HB      LYS   1 -14.117   8.229  -0.520
    6    HB3  LYS   1           1HB      LYS   1 -14.637   9.717  -1.310
    7    HG2  LYS   1           2HG      LYS   1 -16.188   8.610   1.028
    8    HG3  LYS   1           1HG      LYS   1 -14.752   9.592   1.293
    9    HD2  LYS   1           2HD      LYS   1 -16.348  10.905  -0.686
   10    HD3  LYS   1           1HD      LYS   1 -17.401  10.467   0.656
   11    HE2  LYS   1           2HE      LYS   1 -16.381  12.694   0.997
   12    HE3  LYS   1           1HE      LYS   1 -15.872  11.548   2.238
   13    HZ1  LYS   1           2HZ      LYS   1 -13.786  11.285   1.227
   14    HZ2  LYS   1           3HZ      LYS   1 -14.083  12.955   1.198
   15    HZ3  LYS   1           1HZ      LYS   1 -14.282  12.041  -0.215
   16    H    LYS   2           H        LYS   2 -16.654   9.281  -3.662
   17    HA   LYS   2           HA       LYS   2 -16.117   9.133  -5.884
   18    HB2  LYS   2           2HB      LYS   2 -13.703   9.166  -4.485
   19    HB3  LYS   2           1HB      LYS   2 -13.527   7.841  -5.635
   20    HG2  LYS   2           2HG      LYS   2 -12.807   9.800  -6.802
   21    HG3  LYS   2           1HG      LYS   2 -14.427   9.461  -7.410
   22    HD2  LYS   2           2HD      LYS   2 -15.257  11.045  -5.542
   23    HD3  LYS   2           1HD      LYS   2 -13.577  11.569  -5.428
   24    HE2  LYS   2           2HE      LYS   2 -15.548  11.968  -7.646
   25    HE3  LYS   2           1HE      LYS   2 -14.348  13.084  -6.998
   26    HZ1  LYS   2           3HZ      LYS   2 -12.639  11.535  -7.987
   27    HZ2  LYS   2           1HZ      LYS   2 -13.555  12.432  -9.094
   28    HZ3  LYS   2           2HZ      LYS   2 -13.913  10.793  -8.828
   29    H    ALA   3           H        ALA   3 -15.145   7.514  -7.592
   30    HA   ALA   3           HA       ALA   3 -16.756   5.160  -7.458
   31    HB1  ALA   3           1HB      ALA   3 -15.547   4.603  -9.621
   32    HB2  ALA   3           2HB      ALA   3 -14.667   6.114  -9.414
   33    HB3  ALA   3           3HB      ALA   3 -16.419   6.136  -9.603
   34    H    LEU   4           H        LEU   4 -15.049   5.093  -5.259
   35    HA   LEU   4           HA       LEU   4 -13.590   2.616  -5.836
   36    HB2  LEU   4           2HB      LEU   4 -11.674   3.394  -4.421
   37    HB3  LEU   4           1HB      LEU   4 -11.836   4.278  -5.935
   38    HG   LEU   4           HG       LEU   4 -13.323   5.896  -4.461
   39   HD11  LEU   4          1HD1      LEU   4 -12.016   6.005  -2.173
   40   HD12  LEU   4          2HD1      LEU   4 -11.735   4.292  -2.477
   41   HD13  LEU   4          3HD1      LEU   4 -13.386   4.905  -2.349
   42   HD21  LEU   4          3HD2      LEU   4 -10.305   5.878  -4.182
   43   HD22  LEU   4          1HD2      LEU   4 -11.363   7.280  -4.088
   44   HD23  LEU   4          2HD2      LEU   4 -11.160   6.432  -5.623
   45    H    LEU   5           H        LEU   5 -12.552   2.137  -3.357
   46    HA   LEU   5           HA       LEU   5 -14.668   2.497  -1.374
   47    HB2  LEU   5           2HB      LEU   5 -15.141   0.399  -2.797
   48    HB3  LEU   5           1HB      LEU   5 -13.716  -0.292  -2.023
   49    HG   LEU   5           HG       LEU   5 -15.527   0.978  -0.099
   50   HD11  LEU   5          1HD1      LEU   5 -16.995  -1.282  -0.404
   51   HD12  LEU   5          2HD1      LEU   5 -16.621  -0.934  -2.091
   52   HD13  LEU   5          3HD1      LEU   5 -17.453   0.267  -1.106
   53   HD21  LEU   5          3HD2      LEU   5 -13.559  -0.654   0.258
   54   HD22  LEU   5          1HD2      LEU   5 -14.673  -1.915  -0.258
   55   HD23  LEU   5          2HD2      LEU   5 -15.033  -0.956   1.178
   56    H    ALA   6           H        ALA   6 -13.950   2.063   0.769
   57    HA   ALA   6           HA       ALA   6 -11.176   2.571   1.190
   58    HB1  ALA   6           1HB      ALA   6 -12.747   3.413   2.805
   59    HB2  ALA   6           2HB      ALA   6 -11.764   2.192   3.611
   60    HB3  ALA   6           3HB      ALA   6 -13.399   1.800   3.088
   61    H    LEU   7           H        LEU   7 -10.728   0.577  -0.267
   62    HA   LEU   7           HA       LEU   7 -10.880  -1.983   1.072
   63    HB2  LEU   7           2HB      LEU   7 -10.000  -2.920  -0.891
   64    HB3  LEU   7           1HB      LEU   7 -10.967  -1.568  -1.465
   65    HG   LEU   7           HG       LEU   7  -7.959  -1.483  -1.026
   66   HD11  LEU   7          1HD1      LEU   7  -8.944  -2.888  -2.980
   67   HD12  LEU   7          2HD1      LEU   7  -7.717  -1.683  -3.368
   68   HD13  LEU   7          3HD1      LEU   7  -9.420  -1.335  -3.658
   69   HD21  LEU   7          3HD2      LEU   7  -8.896   0.721  -0.735
   70   HD22  LEU   7          1HD2      LEU   7  -9.969   0.504  -2.114
   71   HD23  LEU   7          2HD2      LEU   7  -8.236   0.660  -2.364
   72    H    ALA   8           H        ALA   8  -8.651  -3.284   0.836
   73    HA   ALA   8           HA       ALA   8  -6.687  -1.804   2.481
   74    HB1  ALA   8           1HB      ALA   8  -7.828  -3.819   3.457
   75    HB2  ALA   8           2HB      ALA   8  -6.070  -3.933   3.397
   76    HB3  ALA   8           3HB      ALA   8  -7.051  -4.785   2.206
   77    H    LEU   9           H        LEU   9  -7.208  -3.131  -0.520
   78    HA   LEU   9           HA       LEU   9  -4.676  -4.197  -1.186
   79    HB2  LEU   9           2HB      LEU   9  -7.160  -3.886  -2.403
   80    HB3  LEU   9           1HB      LEU   9  -6.037  -2.984  -3.415
   81    HG   LEU   9           HG       LEU   9  -5.675  -5.869  -2.539
   82   HD11  LEU   9          1HD1      LEU   9  -6.131  -6.421  -4.867
   83   HD12  LEU   9          2HD1      LEU   9  -6.303  -4.713  -5.271
   84   HD13  LEU   9          3HD1      LEU   9  -7.484  -5.497  -4.218
   85   HD21  LEU   9          3HD2      LEU   9  -4.035  -3.988  -4.256
   86   HD22  LEU   9          1HD2      LEU   9  -3.850  -5.741  -4.328
   87   HD23  LEU   9          2HD2      LEU   9  -3.509  -4.879  -2.826
   88    H    HIS  10           H        HIS  10  -6.125  -1.256  -2.482
   89    HA   HIS  10           HA       HIS  10  -3.871  -0.040  -3.517
   90    HB2  HIS  10           2HB      HIS  10  -6.352   1.081  -2.241
   91    HB3  HIS  10           1HB      HIS  10  -5.037   2.156  -2.704
   92    HD1  HIS  10           1HD      HIS  10  -4.410   2.237  -5.276
   93    HD2  HIS  10           2HD      HIS  10  -7.857   0.064  -4.379
   94    HE1  HIS  10           1HE      HIS  10  -5.639   1.901  -7.463
   95    HE2  HIS  10           2HE      HIS  10  -7.740   0.570  -6.938
   96    H    HIS  11           H        HIS  11  -5.175  -0.024  -0.321
   97    HA   HIS  11           HA       HIS  11  -3.638   1.637   1.165
   98    HB2  HIS  11           2HB      HIS  11  -5.098  -0.853   1.533
   99    HB3  HIS  11           1HB      HIS  11  -3.733  -0.715   2.655
  100    HD1  HIS  11           1HD      HIS  11  -4.024   0.862   4.619
  101    HD2  HIS  11           2HD      HIS  11  -6.898   1.445   1.658
  102    HE1  HIS  11           1HE      HIS  11  -5.699   2.513   5.564
  103    HE2  HIS  11           2HE      HIS  11  -7.478   2.871   3.776
  104    H    LEU  12           H        LEU  12  -2.882  -1.609   0.118
  105    HA   LEU  12           HA       LEU  12  -0.213  -1.555   1.230
  106    HB2  LEU  12           2HB      LEU  12  -1.974  -3.580   0.505
  107    HB3  LEU  12           1HB      LEU  12  -0.731  -3.646  -0.742
  108    HG   LEU  12           HG       LEU  12  -0.220  -3.669   2.252
  109   HD11  LEU  12          1HD1      LEU  12  -0.282  -5.832   0.149
  110   HD12  LEU  12          2HD1      LEU  12  -1.089  -5.801   1.717
  111   HD13  LEU  12          3HD1      LEU  12   0.660  -6.015   1.628
  112   HD21  LEU  12          3HD2      LEU  12   1.681  -2.659   1.228
  113   HD22  LEU  12          1HD2      LEU  12   1.604  -3.741  -0.167
  114   HD23  LEU  12          2HD2      LEU  12   2.120  -4.358   1.401
  115    H    ALA  13           H        ALA  13  -1.694  -1.517  -1.949
  116    HA   ALA  13           HA       ALA  13   0.583  -1.465  -3.545
  117    HB1  ALA  13           1HB      ALA  13  -1.880   0.205  -4.079
  118    HB2  ALA  13           2HB      ALA  13  -1.823  -1.537  -4.355
  119    HB3  ALA  13           3HB      ALA  13  -0.762  -0.463  -5.266
  120    H    HIS  14           H        HIS  14  -0.992   1.162  -1.826
  121    HA   HIS  14           HA       HIS  14   0.827   3.128  -2.873
  122    HB2  HIS  14           2HB      HIS  14  -0.627   4.564  -2.081
  123    HB3  HIS  14           1HB      HIS  14  -1.644   3.217  -1.637
  124    HD1  HIS  14           1HD      HIS  14   1.163   5.339  -0.139
  125    HD2  HIS  14           2HD      HIS  14  -2.159   3.114   1.065
  126    HE1  HIS  14           1HE      HIS  14   0.882   5.742   2.348
  127    HE2  HIS  14           2HE      HIS  14  -1.128   4.380   3.101
  128    H    LEU  15           H        LEU  15   0.499   1.300   0.100
  129    HA   LEU  15           HA       LEU  15   2.650   2.449   1.529
  130    HB2  LEU  15           2HB      LEU  15   1.261  -0.201   1.515
  131    HB3  LEU  15           1HB      LEU  15   2.853  -0.137   2.254
  132    HG   LEU  15           HG       LEU  15   2.136   1.114   4.021
  133   HD11  LEU  15          1HD1      LEU  15   0.237   2.359   2.051
  134   HD12  LEU  15          2HD1      LEU  15   1.481   3.140   3.023
  135   HD13  LEU  15          3HD1      LEU  15  -0.006   2.578   3.779
  136   HD21  LEU  15          3HD2      LEU  15  -0.221  -0.377   2.919
  137   HD22  LEU  15          1HD2      LEU  15  -0.387   0.555   4.404
  138   HD23  LEU  15          2HD2      LEU  15   0.782  -0.761   4.316
  139    H    ALA  16           H        ALA  16   2.213   0.091  -0.907
  140    HA   ALA  16           HA       ALA  16   4.869  -0.912  -1.073
  141    HB1  ALA  16           1HB      ALA  16   3.134  -0.754  -3.510
  142    HB2  ALA  16           2HB      ALA  16   2.634  -1.786  -2.168
  143    HB3  ALA  16           3HB      ALA  16   4.179  -2.064  -2.966
  144    H    LEU  17           H        LEU  17   3.301   1.899  -2.316
  145    HA   LEU  17           HA       LEU  17   5.144   2.578  -4.317
  146    HB2  LEU  17           2HB      LEU  17   3.656   4.237  -4.635
  147    HB3  LEU  17           1HB      LEU  17   2.809   3.700  -3.195
  148    HG   LEU  17           HG       LEU  17   4.534   5.141  -1.895
  149   HD11  LEU  17          1HD1      LEU  17   4.684   6.760  -4.405
  150   HD12  LEU  17          2HD1      LEU  17   5.797   5.399  -4.237
  151   HD13  LEU  17          3HD1      LEU  17   5.803   6.701  -3.044
  152   HD21  LEU  17          3HD2      LEU  17   2.513   6.491  -3.699
  153   HD22  LEU  17          1HD2      LEU  17   3.151   7.129  -2.187
  154   HD23  LEU  17          2HD2      LEU  17   2.137   5.687  -2.174
  155    H    HIS  18           H        HIS  18   5.015   3.468  -0.910
  156    HA   HIS  18           HA       HIS  18   7.579   4.826  -1.182
  157    HB2  HIS  18           2HB      HIS  18   7.443   5.274   1.169
  158    HB3  HIS  18           1HB      HIS  18   5.915   5.623   0.395
  159    HD1  HIS  18           1HD      HIS  18   7.513   3.256   2.818
  160    HD2  HIS  18           2HD      HIS  18   3.758   4.030   1.165
  161    HE1  HIS  18           1HE      HIS  18   5.838   1.974   4.215
  162    HE2  HIS  18           2HE      HIS  18   3.534   2.484   3.273
  163    H    LEU  19           H        LEU  19   6.329   1.936   0.302
  164    HA   LEU  19           HA       LEU  19   8.667   0.850   1.377
  165    HB2  LEU  19           2HB      LEU  19   6.399  -0.506  -0.089
  166    HB3  LEU  19           1HB      LEU  19   7.679  -1.388   0.737
  167    HG   LEU  19           HG       LEU  19   6.013   0.704   2.128
  168   HD11  LEU  19          1HD1      LEU  19   4.653  -1.161   3.000
  169   HD12  LEU  19          2HD1      LEU  19   5.556  -2.291   1.994
  170   HD13  LEU  19          3HD1      LEU  19   4.532  -1.071   1.243
  171   HD21  LEU  19          3HD2      LEU  19   6.792  -0.745   4.092
  172   HD22  LEU  19          1HD2      LEU  19   8.032   0.214   3.288
  173   HD23  LEU  19          2HD2      LEU  19   7.894  -1.510   2.952
  174    H    ALA  20           H        ALA  20   7.482   1.185  -1.852
  175    HA   ALA  20           HA       ALA  20   9.338  -0.500  -3.194
  176    HB1  ALA  20           1HB      ALA  20   8.894   1.422  -5.048
  177    HB2  ALA  20           2HB      ALA  20   7.512   1.686  -3.992
  178    HB3  ALA  20           3HB      ALA  20   7.770   0.108  -4.727
  179    H    LEU  21           H        LEU  21   9.333   3.015  -2.897
  180    HA   LEU  21           HA       LEU  21  11.851   3.577  -3.877
  181    HB2  LEU  21           2HB      LEU  21  10.531   4.901  -1.496
  182    HB3  LEU  21           1HB      LEU  21  11.841   5.580  -2.455
  183    HG   LEU  21           HG       LEU  21   9.262   4.731  -3.769
  184   HD11  LEU  21          1HD1      LEU  21   9.771   7.556  -2.862
  185   HD12  LEU  21          2HD1      LEU  21   8.989   6.405  -1.783
  186   HD13  LEU  21          3HD1      LEU  21   8.246   6.800  -3.332
  187   HD21  LEU  21          3HD2      LEU  21  11.079   5.207  -5.285
  188   HD22  LEU  21          1HD2      LEU  21  11.500   6.672  -4.400
  189   HD23  LEU  21          2HD2      LEU  21  10.002   6.602  -5.324
  190    H    ALA  22           H        ALA  22  10.937   2.814  -0.574
  191    HA   ALA  22           HA       ALA  22  13.419   2.892   0.664
  192    HB1  ALA  22           1HB      ALA  22  12.383   0.947   2.091
  193    HB2  ALA  22           2HB      ALA  22  10.932   1.296   1.151
  194    HB3  ALA  22           3HB      ALA  22  11.662   2.555   2.144
  195    H    LEU  23           H        LEU  23  11.917   0.254  -1.127
  196    HA   LEU  23           HA       LEU  23  14.150  -1.538  -0.767
  197    HB2  LEU  23           2HB      LEU  23  11.786  -1.612  -2.657
  198    HB3  LEU  23           1HB      LEU  23  12.985  -2.900  -2.515
  199    HG   LEU  23           HG       LEU  23  11.601  -1.902  -0.039
  200   HD11  LEU  23          1HD1      LEU  23   9.748  -2.351  -1.561
  201   HD12  LEU  23          2HD1      LEU  23   9.871  -3.683  -0.411
  202   HD13  LEU  23          3HD1      LEU  23  10.480  -3.874  -2.055
  203   HD21  LEU  23          3HD2      LEU  23  13.020  -4.383  -0.985
  204   HD22  LEU  23          1HD2      LEU  23  11.848  -4.506   0.327
  205   HD23  LEU  23          2HD2      LEU  23  13.260  -3.466   0.502
  206    H    LYS  24           H        LYS  24  12.818   0.326  -3.426
  207    HA   LYS  24           HA       LYS  24  14.600  -0.212  -5.444
  208    HB2  LYS  24           2HB      LYS  24  12.513   1.374  -5.352
  209    HB3  LYS  24           1HB      LYS  24  13.706   2.617  -4.981
  210    HG2  LYS  24           2HG      LYS  24  14.412   0.850  -7.253
  211    HG3  LYS  24           1HG      LYS  24  13.010   1.880  -7.519
  212    HD2  LYS  24           2HD      LYS  24  15.416   3.148  -6.280
  213    HD3  LYS  24           1HD      LYS  24  15.508   2.744  -7.994
  214    HE2  LYS  24           2HE      LYS  24  13.503   4.554  -6.623
  215    HE3  LYS  24           1HE      LYS  24  14.662   4.980  -7.878
  216    HZ1  LYS  24           3HZ      LYS  24  13.315   3.050  -9.098
  217    HZ2  LYS  24           1HZ      LYS  24  12.893   4.688  -9.200
  218    HZ3  LYS  24           2HZ      LYS  24  12.086   3.675  -8.106
  219    H    LYS  25           H        LYS  25  14.854   2.315  -2.999
  220    HA   LYS  25           HA       LYS  25  17.788   2.253  -3.317
  221    HB2  LYS  25           2HB      LYS  25  16.761   4.212  -4.532
  222    HB3  LYS  25           1HB      LYS  25  16.190   4.797  -2.970
  223    HG2  LYS  25           2HG      LYS  25  18.969   4.095  -2.747
  224    HG3  LYS  25           1HG      LYS  25  18.762   5.165  -4.130
  225    HD2  LYS  25           2HD      LYS  25  18.724   6.880  -2.662
  226    HD3  LYS  25           1HD      LYS  25  17.145   6.294  -2.145
  227    HE2  LYS  25           2HE      LYS  25  18.884   6.600  -0.295
  228    HE3  LYS  25           1HE      LYS  25  18.093   5.027  -0.355
  229    HZ1  LYS  25           3HZ      LYS  25  20.339   4.961  -2.034
  230    HZ2  LYS  25           1HZ      LYS  25  20.057   4.072  -0.607
  231    HZ3  LYS  25           2HZ      LYS  25  20.819   5.596  -0.533
  232    H    ALA  26           H        ALA  26  18.206   1.209  -1.425
  233    HA   ALA  26           HA       ALA  26  16.970   2.117   1.061
  234    HB1  ALA  26           1HB      ALA  26  17.781   0.170   2.036
  235    HB2  ALA  26           2HB      ALA  26  19.161   0.071   0.944
  236    HB3  ALA  26           3HB      ALA  26  17.547  -0.355   0.370
  Start of MODEL   15
    1    H1   LYS   1           1HT      LYS   1 -21.825  -1.543  -7.191
    2    H2   LYS   1           2HT      LYS   1 -20.183  -1.361  -7.567
    3    H3   LYS   1           3HT      LYS   1 -21.232  -0.033  -7.665
    4    HA   LYS   1           HA       LYS   1 -19.659  -0.590  -5.560
    5    HB2  LYS   1           2HB      LYS   1 -22.347   0.828  -5.515
    6    HB3  LYS   1           1HB      LYS   1 -21.027   1.071  -4.371
    7    HG2  LYS   1           2HG      LYS   1 -19.668   1.539  -6.645
    8    HG3  LYS   1           1HG      LYS   1 -21.277   1.994  -7.206
    9    HD2  LYS   1           2HD      LYS   1 -21.375   3.355  -4.952
   10    HD3  LYS   1           1HD      LYS   1 -19.617   3.226  -5.015
   11    HE2  LYS   1           2HE      LYS   1 -20.320   5.300  -6.109
   12    HE3  LYS   1           1HE      LYS   1 -19.658   4.196  -7.313
   13    HZ1  LYS   1           2HZ      LYS   1 -22.535   4.089  -6.775
   14    HZ2  LYS   1           3HZ      LYS   1 -21.694   3.809  -8.217
   15    HZ3  LYS   1           1HZ      LYS   1 -21.942   5.398  -7.683
   16    H    LYS   2           H        LYS   2 -20.665  -0.726  -3.209
   17    HA   LYS   2           HA       LYS   2 -22.849  -2.460  -2.745
   18    HB2  LYS   2           2HB      LYS   2 -20.475  -3.787  -3.575
   19    HB3  LYS   2           1HB      LYS   2 -20.647  -4.079  -1.847
   20    HG2  LYS   2           2HG      LYS   2 -23.010  -4.403  -3.700
   21    HG3  LYS   2           1HG      LYS   2 -21.837  -5.703  -3.503
   22    HD2  LYS   2           2HD      LYS   2 -22.197  -5.522  -1.000
   23    HD3  LYS   2           1HD      LYS   2 -23.541  -4.432  -1.343
   24    HE2  LYS   2           2HE      LYS   2 -23.265  -7.330  -2.182
   25    HE3  LYS   2           1HE      LYS   2 -24.473  -6.634  -1.102
   26    HZ1  LYS   2           3HZ      LYS   2 -24.223  -6.316  -4.021
   27    HZ2  LYS   2           1HZ      LYS   2 -25.074  -5.188  -3.087
   28    HZ3  LYS   2           2HZ      LYS   2 -25.569  -6.808  -3.109
   29    H    ALA   3           H        ALA   3 -22.150  -3.627  -0.395
   30    HA   ALA   3           HA       ALA   3 -22.103  -1.438   1.409
   31    HB1  ALA   3           1HB      ALA   3 -22.592  -2.986   3.009
   32    HB2  ALA   3           2HB      ALA   3 -21.339  -4.101   2.464
   33    HB3  ALA   3           3HB      ALA   3 -22.889  -4.035   1.623
   34    H    LEU   4           H        LEU   4 -20.441  -0.520   2.545
   35    HA   LEU   4           HA       LEU   4 -18.286   0.013   3.158
   36    HB2  LEU   4           2HB      LEU   4 -18.524  -2.685   3.631
   37    HB3  LEU   4           1HB      LEU   4 -17.126  -2.630   2.564
   38    HG   LEU   4           HG       LEU   4 -16.170  -0.810   4.062
   39   HD11  LEU   4          1HD1      LEU   4 -17.393   0.019   5.765
   40   HD12  LEU   4          2HD1      LEU   4 -17.706  -1.599   6.395
   41   HD13  LEU   4          3HD1      LEU   4 -18.767  -0.911   5.165
   42   HD21  LEU   4          3HD2      LEU   4 -16.756  -3.504   5.337
   43   HD22  LEU   4          1HD2      LEU   4 -15.478  -2.395   5.831
   44   HD23  LEU   4          2HD2      LEU   4 -15.421  -3.150   4.237
   45    H    LEU   5           H        LEU   5 -15.915  -1.373   2.008
   46    HA   LEU   5           HA       LEU   5 -15.943  -1.130  -0.822
   47    HB2  LEU   5           2HB      LEU   5 -16.139   1.307  -0.057
   48    HB3  LEU   5           1HB      LEU   5 -14.505   1.127   0.581
   49    HG   LEU   5           HG       LEU   5 -13.891   0.260  -1.780
   50   HD11  LEU   5          1HD1      LEU   5 -16.491   0.196  -2.275
   51   HD12  LEU   5          2HD1      LEU   5 -15.351   0.635  -3.550
   52   HD13  LEU   5          3HD1      LEU   5 -16.240   1.890  -2.684
   53   HD21  LEU   5          3HD2      LEU   5 -14.194   2.946  -0.720
   54   HD22  LEU   5          1HD2      LEU   5 -14.391   2.942  -2.476
   55   HD23  LEU   5          2HD2      LEU   5 -12.922   2.299  -1.753
   56    H    ALA   6           H        ALA   6 -14.191  -2.145  -1.630
   57    HA   ALA   6           HA       ALA   6 -12.471  -3.600   0.042
   58    HB1  ALA   6           1HB      ALA   6 -13.022  -4.080  -2.402
   59    HB2  ALA   6           2HB      ALA   6 -11.335  -4.291  -1.936
   60    HB3  ALA   6           3HB      ALA   6 -11.831  -2.846  -2.816
   61    H    LEU   7           H        LEU   7 -11.408  -2.313   1.535
   62    HA   LEU   7           HA       LEU   7  -9.548  -0.289   0.453
   63    HB2  LEU   7           2HB      LEU   7 -11.204  -0.434   2.859
   64    HB3  LEU   7           1HB      LEU   7  -9.526  -0.035   3.213
   65    HG   LEU   7           HG       LEU   7  -9.735   1.669   1.259
   66   HD11  LEU   7          1HD1      LEU   7 -12.657   1.168   1.926
   67   HD12  LEU   7          2HD1      LEU   7 -11.876   0.841   0.378
   68   HD13  LEU   7          3HD1      LEU   7 -12.055   2.501   0.940
   69   HD21  LEU   7          3HD2      LEU   7 -10.985   1.886   3.989
   70   HD22  LEU   7          1HD2      LEU   7 -11.038   3.257   2.885
   71   HD23  LEU   7          2HD2      LEU   7  -9.486   2.601   3.401
   72    H    ALA   8           H        ALA   8  -7.539  -0.097   1.940
   73    HA   ALA   8           HA       ALA   8  -5.650  -1.007   2.892
   74    HB1  ALA   8           1HB      ALA   8  -6.862  -3.744   2.946
   75    HB2  ALA   8           2HB      ALA   8  -7.421  -2.528   4.096
   76    HB3  ALA   8           3HB      ALA   8  -5.724  -3.010   4.075
   77    H    LEU   9           H        LEU   9  -7.310  -2.501   0.306
   78    HA   LEU   9           HA       LEU   9  -5.260  -4.151  -0.710
   79    HB2  LEU   9           2HB      LEU   9  -7.819  -3.017  -1.649
   80    HB3  LEU   9           1HB      LEU   9  -6.664  -3.418  -2.918
   81    HG   LEU   9           HG       LEU   9  -6.408  -5.692  -1.742
   82   HD11  LEU   9          1HD1      LEU   9  -7.456  -5.035   0.384
   83   HD12  LEU   9          2HD1      LEU   9  -8.339  -6.366  -0.360
   84   HD13  LEU   9          3HD1      LEU   9  -8.977  -4.728  -0.456
   85   HD21  LEU   9          3HD2      LEU   9  -9.091  -4.956  -2.949
   86   HD22  LEU   9          1HD2      LEU   9  -8.427  -6.582  -2.841
   87   HD23  LEU   9          2HD2      LEU   9  -7.643  -5.378  -3.859
   88    H    HIS  10           H        HIS  10  -6.454  -1.229  -2.213
   89    HA   HIS  10           HA       HIS  10  -4.060  -0.739  -3.677
   90    HB2  HIS  10           2HB      HIS  10  -5.122   1.112  -4.504
   91    HB3  HIS  10           1HB      HIS  10  -6.521   0.209  -3.944
   92    HD1  HIS  10           1HD      HIS  10  -4.205   3.014  -2.820
   93    HD2  HIS  10           2HD      HIS  10  -8.021   1.509  -2.002
   94    HE1  HIS  10           1HE      HIS  10  -5.327   4.686  -1.265
   95    HE2  HIS  10           2HE      HIS  10  -7.635   3.754  -0.707
   96    H    HIS  11           H        HIS  11  -5.374   0.187  -0.675
   97    HA   HIS  11           HA       HIS  11  -3.687   2.171   0.249
   98    HB2  HIS  11           2HB      HIS  11  -5.471   0.132   1.291
   99    HB3  HIS  11           1HB      HIS  11  -4.105   0.425   2.373
  100    HD1  HIS  11           1HD      HIS  11  -3.788   2.949   3.221
  101    HD2  HIS  11           2HD      HIS  11  -7.371   2.179   1.219
  102    HE1  HIS  11           1HE      HIS  11  -5.317   4.914   3.692
  103    HE2  HIS  11           2HE      HIS  11  -7.493   4.472   2.455
  104    H    LEU  12           H        LEU  12  -3.257  -1.239  -0.248
  105    HA   LEU  12           HA       LEU  12  -0.792  -1.395   1.287
  106    HB2  LEU  12           2HB      LEU  12  -2.587  -3.265   0.327
  107    HB3  LEU  12           1HB      LEU  12  -1.244  -3.430  -0.797
  108    HG   LEU  12           HG       LEU  12   0.260  -3.493   1.293
  109   HD11  LEU  12          1HD1      LEU  12  -2.012  -2.810   2.592
  110   HD12  LEU  12          2HD1      LEU  12  -0.690  -3.684   3.367
  111   HD13  LEU  12          3HD1      LEU  12  -2.095  -4.563   2.755
  112   HD21  LEU  12          3HD2      LEU  12  -1.480  -5.890   1.367
  113   HD22  LEU  12          1HD2      LEU  12   0.253  -5.767   1.069
  114   HD23  LEU  12          2HD2      LEU  12  -0.889  -5.442  -0.233
  115    H    ALA  13           H        ALA  13  -1.819  -1.240  -2.015
  116    HA   ALA  13           HA       ALA  13   0.669  -1.410  -3.320
  117    HB1  ALA  13           1HB      ALA  13  -1.493  -1.402  -4.536
  118    HB2  ALA  13           2HB      ALA  13  -0.378  -0.195  -5.178
  119    HB3  ALA  13           3HB      ALA  13  -1.701   0.299  -4.124
  120    H    HIS  14           H        HIS  14  -0.903   1.124  -1.597
  121    HA   HIS  14           HA       HIS  14   0.777   3.287  -2.360
  122    HB2  HIS  14           2HB      HIS  14  -1.144   4.053  -1.451
  123    HB3  HIS  14           1HB      HIS  14  -1.299   2.733  -0.322
  124    HD1  HIS  14           1HD      HIS  14   1.281   5.538  -0.779
  125    HD2  HIS  14           2HD      HIS  14  -0.946   3.661   2.210
  126    HE1  HIS  14           1HE      HIS  14   1.908   6.674   1.404
  127    HE2  HIS  14           2HE      HIS  14   0.539   5.560   3.238
  128    H    LEU  15           H        LEU  15   0.634   1.214   0.492
  129    HA   LEU  15           HA       LEU  15   2.963   2.171   1.766
  130    HB2  LEU  15           2HB      LEU  15   1.558  -0.504   1.747
  131    HB3  LEU  15           1HB      LEU  15   3.084  -0.301   2.595
  132    HG   LEU  15           HG       LEU  15   2.147   0.980   4.256
  133   HD11  LEU  15          1HD1      LEU  15   1.453   2.876   2.974
  134   HD12  LEU  15          2HD1      LEU  15   0.029   2.345   3.868
  135   HD13  LEU  15          3HD1      LEU  15   0.195   1.946   2.161
  136   HD21  LEU  15          3HD2      LEU  15   0.507  -0.377   4.998
  137   HD22  LEU  15          1HD2      LEU  15   0.591  -1.183   3.435
  138   HD23  LEU  15          2HD2      LEU  15  -0.579   0.111   3.696
  139    H    ALA  16           H        ALA  16   2.220  -0.128  -0.663
  140    HA   ALA  16           HA       ALA  16   4.806  -1.252  -1.012
  141    HB1  ALA  16           1HB      ALA  16   3.944  -2.305  -2.910
  142    HB2  ALA  16           2HB      ALA  16   2.867  -0.963  -3.282
  143    HB3  ALA  16           3HB      ALA  16   2.499  -2.040  -1.938
  144    H    LEU  17           H        LEU  17   3.290   1.637  -2.131
  145    HA   LEU  17           HA       LEU  17   5.024   2.267  -4.249
  146    HB2  LEU  17           2HB      LEU  17   3.616   4.003  -4.472
  147    HB3  LEU  17           1HB      LEU  17   2.788   3.442  -3.031
  148    HG   LEU  17           HG       LEU  17   4.480   4.797  -1.685
  149   HD11  LEU  17          1HD1      LEU  17   5.727   5.060  -4.175
  150   HD12  LEU  17          2HD1      LEU  17   6.107   5.985  -2.722
  151   HD13  LEU  17          3HD1      LEU  17   4.974   6.630  -3.908
  152   HD21  LEU  17          3HD2      LEU  17   2.066   5.500  -2.853
  153   HD22  LEU  17          1HD2      LEU  17   3.124   6.834  -3.299
  154   HD23  LEU  17          2HD2      LEU  17   2.906   6.414  -1.603
  155    H    HIS  18           H        HIS  18   5.125   3.304  -0.862
  156    HA   HIS  18           HA       HIS  18   7.716   4.525  -1.327
  157    HB2  HIS  18           2HB      HIS  18   7.722   5.132   0.961
  158    HB3  HIS  18           1HB      HIS  18   6.100   5.348   0.339
  159    HD1  HIS  18           1HD      HIS  18   8.034   3.412   2.836
  160    HD2  HIS  18           2HD      HIS  18   4.176   3.493   1.251
  161    HE1  HIS  18           1HE      HIS  18   6.591   2.043   4.413
  162    HE2  HIS  18           2HE      HIS  18   4.220   2.116   3.482
  163    H    LEU  19           H        LEU  19   6.441   1.612   0.053
  164    HA   LEU  19           HA       LEU  19   8.753   0.456   1.124
  165    HB2  LEU  19           2HB      LEU  19   6.239  -0.543  -0.026
  166    HB3  LEU  19           1HB      LEU  19   7.585  -1.650  -0.250
  167    HG   LEU  19           HG       LEU  19   6.492  -2.179   1.822
  168   HD11  LEU  19          1HD1      LEU  19   8.405  -2.397   3.054
  169   HD12  LEU  19          2HD1      LEU  19   8.795  -0.680   2.936
  170   HD13  LEU  19          3HD1      LEU  19   9.160  -1.764   1.592
  171   HD21  LEU  19          3HD2      LEU  19   6.779  -0.174   3.606
  172   HD22  LEU  19          1HD2      LEU  19   5.319  -0.397   2.640
  173   HD23  LEU  19          2HD2      LEU  19   6.544   0.764   2.132
  174    H    ALA  20           H        ALA  20   7.660   1.033  -2.096
  175    HA   ALA  20           HA       ALA  20   9.633  -0.516  -3.497
  176    HB1  ALA  20           1HB      ALA  20   7.433   0.539  -4.417
  177    HB2  ALA  20           2HB      ALA  20   8.851   0.491  -5.458
  178    HB3  ALA  20           3HB      ALA  20   8.418   1.985  -4.632
  179    H    LEU  21           H        LEU  21   9.293   2.954  -3.024
  180    HA   LEU  21           HA       LEU  21  11.752   3.816  -3.941
  181    HB2  LEU  21           2HB      LEU  21  10.333   4.872  -1.482
  182    HB3  LEU  21           1HB      LEU  21  11.511   5.743  -2.467
  183    HG   LEU  21           HG       LEU  21   8.795   4.756  -3.405
  184   HD11  LEU  21          1HD1      LEU  21   8.831   6.767  -1.883
  185   HD12  LEU  21          2HD1      LEU  21   8.193   7.090  -3.497
  186   HD13  LEU  21          3HD1      LEU  21   9.837   7.582  -3.084
  187   HD21  LEU  21          3HD2      LEU  21  10.036   4.676  -5.361
  188   HD22  LEU  21          1HD2      LEU  21  11.184   5.900  -4.806
  189   HD23  LEU  21          2HD2      LEU  21   9.578   6.382  -5.363
  190    H    ALA  22           H        ALA  22  10.840   2.776  -0.715
  191    HA   ALA  22           HA       ALA  22  13.336   2.967   0.539
  192    HB1  ALA  22           1HB      ALA  22  12.462   1.433   2.199
  193    HB2  ALA  22           2HB      ALA  22  11.225   0.866   1.078
  194    HB3  ALA  22           3HB      ALA  22  11.162   2.514   1.698
  195    H    LEU  23           H        LEU  23  11.876   0.369  -1.319
  196    HA   LEU  23           HA       LEU  23  13.923  -1.543  -0.985
  197    HB2  LEU  23           2HB      LEU  23  11.487  -1.422  -2.365
  198    HB3  LEU  23           1HB      LEU  23  12.701  -1.653  -3.620
  199    HG   LEU  23           HG       LEU  23  12.794  -3.322  -1.115
  200   HD11  LEU  23          1HD1      LEU  23  10.483  -3.451  -2.059
  201   HD12  LEU  23          2HD1      LEU  23  11.359  -4.977  -2.152
  202   HD13  LEU  23          3HD1      LEU  23  11.177  -3.977  -3.591
  203   HD21  LEU  23          3HD2      LEU  23  13.750  -4.957  -2.790
  204   HD22  LEU  23          1HD2      LEU  23  14.707  -3.489  -2.584
  205   HD23  LEU  23          2HD2      LEU  23  13.666  -3.674  -3.997
  206    H    LYS  24           H        LYS  24  13.294   0.841  -3.496
  207    HA   LYS  24           HA       LYS  24  15.609   0.353  -5.041
  208    HB2  LYS  24           2HB      LYS  24  13.456   1.861  -5.477
  209    HB3  LYS  24           1HB      LYS  24  14.516   3.127  -4.856
  210    HG2  LYS  24           2HG      LYS  24  16.109   1.648  -6.648
  211    HG3  LYS  24           1HG      LYS  24  14.552   1.812  -7.448
  212    HD2  LYS  24           2HD      LYS  24  15.797   3.748  -8.084
  213    HD3  LYS  24           1HD      LYS  24  14.655   4.296  -6.858
  214    HE2  LYS  24           2HE      LYS  24  17.105   5.081  -6.629
  215    HE3  LYS  24           1HE      LYS  24  16.324   4.430  -5.191
  216    HZ1  LYS  24           3HZ      LYS  24  17.677   2.662  -5.154
  217    HZ2  LYS  24           1HZ      LYS  24  18.685   3.593  -6.154
  218    HZ3  LYS  24           2HZ      LYS  24  17.636   2.458  -6.845
  219    H    LYS  25           H        LYS  25  14.986   2.280  -2.222
  220    HA   LYS  25           HA       LYS  25  16.341   3.355  -0.728
  221    HB2  LYS  25           2HB      LYS  25  17.648   1.061  -1.251
  222    HB3  LYS  25           1HB      LYS  25  18.847   2.213  -1.842
  223    HG2  LYS  25           2HG      LYS  25  18.041   3.363   0.542
  224    HG3  LYS  25           1HG      LYS  25  18.002   1.641   0.918
  225    HD2  LYS  25           2HD      LYS  25  20.225   2.040   1.356
  226    HD3  LYS  25           1HD      LYS  25  20.349   1.709  -0.369
  227    HE2  LYS  25           2HE      LYS  25  21.573   3.744   0.134
  228    HE3  LYS  25           1HE      LYS  25  20.148   4.150  -0.820
  229    HZ1  LYS  25           3HZ      LYS  25  20.845   4.960   1.819
  230    HZ2  LYS  25           1HZ      LYS  25  19.304   4.252   1.791
  231    HZ3  LYS  25           2HZ      LYS  25  19.646   5.584   0.783
  232    H    ALA  26           H        ALA  26  17.464   5.259  -0.554
  233    HA   ALA  26           HA       ALA  26  18.868   6.319  -2.891
  234    HB1  ALA  26           1HB      ALA  26  16.493   7.695  -1.608
  235    HB2  ALA  26           2HB      ALA  26  16.569   7.058  -3.252
  236    HB3  ALA  26           3HB      ALA  26  17.570   8.435  -2.793
  Start of MODEL   16
    1    H1   LYS   1           1HT      LYS   1 -26.425   3.339  -8.726
    2    H2   LYS   1           2HT      LYS   1 -25.769   4.550  -7.736
    3    H3   LYS   1           3HT      LYS   1 -25.781   2.936  -7.212
    4    HA   LYS   1           HA       LYS   1 -24.338   2.392  -9.161
    5    HB2  LYS   1           2HB      LYS   1 -24.494   5.389  -9.309
    6    HB3  LYS   1           1HB      LYS   1 -23.004   4.582  -9.795
    7    HG2  LYS   1           2HG      LYS   1 -23.931   3.755 -11.695
    8    HG3  LYS   1           1HG      LYS   1 -25.424   3.304 -10.883
    9    HD2  LYS   1           2HD      LYS   1 -26.469   5.126 -11.691
   10    HD3  LYS   1           1HD      LYS   1 -25.228   6.186 -11.020
   11    HE2  LYS   1           2HE      LYS   1 -24.755   4.623 -13.563
   12    HE3  LYS   1           1HE      LYS   1 -25.544   6.199 -13.594
   13    HZ1  LYS   1           2HZ      LYS   1 -22.817   5.563 -12.599
   14    HZ2  LYS   1           3HZ      LYS   1 -23.577   7.061 -12.349
   15    HZ3  LYS   1           1HZ      LYS   1 -23.235   6.539 -13.925
   16    H    LYS   2           H        LYS   2 -21.793   3.468  -8.878
   17    HA   LYS   2           HA       LYS   2 -20.001   3.552  -7.437
   18    HB2  LYS   2           2HB      LYS   2 -21.976   5.129  -6.192
   19    HB3  LYS   2           1HB      LYS   2 -21.358   4.065  -4.929
   20    HG2  LYS   2           2HG      LYS   2 -19.518   5.573  -6.792
   21    HG3  LYS   2           1HG      LYS   2 -20.109   6.279  -5.288
   22    HD2  LYS   2           2HD      LYS   2 -18.728   3.582  -5.386
   23    HD3  LYS   2           1HD      LYS   2 -17.850   5.091  -5.146
   24    HE2  LYS   2           2HE      LYS   2 -19.922   3.828  -3.350
   25    HE3  LYS   2           1HE      LYS   2 -18.275   4.312  -2.954
   26    HZ1  LYS   2           3HZ      LYS   2 -20.651   6.007  -3.357
   27    HZ2  LYS   2           1HZ      LYS   2 -19.097   6.643  -3.580
   28    HZ3  LYS   2           2HZ      LYS   2 -19.540   6.009  -2.074
   29    H    ALA   3           H        ALA   3 -19.404   1.452  -7.419
   30    HA   ALA   3           HA       ALA   3 -20.869  -0.581  -6.032
   31    HB1  ALA   3           1HB      ALA   3 -18.287  -0.465  -7.546
   32    HB2  ALA   3           2HB      ALA   3 -19.707  -1.472  -7.822
   33    HB3  ALA   3           3HB      ALA   3 -18.603  -1.849  -6.503
   34    H    LEU   4           H        LEU   4 -17.415  -0.104  -5.593
   35    HA   LEU   4           HA       LEU   4 -17.450  -0.885  -2.872
   36    HB2  LEU   4           2HB      LEU   4 -15.072  -0.132  -2.878
   37    HB3  LEU   4           1HB      LEU   4 -15.460  -1.203  -4.220
   38    HG   LEU   4           HG       LEU   4 -15.957   1.036  -5.510
   39   HD11  LEU   4          1HD1      LEU   4 -14.474   1.899  -3.050
   40   HD12  LEU   4          2HD1      LEU   4 -15.727   2.747  -3.956
   41   HD13  LEU   4          3HD1      LEU   4 -14.081   2.683  -4.582
   42   HD21  LEU   4          3HD2      LEU   4 -14.144  -0.563  -6.048
   43   HD22  LEU   4          1HD2      LEU   4 -13.142   0.154  -4.790
   44   HD23  LEU   4          2HD2      LEU   4 -13.583   1.098  -6.208
   45    H    LEU   5           H        LEU   5 -16.074   0.666  -1.337
   46    HA   LEU   5           HA       LEU   5 -17.323   3.338  -1.331
   47    HB2  LEU   5           2HB      LEU   5 -18.528   1.825   0.221
   48    HB3  LEU   5           1HB      LEU   5 -17.012   1.488   1.050
   49    HG   LEU   5           HG       LEU   5 -18.563   3.288   2.064
   50   HD11  LEU   5          1HD1      LEU   5 -15.882   2.891   2.222
   51   HD12  LEU   5          2HD1      LEU   5 -16.730   4.142   3.124
   52   HD13  LEU   5          3HD1      LEU   5 -15.916   4.546   1.614
   53   HD21  LEU   5          3HD2      LEU   5 -18.546   5.464   1.116
   54   HD22  LEU   5          1HD2      LEU   5 -18.863   4.391  -0.247
   55   HD23  LEU   5          2HD2      LEU   5 -17.246   5.058  -0.005
   56    H    ALA   6           H        ALA   6 -14.961   1.379   0.500
   57    HA   ALA   6           HA       ALA   6 -13.031   3.614   0.258
   58    HB1  ALA   6           1HB      ALA   6 -12.100   2.424   2.430
   59    HB2  ALA   6           2HB      ALA   6 -13.766   1.860   2.570
   60    HB3  ALA   6           3HB      ALA   6 -13.419   3.589   2.542
   61    H    LEU   7           H        LEU   7 -10.853   3.033  -0.085
   62    HA   LEU   7           HA       LEU   7 -10.427   0.785  -1.736
   63    HB2  LEU   7           2HB      LEU   7  -8.381   2.425  -0.219
   64    HB3  LEU   7           1HB      LEU   7  -8.032   1.327  -1.548
   65    HG   LEU   7           HG       LEU   7  -9.432   3.990  -1.613
   66   HD11  LEU   7          1HD1      LEU   7  -7.586   2.820  -3.675
   67   HD12  LEU   7          2HD1      LEU   7  -6.923   3.415  -2.150
   68   HD13  LEU   7          3HD1      LEU   7  -7.812   4.506  -3.212
   69   HD21  LEU   7          3HD2      LEU   7 -10.069   3.343  -4.015
   70   HD22  LEU   7          1HD2      LEU   7 -11.055   2.636  -2.736
   71   HD23  LEU   7          2HD2      LEU   7  -9.808   1.670  -3.524
   72    H    ALA   8           H        ALA   8  -8.865  -0.969  -1.313
   73    HA   ALA   8           HA       ALA   8  -8.790  -1.776   1.513
   74    HB1  ALA   8           1HB      ALA   8 -10.602  -3.079   0.906
   75    HB2  ALA   8           2HB      ALA   8  -9.266  -4.173   0.557
   76    HB3  ALA   8           3HB      ALA   8 -10.036  -3.275  -0.750
   77    H    LEU   9           H        LEU   9  -7.696  -2.627  -1.740
   78    HA   LEU   9           HA       LEU   9  -5.319  -3.909  -0.637
   79    HB2  LEU   9           2HB      LEU   9  -5.990  -3.372  -3.517
   80    HB3  LEU   9           1HB      LEU   9  -4.799  -4.506  -2.892
   81    HG   LEU   9           HG       LEU   9  -6.600  -5.931  -3.356
   82   HD11  LEU   9          1HD1      LEU   9  -7.308  -5.045  -0.555
   83   HD12  LEU   9          2HD1      LEU   9  -5.860  -5.981  -0.922
   84   HD13  LEU   9          3HD1      LEU   9  -7.454  -6.656  -1.249
   85   HD21  LEU   9          3HD2      LEU   9  -8.087  -3.633  -3.515
   86   HD22  LEU   9          1HD2      LEU   9  -8.764  -4.378  -2.066
   87   HD23  LEU   9          2HD2      LEU   9  -8.766  -5.255  -3.594
   88    H    HIS  10           H        HIS  10  -6.097  -1.236  -2.778
   89    HA   HIS  10           HA       HIS  10  -3.680  -0.180  -3.441
   90    HB2  HIS  10           2HB      HIS  10  -6.244   1.100  -2.616
   91    HB3  HIS  10           1HB      HIS  10  -4.821   2.120  -2.802
   92    HD1  HIS  10           1HD      HIS  10  -4.141   2.733  -5.146
   93    HD2  HIS  10           2HD      HIS  10  -6.913  -0.385  -5.082
   94    HE1  HIS  10           1HE      HIS  10  -4.801   2.304  -7.549
   95    HE2  HIS  10           2HE      HIS  10  -6.474   0.393  -7.534
   96    H    HIS  11           H        HIS  11  -5.286  -0.153  -0.413
   97    HA   HIS  11           HA       HIS  11  -4.023   1.500   1.295
   98    HB2  HIS  11           2HB      HIS  11  -4.961  -1.334   1.410
   99    HB3  HIS  11           1HB      HIS  11  -4.042  -0.714   2.789
  100    HD1  HIS  11           1HD      HIS  11  -5.464   0.442   4.526
  101    HD2  HIS  11           2HD      HIS  11  -7.210   0.576   0.736
  102    HE1  HIS  11           1HE      HIS  11  -7.716   1.582   4.809
  103    HE2  HIS  11           2HE      HIS  11  -8.792   1.668   2.503
  104    H    LEU  12           H        LEU  12  -2.911  -1.610   0.184
  105    HA   LEU  12           HA       LEU  12  -0.310  -1.323   1.460
  106    HB2  LEU  12           2HB      LEU  12  -1.581  -3.468  -0.240
  107    HB3  LEU  12           1HB      LEU  12   0.115  -3.531   0.236
  108    HG   LEU  12           HG       LEU  12  -2.203  -3.283   2.177
  109   HD11  LEU  12          1HD1      LEU  12  -0.446  -5.707   1.900
  110   HD12  LEU  12          2HD1      LEU  12  -1.810  -5.501   0.797
  111   HD13  LEU  12          3HD1      LEU  12  -2.086  -5.582   2.539
  112   HD21  LEU  12          3HD2      LEU  12   0.798  -3.481   2.440
  113   HD22  LEU  12          1HD2      LEU  12  -0.254  -4.042   3.741
  114   HD23  LEU  12          2HD2      LEU  12  -0.307  -2.355   3.230
  115    H    ALA  13           H        ALA  13  -1.676  -1.544  -1.749
  116    HA   ALA  13           HA       ALA  13   0.591  -1.348  -3.325
  117    HB1  ALA  13           1HB      ALA  13  -1.781   0.391  -3.958
  118    HB2  ALA  13           2HB      ALA  13  -1.924  -1.366  -4.037
  119    HB3  ALA  13           3HB      ALA  13  -0.761  -0.529  -5.065
  120    H    HIS  14           H        HIS  14  -0.946   0.989  -1.333
  121    HA   HIS  14           HA       HIS  14   0.482   3.310  -2.195
  122    HB2  HIS  14           2HB      HIS  14  -1.495   3.772  -1.107
  123    HB3  HIS  14           1HB      HIS  14  -1.250   2.556   0.121
  124    HD1  HIS  14           1HD      HIS  14   0.556   5.767  -0.952
  125    HD2  HIS  14           2HD      HIS  14  -0.541   3.678   2.492
  126    HE1  HIS  14           1HE      HIS  14   1.351   7.159   1.020
  127    HE2  HIS  14           2HE      HIS  14   0.691   5.901   3.132
  128    H    LEU  15           H        LEU  15   0.677   1.262   0.681
  129    HA   LEU  15           HA       LEU  15   3.064   2.345   1.712
  130    HB2  LEU  15           2HB      LEU  15   1.691  -0.316   1.915
  131    HB3  LEU  15           1HB      LEU  15   3.353  -0.193   2.473
  132    HG   LEU  15           HG       LEU  15   2.732   0.867   4.362
  133   HD11  LEU  15          1HD1      LEU  15   2.447   3.039   3.506
  134   HD12  LEU  15          2HD1      LEU  15   0.897   2.708   4.275
  135   HD13  LEU  15          3HD1      LEU  15   1.061   2.564   2.528
  136   HD21  LEU  15          3HD2      LEU  15   0.376   0.543   5.030
  137   HD22  LEU  15          1HD2      LEU  15   1.004  -0.884   4.203
  138   HD23  LEU  15          2HD2      LEU  15  -0.053   0.236   3.349
  139    H    ALA  16           H        ALA  16   2.263  -0.021  -0.624
  140    HA   ALA  16           HA       ALA  16   4.813  -1.085  -1.151
  141    HB1  ALA  16           1HB      ALA  16   3.835  -2.141  -2.980
  142    HB2  ALA  16           2HB      ALA  16   2.787  -0.767  -3.330
  143    HB3  ALA  16           3HB      ALA  16   2.431  -1.822  -1.961
  144    H    LEU  17           H        LEU  17   3.211   1.798  -2.197
  145    HA   LEU  17           HA       LEU  17   4.843   2.457  -4.373
  146    HB2  LEU  17           2HB      LEU  17   3.420   4.189  -4.507
  147    HB3  LEU  17           1HB      LEU  17   2.673   3.618  -3.026
  148    HG   LEU  17           HG       LEU  17   4.447   4.967  -1.773
  149   HD11  LEU  17          1HD1      LEU  17   6.057   6.004  -2.960
  150   HD12  LEU  17          2HD1      LEU  17   4.822   6.907  -3.838
  151   HD13  LEU  17          3HD1      LEU  17   5.372   5.347  -4.450
  152   HD21  LEU  17          3HD2      LEU  17   3.199   7.066  -2.069
  153   HD22  LEU  17          1HD2      LEU  17   2.100   5.689  -2.019
  154   HD23  LEU  17          2HD2      LEU  17   2.498   6.444  -3.563
  155    H    HIS  18           H        HIS  18   5.080   3.460  -0.989
  156    HA   HIS  18           HA       HIS  18   7.645   4.695  -1.525
  157    HB2  HIS  18           2HB      HIS  18   7.745   5.189   0.798
  158    HB3  HIS  18           1HB      HIS  18   6.109   5.464   0.235
  159    HD1  HIS  18           1HD      HIS  18   8.116   3.144   2.382
  160    HD2  HIS  18           2HD      HIS  18   4.149   3.780   1.248
  161    HE1  HIS  18           1HE      HIS  18   6.697   1.723   3.932
  162    HE2  HIS  18           2HE      HIS  18   4.270   2.131   3.296
  163    H    LEU  19           H        LEU  19   6.427   1.766  -0.093
  164    HA   LEU  19           HA       LEU  19   8.787   0.590   0.810
  165    HB2  LEU  19           2HB      LEU  19   6.186  -0.360   0.062
  166    HB3  LEU  19           1HB      LEU  19   7.383  -1.401  -0.685
  167    HG   LEU  19           HG       LEU  19   6.872  -2.289   1.472
  168   HD11  LEU  19          1HD1      LEU  19   9.382  -0.984   2.278
  169   HD12  LEU  19          2HD1      LEU  19   9.416  -1.680   0.657
  170   HD13  LEU  19          3HD1      LEU  19   9.025  -2.695   2.045
  171   HD21  LEU  19          3HD2      LEU  19   7.615   0.413   2.607
  172   HD22  LEU  19          1HD2      LEU  19   7.075  -0.992   3.526
  173   HD23  LEU  19          2HD2      LEU  19   5.962  -0.175   2.427
  174    H    ALA  20           H        ALA  20   7.504   1.160  -2.341
  175    HA   ALA  20           HA       ALA  20   9.319  -0.397  -3.877
  176    HB1  ALA  20           1HB      ALA  20   8.570   2.141  -5.124
  177    HB2  ALA  20           2HB      ALA  20   7.189   1.263  -4.471
  178    HB3  ALA  20           3HB      ALA  20   8.247   0.492  -5.651
  179    H    LEU  21           H        LEU  21   9.312   3.064  -3.246
  180    HA   LEU  21           HA       LEU  21  11.900   3.605  -4.194
  181    HB2  LEU  21           2HB      LEU  21  10.156   4.967  -2.140
  182    HB3  LEU  21           1HB      LEU  21  11.773   5.560  -2.512
  183    HG   LEU  21           HG       LEU  21  10.937   5.400  -5.019
  184   HD11  LEU  21          1HD1      LEU  21   8.387   5.499  -3.387
  185   HD12  LEU  21          2HD1      LEU  21   8.796   4.395  -4.704
  186   HD13  LEU  21          3HD1      LEU  21   8.474   6.096  -5.042
  187   HD21  LEU  21          3HD2      LEU  21  10.132   7.745  -4.826
  188   HD22  LEU  21          1HD2      LEU  21  11.605   7.473  -3.895
  189   HD23  LEU  21          2HD2      LEU  21  10.048   7.556  -3.077
  190    H    ALA  22           H        ALA  22  10.711   2.765  -1.002
  191    HA   ALA  22           HA       ALA  22  13.126   2.870   0.418
  192    HB1  ALA  22           1HB      ALA  22  10.856   0.933   0.888
  193    HB2  ALA  22           2HB      ALA  22  10.855   2.608   1.441
  194    HB3  ALA  22           3HB      ALA  22  12.047   1.471   2.069
  195    H    LEU  23           H        LEU  23  11.700   0.376  -1.576
  196    HA   LEU  23           HA       LEU  23  13.376  -1.765  -0.962
  197    HB2  LEU  23           2HB      LEU  23  11.387  -1.255  -2.862
  198    HB3  LEU  23           1HB      LEU  23  12.825  -1.607  -3.815
  199    HG   LEU  23           HG       LEU  23  11.504  -3.657  -3.280
  200   HD11  LEU  23          1HD1      LEU  23  13.456  -4.935  -2.278
  201   HD12  LEU  23          2HD1      LEU  23  14.276  -3.386  -2.098
  202   HD13  LEU  23          3HD1      LEU  23  13.842  -3.977  -3.700
  203   HD21  LEU  23          3HD2      LEU  23  11.230  -2.496  -0.769
  204   HD22  LEU  23          1HD2      LEU  23  12.408  -3.784  -0.493
  205   HD23  LEU  23          2HD2      LEU  23  10.830  -4.163  -1.177
  206    H    LYS  24           H        LYS  24  13.766   0.852  -3.276
  207    HA   LYS  24           HA       LYS  24  16.438  -0.049  -3.979
  208    HB2  LYS  24           2HB      LYS  24  14.938   0.897  -5.715
  209    HB3  LYS  24           1HB      LYS  24  14.969   2.441  -4.863
  210    HG2  LYS  24           2HG      LYS  24  17.582   1.157  -5.562
  211    HG3  LYS  24           1HG      LYS  24  16.674   1.945  -6.846
  212    HD2  LYS  24           2HD      LYS  24  17.078   4.031  -6.033
  213    HD3  LYS  24           1HD      LYS  24  16.812   3.533  -4.368
  214    HE2  LYS  24           2HE      LYS  24  19.350   3.459  -5.975
  215    HE3  LYS  24           1HE      LYS  24  19.077   4.078  -4.351
  216    HZ1  LYS  24           3HZ      LYS  24  20.257   2.067  -4.132
  217    HZ2  LYS  24           1HZ      LYS  24  19.226   1.240  -5.193
  218    HZ3  LYS  24           2HZ      LYS  24  18.658   1.729  -3.666
  219    H    LYS  25           H        LYS  25  14.983   2.830  -2.530
  220    HA   LYS  25           HA       LYS  25  17.640   3.645  -1.554
  221    HB2  LYS  25           2HB      LYS  25  15.717   5.115  -2.796
  222    HB3  LYS  25           1HB      LYS  25  15.326   5.431  -1.107
  223    HG2  LYS  25           2HG      LYS  25  18.108   5.724  -2.288
  224    HG3  LYS  25           1HG      LYS  25  16.975   7.059  -2.078
  225    HD2  LYS  25           2HD      LYS  25  16.845   6.399   0.387
  226    HD3  LYS  25           1HD      LYS  25  18.233   5.352   0.086
  227    HE2  LYS  25           2HE      LYS  25  18.116   8.287   0.337
  228    HE3  LYS  25           1HE      LYS  25  19.481   7.193   0.561
  229    HZ1  LYS  25           3HZ      LYS  25  18.456   8.350  -1.960
  230    HZ2  LYS  25           1HZ      LYS  25  19.462   6.986  -1.949
  231    HZ3  LYS  25           2HZ      LYS  25  20.017   8.449  -1.307
  232    H    ALA  26           H        ALA  26  18.115   2.809   0.367
  233    HA   ALA  26           HA       ALA  26  16.598   3.496   2.675
  234    HB1  ALA  26           1HB      ALA  26  15.193   1.619   1.945
  235    HB2  ALA  26           2HB      ALA  26  16.041   1.226   3.440
  236    HB3  ALA  26           3HB      ALA  26  16.611   0.566   1.906
  Start of MODEL   17
    1    H1   LYS   1           1HT      LYS   1 -27.092  -5.911  -5.943
    2    H2   LYS   1           2HT      LYS   1 -27.118  -6.126  -4.261
    3    H3   LYS   1           3HT      LYS   1 -27.400  -7.442  -5.293
    4    HA   LYS   1           HA       LYS   1 -25.253  -7.914  -5.004
    5    HB2  LYS   1           2HB      LYS   1 -25.187  -5.511  -6.844
    6    HB3  LYS   1           1HB      LYS   1 -23.740  -6.452  -6.486
    7    HG2  LYS   1           2HG      LYS   1 -25.981  -8.174  -7.198
    8    HG3  LYS   1           1HG      LYS   1 -25.638  -6.999  -8.465
    9    HD2  LYS   1           2HD      LYS   1 -23.192  -7.667  -8.274
   10    HD3  LYS   1           1HD      LYS   1 -23.716  -8.989  -7.232
   11    HE2  LYS   1           2HE      LYS   1 -23.439  -9.485  -9.758
   12    HE3  LYS   1           1HE      LYS   1 -24.912 -10.049  -8.974
   13    HZ1  LYS   1           2HZ      LYS   1 -26.163  -8.369  -9.933
   14    HZ2  LYS   1           3HZ      LYS   1 -25.086  -8.764 -11.180
   15    HZ3  LYS   1           1HZ      LYS   1 -24.811  -7.385 -10.238
   16    H    LYS   2           H        LYS   2 -24.419  -4.535  -5.339
   17    HA   LYS   2           HA       LYS   2 -24.277  -3.760  -2.648
   18    HB2  LYS   2           2HB      LYS   2 -21.818  -3.972  -2.278
   19    HB3  LYS   2           1HB      LYS   2 -22.626  -5.535  -2.358
   20    HG2  LYS   2           2HG      LYS   2 -21.868  -5.920  -4.596
   21    HG3  LYS   2           1HG      LYS   2 -21.333  -4.251  -4.773
   22    HD2  LYS   2           2HD      LYS   2 -19.920  -5.046  -2.553
   23    HD3  LYS   2           1HD      LYS   2 -19.970  -6.536  -3.499
   24    HE2  LYS   2           2HE      LYS   2 -18.006  -5.300  -4.185
   25    HE3  LYS   2           1HE      LYS   2 -19.181  -5.199  -5.493
   26    HZ1  LYS   2           3HZ      LYS   2 -19.062  -3.129  -3.394
   27    HZ2  LYS   2           1HZ      LYS   2 -19.710  -3.016  -4.959
   28    HZ3  LYS   2           2HZ      LYS   2 -18.024  -3.068  -4.735
   29    H    ALA   3           H        ALA   3 -21.991  -2.196  -2.667
   30    HA   ALA   3           HA       ALA   3 -22.756  -0.127  -4.521
   31    HB1  ALA   3           1HB      ALA   3 -21.834   0.304  -2.212
   32    HB2  ALA   3           2HB      ALA   3 -21.009   1.183  -3.497
   33    HB3  ALA   3           3HB      ALA   3 -20.268  -0.254  -2.799
   34    H    LEU   4           H        LEU   4 -20.737   0.975  -5.702
   35    HA   LEU   4           HA       LEU   4 -19.923  -0.899  -7.705
   36    HB2  LEU   4           2HB      LEU   4 -20.181   1.807  -7.692
   37    HB3  LEU   4           1HB      LEU   4 -18.436   1.655  -7.514
   38    HG   LEU   4           HG       LEU   4 -19.041  -0.234  -9.456
   39   HD11  LEU   4          1HD1      LEU   4 -20.320   1.250 -11.136
   40   HD12  LEU   4          2HD1      LEU   4 -20.840   2.172  -9.723
   41   HD13  LEU   4          3HD1      LEU   4 -21.264   0.466  -9.867
   42   HD21  LEU   4          3HD2      LEU   4 -18.367   2.109 -10.840
   43   HD22  LEU   4          1HD2      LEU   4 -17.251   0.896 -10.224
   44   HD23  LEU   4          2HD2      LEU   4 -17.654   2.304  -9.242
   45    H    LEU   5           H        LEU   5 -17.300  -0.225  -8.252
   46    HA   LEU   5           HA       LEU   5 -15.843  -2.045  -6.743
   47    HB2  LEU   5           2HB      LEU   5 -15.127   0.174  -8.604
   48    HB3  LEU   5           1HB      LEU   5 -13.840  -0.486  -7.598
   49    HG   LEU   5           HG       LEU   5 -14.024  -1.650  -9.795
   50   HD11  LEU   5          1HD1      LEU   5 -13.612  -3.760  -8.902
   51   HD12  LEU   5          2HD1      LEU   5 -14.928  -3.640  -7.737
   52   HD13  LEU   5          3HD1      LEU   5 -13.425  -2.762  -7.461
   53   HD21  LEU   5          3HD2      LEU   5 -16.454  -1.406 -10.087
   54   HD22  LEU   5          1HD2      LEU   5 -16.742  -2.484  -8.717
   55   HD23  LEU   5          2HD2      LEU   5 -15.990  -3.104 -10.187
   56    H    ALA   6           H        ALA   6 -14.283  -1.835  -5.129
   57    HA   ALA   6           HA       ALA   6 -14.216   0.693  -3.622
   58    HB1  ALA   6           1HB      ALA   6 -15.953  -1.007  -2.689
   59    HB2  ALA   6           2HB      ALA   6 -14.802  -0.286  -1.566
   60    HB3  ALA   6           3HB      ALA   6 -14.542  -1.927  -2.163
   61    H    LEU   7           H        LEU   7 -12.205   1.170  -2.913
   62    HA   LEU   7           HA       LEU   7 -10.022  -0.496  -3.707
   63    HB2  LEU   7           2HB      LEU   7 -10.022   1.911  -1.864
   64    HB3  LEU   7           1HB      LEU   7  -8.598   1.188  -2.611
   65    HG   LEU   7           HG       LEU   7 -10.844   2.718  -3.922
   66   HD11  LEU   7          1HD1      LEU   7  -9.196   4.206  -4.514
   67   HD12  LEU   7          2HD1      LEU   7  -7.955   2.961  -4.624
   68   HD13  LEU   7          3HD1      LEU   7  -8.461   3.565  -3.046
   69   HD21  LEU   7          3HD2      LEU   7  -9.071   0.602  -5.110
   70   HD22  LEU   7          1HD2      LEU   7  -9.502   2.010  -6.087
   71   HD23  LEU   7          2HD2      LEU   7 -10.764   0.951  -5.452
   72    H    ALA   8           H        ALA   8  -8.284  -1.111  -2.176
   73    HA   ALA   8           HA       ALA   8  -8.593  -1.459   0.565
   74    HB1  ALA   8           1HB      ALA   8 -10.378  -2.934   0.451
   75    HB2  ALA   8           2HB      ALA   8  -9.021  -4.062   0.392
   76    HB3  ALA   8           3HB      ALA   8  -9.859  -3.605  -1.093
   77    H    LEU   9           H        LEU   9  -7.386  -2.609  -2.445
   78    HA   LEU   9           HA       LEU   9  -5.096  -3.967  -1.269
   79    HB2  LEU   9           2HB      LEU   9  -5.808  -3.322  -4.118
   80    HB3  LEU   9           1HB      LEU   9  -4.457  -4.326  -3.603
   81    HG   LEU   9           HG       LEU   9  -6.160  -5.805  -2.409
   82   HD11  LEU   9          1HD1      LEU   9  -7.920  -3.775  -3.666
   83   HD12  LEU   9          2HD1      LEU   9  -8.209  -4.799  -2.260
   84   HD13  LEU   9          3HD1      LEU   9  -8.434  -5.443  -3.884
   85   HD21  LEU   9          3HD2      LEU   9  -5.710  -5.487  -5.329
   86   HD22  LEU   9          1HD2      LEU   9  -7.074  -6.512  -4.877
   87   HD23  LEU   9          2HD2      LEU   9  -5.452  -6.896  -4.299
   88    H    HIS  10           H        HIS  10  -5.613  -1.391  -3.606
   89    HA   HIS  10           HA       HIS  10  -3.148  -0.303  -3.952
   90    HB2  HIS  10           2HB      HIS  10  -5.768   1.106  -3.448
   91    HB3  HIS  10           1HB      HIS  10  -4.293   1.976  -3.852
   92    HD1  HIS  10           1HD      HIS  10  -6.212   2.460  -5.946
   93    HD2  HIS  10           2HD      HIS  10  -4.107  -1.148  -5.908
   94    HE1  HIS  10           1HE      HIS  10  -6.368   1.514  -8.288
   95    HE2  HIS  10           2HE      HIS  10  -5.068  -0.673  -8.295
   96    H    HIS  11           H        HIS  11  -5.307   0.081  -1.320
   97    HA   HIS  11           HA       HIS  11  -4.302   1.878   0.405
   98    HB2  HIS  11           2HB      HIS  11  -5.464  -0.864   0.628
   99    HB3  HIS  11           1HB      HIS  11  -4.897  -0.064   2.108
  100    HD1  HIS  11           1HD      HIS  11  -7.311   0.395   3.031
  101    HD2  HIS  11           2HD      HIS  11  -6.619   2.049  -0.740
  102    HE1  HIS  11           1HE      HIS  11  -9.259   1.953   2.554
  103    HE2  HIS  11           2HE      HIS  11  -8.865   2.950   0.245
  104    H    LEU  12           H        LEU  12  -3.246  -1.412  -0.018
  105    HA   LEU  12           HA       LEU  12  -0.971  -1.106   1.770
  106    HB2  LEU  12           2HB      LEU  12  -2.160  -3.368   0.181
  107    HB3  LEU  12           1HB      LEU  12  -0.522  -3.504   0.816
  108    HG   LEU  12           HG       LEU  12  -2.132  -4.470   2.398
  109   HD11  LEU  12          1HD1      LEU  12  -0.104  -2.864   3.070
  110   HD12  LEU  12          2HD1      LEU  12  -1.177  -3.560   4.284
  111   HD13  LEU  12          3HD1      LEU  12  -1.423  -1.902   3.738
  112   HD21  LEU  12          3HD2      LEU  12  -4.022  -3.372   3.175
  113   HD22  LEU  12          1HD2      LEU  12  -3.931  -2.721   1.540
  114   HD23  LEU  12          2HD2      LEU  12  -3.335  -1.773   2.901
  115    H    ALA  13           H        ALA  13  -1.685  -1.534  -1.621
  116    HA   ALA  13           HA       ALA  13   0.907  -1.734  -2.665
  117    HB1  ALA  13           1HB      ALA  13  -1.130  -0.028  -4.060
  118    HB2  ALA  13           2HB      ALA  13  -1.433  -1.757  -3.879
  119    HB3  ALA  13           3HB      ALA  13  -0.000  -1.198  -4.743
  120    H    HIS  14           H        HIS  14  -0.896   0.892  -1.385
  121    HA   HIS  14           HA       HIS  14   0.740   3.048  -2.245
  122    HB2  HIS  14           2HB      HIS  14  -1.271   3.822  -1.546
  123    HB3  HIS  14           1HB      HIS  14  -1.453   2.602  -0.305
  124    HD1  HIS  14           1HD      HIS  14   1.279   5.262  -0.741
  125    HD2  HIS  14           2HD      HIS  14  -1.530   3.956   2.057
  126    HE1  HIS  14           1HE      HIS  14   1.615   6.683   1.335
  127    HE2  HIS  14           2HE      HIS  14  -0.089   5.902   3.054
  128    H    LEU  15           H        LEU  15   0.459   1.329   0.844
  129    HA   LEU  15           HA       LEU  15   2.704   2.533   2.091
  130    HB2  LEU  15           2HB      LEU  15   1.428  -0.200   2.332
  131    HB3  LEU  15           1HB      LEU  15   2.863   0.219   3.255
  132    HG   LEU  15           HG       LEU  15   1.716   1.637   4.648
  133   HD11  LEU  15          1HD1      LEU  15  -0.319   2.891   3.996
  134   HD12  LEU  15          2HD1      LEU  15  -0.263   2.132   2.408
  135   HD13  LEU  15          3HD1      LEU  15   1.029   3.226   2.910
  136   HD21  LEU  15          3HD2      LEU  15  -0.780   0.263   3.739
  137   HD22  LEU  15          1HD2      LEU  15  -0.179   0.518   5.375
  138   HD23  LEU  15          2HD2      LEU  15   0.552  -0.716   4.353
  139    H    ALA  16           H        ALA  16   2.182   0.008  -0.135
  140    HA   ALA  16           HA       ALA  16   4.851  -1.024  -0.189
  141    HB1  ALA  16           1HB      ALA  16   2.646  -2.095  -1.072
  142    HB2  ALA  16           2HB      ALA  16   4.146  -2.385  -1.949
  143    HB3  ALA  16           3HB      ALA  16   2.998  -1.189  -2.542
  144    H    LEU  17           H        LEU  17   3.204   1.567  -1.775
  145    HA   LEU  17           HA       LEU  17   4.938   2.026  -3.918
  146    HB2  LEU  17           2HB      LEU  17   3.234   3.444  -4.297
  147    HB3  LEU  17           1HB      LEU  17   2.774   3.469  -2.607
  148    HG   LEU  17           HG       LEU  17   5.244   4.980  -3.291
  149   HD11  LEU  17          1HD1      LEU  17   3.790   5.513  -5.210
  150   HD12  LEU  17          2HD1      LEU  17   3.971   6.904  -4.143
  151   HD13  LEU  17          3HD1      LEU  17   2.490   5.948  -4.101
  152   HD21  LEU  17          3HD2      LEU  17   4.559   6.346  -1.528
  153   HD22  LEU  17          1HD2      LEU  17   3.880   4.795  -1.040
  154   HD23  LEU  17          2HD2      LEU  17   2.851   6.008  -1.798
  155    H    HIS  18           H        HIS  18   4.988   3.420  -0.647
  156    HA   HIS  18           HA       HIS  18   7.463   4.801  -1.249
  157    HB2  HIS  18           2HB      HIS  18   7.531   5.399   1.088
  158    HB3  HIS  18           1HB      HIS  18   5.928   5.627   0.430
  159    HD1  HIS  18           1HD      HIS  18   7.842   3.421   2.778
  160    HD2  HIS  18           2HD      HIS  18   3.916   4.042   1.509
  161    HE1  HIS  18           1HE      HIS  18   6.362   2.173   4.413
  162    HE2  HIS  18           2HE      HIS  18   3.957   2.546   3.657
  163    H    LEU  19           H        LEU  19   6.518   1.942   0.467
  164    HA   LEU  19           HA       LEU  19   8.973   1.014   1.403
  165    HB2  LEU  19           2HB      LEU  19   6.395  -0.128   0.804
  166    HB3  LEU  19           1HB      LEU  19   7.645  -1.195   0.179
  167    HG   LEU  19           HG       LEU  19   7.205  -1.860   2.428
  168   HD11  LEU  19          1HD1      LEU  19   9.688  -1.228   1.538
  169   HD12  LEU  19          2HD1      LEU  19   9.377  -1.989   3.098
  170   HD13  LEU  19          3HD1      LEU  19   9.616  -0.243   3.004
  171   HD21  LEU  19          3HD2      LEU  19   7.754   1.005   3.245
  172   HD22  LEU  19          1HD2      LEU  19   7.269  -0.317   4.307
  173   HD23  LEU  19          2HD2      LEU  19   6.139   0.304   3.102
  174    H    ALA  20           H        ALA  20   7.571   1.176  -1.741
  175    HA   ALA  20           HA       ALA  20   9.376  -0.441  -3.208
  176    HB1  ALA  20           1HB      ALA  20   8.275   2.030  -4.457
  177    HB2  ALA  20           2HB      ALA  20   7.133   0.809  -3.903
  178    HB3  ALA  20           3HB      ALA  20   8.357   0.392  -5.100
  179    H    LEU  21           H        LEU  21   9.263   3.053  -2.829
  180    HA   LEU  21           HA       LEU  21  11.586   3.811  -4.094
  181    HB2  LEU  21           2HB      LEU  21  10.645   4.918  -1.439
  182    HB3  LEU  21           1HB      LEU  21  11.661   5.745  -2.622
  183    HG   LEU  21           HG       LEU  21   8.829   4.794  -3.156
  184   HD11  LEU  21          1HD1      LEU  21   9.912   7.553  -2.518
  185   HD12  LEU  21          2HD1      LEU  21   8.798   6.611  -1.525
  186   HD13  LEU  21          3HD1      LEU  21   8.278   7.233  -3.092
  187   HD21  LEU  21          3HD2      LEU  21   9.237   6.565  -5.069
  188   HD22  LEU  21          1HD2      LEU  21   9.857   4.920  -5.257
  189   HD23  LEU  21          2HD2      LEU  21  10.940   6.223  -4.757
  190    H    ALA  22           H        ALA  22  11.180   2.782  -0.764
  191    HA   ALA  22           HA       ALA  22  13.873   2.860   0.035
  192    HB1  ALA  22           1HB      ALA  22  12.615   0.652   1.324
  193    HB2  ALA  22           2HB      ALA  22  11.405   1.919   1.134
  194    HB3  ALA  22           3HB      ALA  22  12.912   2.262   1.978
  195    H    LEU  23           H        LEU  23  11.941   0.308  -1.413
  196    HA   LEU  23           HA       LEU  23  13.884  -1.725  -1.442
  197    HB2  LEU  23           2HB      LEU  23  11.265  -1.447  -2.341
  198    HB3  LEU  23           1HB      LEU  23  12.186  -1.693  -3.821
  199    HG   LEU  23           HG       LEU  23  11.388  -3.832  -2.819
  200   HD11  LEU  23          1HD1      LEU  23  14.395  -3.615  -2.608
  201   HD12  LEU  23          2HD1      LEU  23  13.548  -3.596  -4.157
  202   HD13  LEU  23          3HD1      LEU  23  13.442  -5.008  -3.105
  203   HD21  LEU  23          3HD2      LEU  23  11.823  -4.437  -0.656
  204   HD22  LEU  23          1HD2      LEU  23  11.959  -2.696  -0.418
  205   HD23  LEU  23          2HD2      LEU  23  13.412  -3.670  -0.653
  206    H    LYS  24           H        LYS  24  13.056   0.755  -3.789
  207    HA   LYS  24           HA       LYS  24  14.959   0.090  -5.759
  208    HB2  LYS  24           2HB      LYS  24  12.968   1.956  -5.543
  209    HB3  LYS  24           1HB      LYS  24  14.407   2.968  -5.399
  210    HG2  LYS  24           2HG      LYS  24  14.765   1.013  -7.511
  211    HG3  LYS  24           1HG      LYS  24  13.280   1.924  -7.772
  212    HD2  LYS  24           2HD      LYS  24  15.933   3.251  -7.147
  213    HD3  LYS  24           1HD      LYS  24  15.367   2.964  -8.791
  214    HE2  LYS  24           2HE      LYS  24  13.471   4.295  -6.908
  215    HE3  LYS  24           1HE      LYS  24  14.837   5.247  -7.488
  216    HZ1  LYS  24           3HZ      LYS  24  13.725   3.837  -9.646
  217    HZ2  LYS  24           1HZ      LYS  24  13.815   5.512  -9.409
  218    HZ3  LYS  24           2HZ      LYS  24  12.475   4.643  -8.831
  219    H    LYS  25           H        LYS  25  15.051   2.502  -3.186
  220    HA   LYS  25           HA       LYS  25  17.683   1.988  -2.363
  221    HB2  LYS  25           2HB      LYS  25  18.646   4.233  -3.250
  222    HB3  LYS  25           1HB      LYS  25  18.640   2.828  -4.311
  223    HG2  LYS  25           2HG      LYS  25  17.219   3.805  -5.770
  224    HG3  LYS  25           1HG      LYS  25  16.145   4.358  -4.488
  225    HD2  LYS  25           2HD      LYS  25  16.966   6.354  -5.476
  226    HD3  LYS  25           1HD      LYS  25  17.932   6.160  -4.016
  227    HE2  LYS  25           2HE      LYS  25  18.806   5.214  -6.766
  228    HE3  LYS  25           1HE      LYS  25  19.299   6.743  -6.047
  229    HZ1  LYS  25           3HZ      LYS  25  20.111   5.335  -4.114
  230    HZ2  LYS  25           1HZ      LYS  25  21.009   5.256  -5.551
  231    HZ3  LYS  25           2HZ      LYS  25  19.941   3.997  -5.149
  232    H    ALA  26           H        ALA  26  16.913   5.324  -2.887
  233    HA   ALA  26           HA       ALA  26  15.297   5.782  -0.604
  234    HB1  ALA  26           1HB      ALA  26  16.785   6.437   1.035
  235    HB2  ALA  26           2HB      ALA  26  18.061   6.814  -0.121
  236    HB3  ALA  26           3HB      ALA  26  17.714   5.134   0.288
  Start of MODEL   18
    1    H1   LYS   1           1HT      LYS   1 -23.808  -6.353   1.722
    2    H2   LYS   1           2HT      LYS   1 -23.052  -4.885   2.114
    3    H3   LYS   1           3HT      LYS   1 -22.200  -6.089   1.274
    4    HA   LYS   1           HA       LYS   1 -22.928  -5.378  -0.675
    5    HB2  LYS   1           2HB      LYS   1 -25.043  -6.581  -0.257
    6    HB3  LYS   1           1HB      LYS   1 -25.669  -5.187   0.617
    7    HG2  LYS   1           2HG      LYS   1 -24.651  -4.622  -2.117
    8    HG3  LYS   1           1HG      LYS   1 -26.099  -5.621  -2.043
    9    HD2  LYS   1           2HD      LYS   1 -26.454  -3.502  -0.171
   10    HD3  LYS   1           1HD      LYS   1 -25.879  -2.780  -1.671
   11    HE2  LYS   1           2HE      LYS   1 -28.199  -4.725  -1.464
   12    HE3  LYS   1           1HE      LYS   1 -28.362  -2.974  -1.595
   13    HZ1  LYS   1           2HZ      LYS   1 -26.779  -4.469  -3.578
   14    HZ2  LYS   1           3HZ      LYS   1 -27.559  -2.968  -3.740
   15    HZ3  LYS   1           1HZ      LYS   1 -28.471  -4.398  -3.712
   16    H    LYS   2           H        LYS   2 -21.956  -3.469  -1.015
   17    HA   LYS   2           HA       LYS   2 -23.330  -1.026  -0.783
   18    HB2  LYS   2           2HB      LYS   2 -22.556  -1.676   1.692
   19    HB3  LYS   2           1HB      LYS   2 -21.035  -0.984   1.134
   20    HG2  LYS   2           2HG      LYS   2 -23.098   0.766   0.254
   21    HG3  LYS   2           1HG      LYS   2 -23.446   0.381   1.939
   22    HD2  LYS   2           2HD      LYS   2 -21.657   1.545   2.697
   23    HD3  LYS   2           1HD      LYS   2 -20.598   0.920   1.435
   24    HE2  LYS   2           2HE      LYS   2 -20.882   3.354   1.190
   25    HE3  LYS   2           1HE      LYS   2 -21.600   2.513  -0.182
   26    HZ1  LYS   2           3HZ      LYS   2 -23.742   2.600   1.151
   27    HZ2  LYS   2           1HZ      LYS   2 -23.199   4.056   0.476
   28    HZ3  LYS   2           2HZ      LYS   2 -22.964   3.751   2.130
   29    H    ALA   3           H        ALA   3 -21.017   0.621  -0.348
   30    HA   ALA   3           HA       ALA   3 -19.335  -0.111  -2.667
   31    HB1  ALA   3           1HB      ALA   3 -20.785   1.744  -3.309
   32    HB2  ALA   3           2HB      ALA   3 -19.134   2.331  -3.127
   33    HB3  ALA   3           3HB      ALA   3 -20.322   2.643  -1.865
   34    H    LEU   4           H        LEU   4 -17.180   0.030  -2.375
   35    HA   LEU   4           HA       LEU   4 -16.167   0.269   0.287
   36    HB2  LEU   4           2HB      LEU   4 -15.227  -1.220  -1.545
   37    HB3  LEU   4           1HB      LEU   4 -14.563   0.237  -2.278
   38    HG   LEU   4           HG       LEU   4 -13.460   0.703  -0.016
   39   HD11  LEU   4          1HD1      LEU   4 -14.675  -0.750   1.437
   40   HD12  LEU   4          2HD1      LEU   4 -13.060  -1.442   1.302
   41   HD13  LEU   4          3HD1      LEU   4 -14.396  -2.143   0.392
   42   HD21  LEU   4          3HD2      LEU   4 -12.765  -1.416  -1.985
   43   HD22  LEU   4          1HD2      LEU   4 -11.820  -1.374  -0.497
   44   HD23  LEU   4          2HD2      LEU   4 -11.882   0.047  -1.542
   45    H    LEU   5           H        LEU   5 -15.114   1.953   1.255
   46    HA   LEU   5           HA       LEU   5 -15.377   4.570   0.036
   47    HB2  LEU   5           2HB      LEU   5 -14.892   3.493   2.712
   48    HB3  LEU   5           1HB      LEU   5 -13.858   4.872   2.344
   49    HG   LEU   5           HG       LEU   5 -16.059   5.521   3.363
   50   HD11  LEU   5          1HD1      LEU   5 -14.717   6.990   1.784
   51   HD12  LEU   5          2HD1      LEU   5 -16.432   7.369   1.890
   52   HD13  LEU   5          3HD1      LEU   5 -15.817   6.479   0.502
   53   HD21  LEU   5          3HD2      LEU   5 -17.231   3.612   1.969
   54   HD22  LEU   5          1HD2      LEU   5 -17.356   4.865   0.729
   55   HD23  LEU   5          2HD2      LEU   5 -18.100   5.106   2.309
   56    H    ALA   6           H        ALA   6 -13.792   5.695  -0.975
   57    HA   ALA   6           HA       ALA   6 -11.813   5.987  -2.127
   58    HB1  ALA   6           1HB      ALA   6  -9.792   5.947  -0.639
   59    HB2  ALA   6           2HB      ALA   6 -10.801   5.274   0.641
   60    HB3  ALA   6           3HB      ALA   6 -11.130   6.891   0.016
   61    H    LEU   7           H        LEU   7  -9.827   3.902  -0.336
   62    HA   LEU   7           HA       LEU   7 -10.289   1.615  -2.109
   63    HB2  LEU   7           2HB      LEU   7  -7.690   3.140  -1.885
   64    HB3  LEU   7           1HB      LEU   7  -7.772   1.485  -2.483
   65    HG   LEU   7           HG       LEU   7  -9.227   3.879  -3.663
   66   HD11  LEU   7          1HD1      LEU   7  -7.079   2.186  -4.953
   67   HD12  LEU   7          2HD1      LEU   7  -6.687   3.622  -4.004
   68   HD13  LEU   7          3HD1      LEU   7  -7.679   3.765  -5.454
   69   HD21  LEU   7          3HD2      LEU   7 -10.595   2.374  -4.637
   70   HD22  LEU   7          1HD2      LEU   7  -9.739   1.043  -3.869
   71   HD23  LEU   7          2HD2      LEU   7  -9.196   1.656  -5.431
   72    H    ALA   8           H        ALA   8  -8.804  -0.237  -1.447
   73    HA   ALA   8           HA       ALA   8  -8.155  -0.188   1.415
   74    HB1  ALA   8           1HB      ALA   8  -9.805  -2.410   0.220
   75    HB2  ALA   8           2HB      ALA   8 -10.508  -1.055   1.105
   76    HB3  ALA   8           3HB      ALA   8  -9.402  -2.164   1.918
   77    H    LEU   9           H        LEU   9  -7.856  -1.661  -1.697
   78    HA   LEU   9           HA       LEU   9  -5.794  -3.519  -0.817
   79    HB2  LEU   9           2HB      LEU   9  -7.514  -4.074  -2.538
   80    HB3  LEU   9           1HB      LEU   9  -6.766  -2.882  -3.590
   81    HG   LEU   9           HG       LEU   9  -6.043  -5.317  -3.939
   82   HD11  LEU   9          1HD1      LEU   9  -3.594  -3.765  -3.258
   83   HD12  LEU   9          2HD1      LEU   9  -4.715  -3.015  -4.394
   84   HD13  LEU   9          3HD1      LEU   9  -4.019  -4.596  -4.748
   85   HD21  LEU   9          3HD2      LEU   9  -4.302  -4.827  -1.517
   86   HD22  LEU   9          1HD2      LEU   9  -4.582  -6.338  -2.380
   87   HD23  LEU   9          2HD2      LEU   9  -5.859  -5.649  -1.377
   88    H    HIS  10           H        HIS  10  -6.081  -0.957  -3.235
   89    HA   HIS  10           HA       HIS  10  -3.412  -0.608  -3.928
   90    HB2  HIS  10           2HB      HIS  10  -5.723   1.296  -3.670
   91    HB3  HIS  10           1HB      HIS  10  -4.121   1.907  -4.044
   92    HD1  HIS  10           1HD      HIS  10  -4.160   2.371  -6.509
   93    HD2  HIS  10           2HD      HIS  10  -5.930  -1.294  -5.565
   94    HE1  HIS  10           1HE      HIS  10  -4.732   1.255  -8.721
   95    HE2  HIS  10           2HE      HIS  10  -5.800  -0.993  -8.157
   96    H    HIS  11           H        HIS  11  -5.237   0.293  -1.181
   97    HA   HIS  11           HA       HIS  11  -3.765   2.094   0.240
   98    HB2  HIS  11           2HB      HIS  11  -5.662  -0.042   0.750
   99    HB3  HIS  11           1HB      HIS  11  -4.494   0.105   2.075
  100    HD1  HIS  11           1HD      HIS  11  -5.264   1.720   3.820
  101    HD2  HIS  11           2HD      HIS  11  -6.554   2.833   0.006
  102    HE1  HIS  11           1HE      HIS  11  -6.578   3.879   4.103
  103    HE2  HIS  11           2HE      HIS  11  -7.376   4.567   1.782
  104    H    LEU  12           H        LEU  12  -3.244  -1.346  -0.137
  105    HA   LEU  12           HA       LEU  12  -0.906  -1.399   1.572
  106    HB2  LEU  12           2HB      LEU  12  -2.263  -3.404  -0.219
  107    HB3  LEU  12           1HB      LEU  12  -0.662  -3.733   0.437
  108    HG   LEU  12           HG       LEU  12  -2.470  -4.665   1.873
  109   HD11  LEU  12          1HD1      LEU  12  -0.226  -3.214   2.658
  110   HD12  LEU  12          2HD1      LEU  12  -1.172  -4.295   3.679
  111   HD13  LEU  12          3HD1      LEU  12  -1.521  -2.565   3.665
  112   HD21  LEU  12          3HD2      LEU  12  -3.195  -1.783   2.454
  113   HD22  LEU  12          1HD2      LEU  12  -4.019  -3.237   3.010
  114   HD23  LEU  12          2HD2      LEU  12  -4.091  -2.783   1.310
  115    H    ALA  13           H        ALA  13  -1.634  -1.534  -1.843
  116    HA   ALA  13           HA       ALA  13   0.965  -1.781  -2.872
  117    HB1  ALA  13           1HB      ALA  13   0.103  -0.768  -4.920
  118    HB2  ALA  13           2HB      ALA  13  -1.293  -0.139  -4.052
  119    HB3  ALA  13           3HB      ALA  13  -1.103  -1.876  -4.267
  120    H    HIS  14           H        HIS  14  -0.762   0.855  -1.476
  121    HA   HIS  14           HA       HIS  14   0.979   2.960  -2.262
  122    HB2  HIS  14           2HB      HIS  14  -0.839   3.966  -1.505
  123    HB3  HIS  14           1HB      HIS  14  -1.339   2.596  -0.540
  124    HD1  HIS  14           1HD      HIS  14   1.742   4.835  -0.210
  125    HD2  HIS  14           2HD      HIS  14  -1.587   3.619   1.998
  126    HE1  HIS  14           1HE      HIS  14   1.999   5.859   2.100
  127    HE2  HIS  14           2HE      HIS  14  -0.047   5.162   3.447
  128    H    LEU  15           H        LEU  15   0.663   1.055   0.688
  129    HA   LEU  15           HA       LEU  15   2.882   2.135   2.075
  130    HB2  LEU  15           2HB      LEU  15   1.545  -0.581   2.075
  131    HB3  LEU  15           1HB      LEU  15   2.983  -0.285   3.040
  132    HG   LEU  15           HG       LEU  15   1.839   0.911   4.590
  133   HD11  LEU  15          1HD1      LEU  15   1.459   2.831   3.123
  134   HD12  LEU  15          2HD1      LEU  15   0.003   2.490   4.052
  135   HD13  LEU  15          3HD1      LEU  15   0.106   1.995   2.365
  136   HD21  LEU  15          3HD2      LEU  15  -0.293   0.010   5.000
  137   HD22  LEU  15          1HD2      LEU  15   0.449  -1.205   3.962
  138   HD23  LEU  15          2HD2      LEU  15  -0.697  -0.050   3.286
  139    H    ALA  16           H        ALA  16   2.374  -0.187  -0.357
  140    HA   ALA  16           HA       ALA  16   5.060  -1.202  -0.447
  141    HB1  ALA  16           1HB      ALA  16   2.635  -1.907  -1.614
  142    HB2  ALA  16           2HB      ALA  16   4.197  -2.663  -1.919
  143    HB3  ALA  16           3HB      ALA  16   3.623  -1.369  -2.971
  144    H    LEU  17           H        LEU  17   3.347   1.443  -1.867
  145    HA   LEU  17           HA       LEU  17   5.045   2.102  -3.962
  146    HB2  LEU  17           2HB      LEU  17   3.573   3.773  -4.225
  147    HB3  LEU  17           1HB      LEU  17   2.781   3.211  -2.764
  148    HG   LEU  17           HG       LEU  17   4.469   4.682  -1.488
  149   HD11  LEU  17          1HD1      LEU  17   4.714   6.585  -3.628
  150   HD12  LEU  17          2HD1      LEU  17   5.427   5.056  -4.143
  151   HD13  LEU  17          3HD1      LEU  17   5.996   5.845  -2.670
  152   HD21  LEU  17          3HD2      LEU  17   2.720   6.382  -3.223
  153   HD22  LEU  17          1HD2      LEU  17   2.926   6.402  -1.470
  154   HD23  LEU  17          2HD2      LEU  17   1.958   5.139  -2.229
  155    H    HIS  18           H        HIS  18   5.178   3.161  -0.594
  156    HA   HIS  18           HA       HIS  18   7.660   4.581  -1.143
  157    HB2  HIS  18           2HB      HIS  18   7.711   5.111   1.193
  158    HB3  HIS  18           1HB      HIS  18   6.085   5.331   0.582
  159    HD1  HIS  18           1HD      HIS  18   8.102   3.149   2.844
  160    HD2  HIS  18           2HD      HIS  18   4.156   3.543   1.539
  161    HE1  HIS  18           1HE      HIS  18   6.694   1.719   4.394
  162    HE2  HIS  18           2HE      HIS  18   4.279   1.935   3.608
  163    H    LEU  19           H        LEU  19   6.650   1.692   0.531
  164    HA   LEU  19           HA       LEU  19   9.109   0.699   1.387
  165    HB2  LEU  19           2HB      LEU  19   6.507  -0.373   0.967
  166    HB3  LEU  19           1HB      LEU  19   7.632  -1.436   0.137
  167    HG   LEU  19           HG       LEU  19   7.429  -2.241   2.371
  168   HD11  LEU  19          1HD1      LEU  19   9.668  -2.369   2.946
  169   HD12  LEU  19          2HD1      LEU  19   9.943  -0.648   2.671
  170   HD13  LEU  19          3HD1      LEU  19   9.815  -1.752   1.301
  171   HD21  LEU  19          3HD2      LEU  19   6.475  -0.152   3.304
  172   HD22  LEU  19          1HD2      LEU  19   8.083   0.570   3.285
  173   HD23  LEU  19          2HD2      LEU  19   7.747  -0.813   4.328
  174    H    ALA  20           H        ALA  20   7.593   0.884  -1.717
  175    HA   ALA  20           HA       ALA  20   9.496  -0.689  -3.188
  176    HB1  ALA  20           1HB      ALA  20   7.407   1.325  -3.948
  177    HB2  ALA  20           2HB      ALA  20   7.499  -0.384  -4.361
  178    HB3  ALA  20           3HB      ALA  20   8.575   0.771  -5.144
  179    H    LEU  21           H        LEU  21   8.934   2.777  -2.982
  180    HA   LEU  21           HA       LEU  21  11.175   3.707  -4.314
  181    HB2  LEU  21           2HB      LEU  21   9.188   4.848  -2.681
  182    HB3  LEU  21           1HB      LEU  21  10.719   5.287  -1.928
  183    HG   LEU  21           HG       LEU  21  10.034   5.704  -4.856
  184   HD11  LEU  21          1HD1      LEU  21   8.775   7.339  -3.770
  185   HD12  LEU  21          2HD1      LEU  21  10.316   8.176  -3.968
  186   HD13  LEU  21          3HD1      LEU  21   9.899   7.446  -2.418
  187   HD21  LEU  21          3HD2      LEU  21  12.402   5.450  -4.691
  188   HD22  LEU  21          1HD2      LEU  21  12.466   6.325  -3.159
  189   HD23  LEU  21          2HD2      LEU  21  12.135   7.191  -4.660
  190    H    ALA  22           H        ALA  22  10.795   2.840  -0.931
  191    HA   ALA  22           HA       ALA  22  13.451   3.324  -0.108
  192    HB1  ALA  22           1HB      ALA  22  12.951   1.871   1.792
  193    HB2  ALA  22           2HB      ALA  22  11.530   1.239   0.958
  194    HB3  ALA  22           3HB      ALA  22  11.576   2.926   1.472
  195    H    LEU  23           H        LEU  23  11.829   0.395  -1.192
  196    HA   LEU  23           HA       LEU  23  13.899  -1.435  -1.097
  197    HB2  LEU  23           2HB      LEU  23  11.344  -1.248  -2.364
  198    HB3  LEU  23           1HB      LEU  23  12.501  -1.819  -3.564
  199    HG   LEU  23           HG       LEU  23  11.458  -3.687  -2.281
  200   HD11  LEU  23          1HD1      LEU  23  13.499  -4.882  -1.908
  201   HD12  LEU  23          2HD1      LEU  23  14.387  -3.396  -1.583
  202   HD13  LEU  23          3HD1      LEU  23  13.826  -3.748  -3.219
  203   HD21  LEU  23          3HD2      LEU  23  13.060  -2.904   0.120
  204   HD22  LEU  23          1HD2      LEU  23  11.588  -3.867   0.024
  205   HD23  LEU  23          2HD2      LEU  23  11.508  -2.112  -0.131
  206    H    LYS  24           H        LYS  24  13.205   1.031  -3.444
  207    HA   LYS  24           HA       LYS  24  15.374   0.232  -5.199
  208    HB2  LYS  24           2HB      LYS  24  13.009   1.444  -5.673
  209    HB3  LYS  24           1HB      LYS  24  14.063   2.855  -5.588
  210    HG2  LYS  24           2HG      LYS  24  14.771   0.432  -7.260
  211    HG3  LYS  24           1HG      LYS  24  13.767   1.734  -7.895
  212    HD2  LYS  24           2HD      LYS  24  15.694   2.781  -8.452
  213    HD3  LYS  24           1HD      LYS  24  15.898   3.089  -6.726
  214    HE2  LYS  24           2HE      LYS  24  17.910   2.027  -7.343
  215    HE3  LYS  24           1HE      LYS  24  16.957   0.725  -6.635
  216    HZ1  LYS  24           3HZ      LYS  24  16.179   0.264  -8.977
  217    HZ2  LYS  24           1HZ      LYS  24  17.793  -0.117  -8.642
  218    HZ3  LYS  24           2HZ      LYS  24  17.422   1.293  -9.506
  219    H    LYS  25           H        LYS  25  14.669   2.894  -3.020
  220    HA   LYS  25           HA       LYS  25  17.187   4.211  -3.575
  221    HB2  LYS  25           2HB      LYS  25  15.128   5.483  -3.128
  222    HB3  LYS  25           1HB      LYS  25  15.074   4.815  -1.497
  223    HG2  LYS  25           2HG      LYS  25  17.677   6.010  -2.167
  224    HG3  LYS  25           1HG      LYS  25  16.347   7.168  -2.230
  225    HD2  LYS  25           2HD      LYS  25  16.645   5.284   0.108
  226    HD3  LYS  25           1HD      LYS  25  17.536   6.803   0.054
  227    HE2  LYS  25           2HE      LYS  25  14.520   6.517  -0.155
  228    HE3  LYS  25           1HE      LYS  25  15.408   7.081   1.259
  229    HZ1  LYS  25           3HZ      LYS  25  16.260   8.555  -0.957
  230    HZ2  LYS  25           1HZ      LYS  25  15.420   9.108   0.405
  231    HZ3  LYS  25           2HZ      LYS  25  14.563   8.563  -0.956
  232    H    ALA  26           H        ALA  26  15.829   2.375  -0.829
  233    HA   ALA  26           HA       ALA  26  18.247   2.794   0.739
  234    HB1  ALA  26           1HB      ALA  26  16.221   2.766   1.996
  235    HB2  ALA  26           2HB      ALA  26  17.048   1.256   2.366
  236    HB3  ALA  26           3HB      ALA  26  15.693   1.264   1.240
  Start of MODEL   19
    1    H1   LYS   1           1HT      LYS   1 -19.987 -15.267   5.750
    2    H2   LYS   1           2HT      LYS   1 -20.132 -15.835   4.156
    3    H3   LYS   1           3HT      LYS   1 -21.136 -14.587   4.714
    4    HA   LYS   1           HA       LYS   1 -18.667 -13.597   5.176
    5    HB2  LYS   1           2HB      LYS   1 -18.691 -14.855   2.416
    6    HB3  LYS   1           1HB      LYS   1 -17.381 -13.941   3.165
    7    HG2  LYS   1           2HG      LYS   1 -18.342 -16.338   4.659
    8    HG3  LYS   1           1HG      LYS   1 -17.471 -16.653   3.161
    9    HD2  LYS   1           2HD      LYS   1 -16.152 -14.585   4.733
   10    HD3  LYS   1           1HD      LYS   1 -16.345 -16.068   5.660
   11    HE2  LYS   1           2HE      LYS   1 -14.208 -15.969   4.331
   12    HE3  LYS   1           1HE      LYS   1 -15.216 -17.368   3.966
   13    HZ1  LYS   1           2HZ      LYS   1 -15.273 -14.849   2.399
   14    HZ2  LYS   1           3HZ      LYS   1 -16.000 -16.333   1.995
   15    HZ3  LYS   1           1HZ      LYS   1 -14.314 -16.187   1.993
   16    H    LYS   2           H        LYS   2 -18.896 -11.493   4.633
   17    HA   LYS   2           HA       LYS   2 -20.473 -10.703   2.323
   18    HB2  LYS   2           2HB      LYS   2 -22.144 -11.048   4.197
   19    HB3  LYS   2           1HB      LYS   2 -21.339  -9.733   5.059
   20    HG2  LYS   2           2HG      LYS   2 -22.007  -8.124   3.506
   21    HG3  LYS   2           1HG      LYS   2 -22.213  -9.306   2.213
   22    HD2  LYS   2           2HD      LYS   2 -24.093 -10.254   3.817
   23    HD3  LYS   2           1HD      LYS   2 -24.063  -8.618   4.469
   24    HE2  LYS   2           2HE      LYS   2 -25.686  -8.522   2.751
   25    HE3  LYS   2           1HE      LYS   2 -24.239  -7.836   2.014
   26    HZ1  LYS   2           3HZ      LYS   2 -23.881 -10.397   1.453
   27    HZ2  LYS   2           1HZ      LYS   2 -24.721  -9.343   0.423
   28    HZ3  LYS   2           2HZ      LYS   2 -25.579 -10.364   1.479
   29    H    ALA   3           H        ALA   3 -20.076  -8.570   1.684
   30    HA   ALA   3           HA       ALA   3 -18.730  -6.622   3.222
   31    HB1  ALA   3           1HB      ALA   3 -17.024  -8.487   1.598
   32    HB2  ALA   3           2HB      ALA   3 -16.719  -7.806   3.196
   33    HB3  ALA   3           3HB      ALA   3 -16.556  -6.793   1.762
   34    H    LEU   4           H        LEU   4 -18.475  -4.682   2.055
   35    HA   LEU   4           HA       LEU   4 -19.945  -4.642  -0.474
   36    HB2  LEU   4           2HB      LEU   4 -18.844  -2.203   0.900
   37    HB3  LEU   4           1HB      LEU   4 -20.252  -2.338  -0.148
   38    HG   LEU   4           HG       LEU   4 -21.168  -2.099   2.020
   39   HD11  LEU   4          1HD1      LEU   4 -21.219  -5.018   2.281
   40   HD12  LEU   4          2HD1      LEU   4 -21.578  -4.469   0.645
   41   HD13  LEU   4          3HD1      LEU   4 -22.543  -3.892   2.001
   42   HD21  LEU   4          3HD2      LEU   4 -19.714  -4.286   3.355
   43   HD22  LEU   4          1HD2      LEU   4 -20.102  -2.669   3.939
   44   HD23  LEU   4          2HD2      LEU   4 -18.702  -2.917   2.898
   45    H    LEU   5           H        LEU   5 -18.784  -2.316  -1.537
   46    HA   LEU   5           HA       LEU   5 -16.154  -3.367  -2.378
   47    HB2  LEU   5           2HB      LEU   5 -18.230  -3.042  -4.013
   48    HB3  LEU   5           1HB      LEU   5 -17.635  -1.379  -4.045
   49    HG   LEU   5           HG       LEU   5 -15.300  -2.799  -4.300
   50   HD11  LEU   5          1HD1      LEU   5 -16.106  -4.346  -6.323
   51   HD12  LEU   5          2HD1      LEU   5 -17.561  -4.443  -5.328
   52   HD13  LEU   5          3HD1      LEU   5 -16.005  -4.945  -4.669
   53   HD21  LEU   5          3HD2      LEU   5 -17.187  -1.777  -6.443
   54   HD22  LEU   5          1HD2      LEU   5 -15.515  -2.248  -6.751
   55   HD23  LEU   5          2HD2      LEU   5 -15.866  -0.899  -5.673
   56    H    ALA   6           H        ALA   6 -14.482  -2.243  -1.713
   57    HA   ALA   6           HA       ALA   6 -14.489   0.655  -1.738
   58    HB1  ALA   6           1HB      ALA   6 -15.127   0.764   0.454
   59    HB2  ALA   6           2HB      ALA   6 -13.444   0.337   0.754
   60    HB3  ALA   6           3HB      ALA   6 -14.685  -0.915   0.772
   61    H    LEU   7           H        LEU   7 -12.166   1.216  -0.539
   62    HA   LEU   7           HA       LEU   7 -10.248  -0.272  -2.170
   63    HB2  LEU   7           2HB      LEU   7 -10.447   2.442  -1.185
   64    HB3  LEU   7           1HB      LEU   7  -8.896   1.738  -0.727
   65    HG   LEU   7           HG       LEU   7  -8.839   0.877  -3.198
   66   HD11  LEU   7          1HD1      LEU   7 -11.134   1.497  -3.760
   67   HD12  LEU   7          2HD1      LEU   7 -10.005   2.425  -4.744
   68   HD13  LEU   7          3HD1      LEU   7 -10.792   3.183  -3.363
   69   HD21  LEU   7          3HD2      LEU   7  -7.339   2.620  -2.168
   70   HD22  LEU   7          1HD2      LEU   7  -8.520   3.847  -2.648
   71   HD23  LEU   7          2HD2      LEU   7  -7.672   2.912  -3.876
   72    H    ALA   8           H        ALA   8  -8.397  -1.270  -1.336
   73    HA   ALA   8           HA       ALA   8  -7.810  -1.378   1.458
   74    HB1  ALA   8           1HB      ALA   8  -9.901  -2.857   1.169
   75    HB2  ALA   8           2HB      ALA   8  -8.527  -3.543   2.033
   76    HB3  ALA   8           3HB      ALA   8  -8.822  -3.984   0.352
   77    H    LEU   9           H        LEU   9  -7.469  -2.644  -1.733
   78    HA   LEU   9           HA       LEU   9  -5.016  -4.072  -1.276
   79    HB2  LEU   9           2HB      LEU   9  -6.969  -3.859  -3.279
   80    HB3  LEU   9           1HB      LEU   9  -5.467  -3.286  -3.999
   81    HG   LEU   9           HG       LEU   9  -5.770  -5.913  -2.510
   82   HD11  LEU   9          1HD1      LEU   9  -5.423  -6.835  -4.889
   83   HD12  LEU   9          2HD1      LEU   9  -5.877  -5.224  -5.443
   84   HD13  LEU   9          3HD1      LEU   9  -7.013  -6.180  -4.493
   85   HD21  LEU   9          3HD2      LEU   9  -3.522  -5.982  -2.548
   86   HD22  LEU   9          1HD2      LEU   9  -3.475  -4.386  -3.292
   87   HD23  LEU   9          2HD2      LEU   9  -3.540  -5.827  -4.304
   88    H    HIS  10           H        HIS  10  -5.852  -1.279  -3.258
   89    HA   HIS  10           HA       HIS  10  -3.300  -0.378  -3.883
   90    HB2  HIS  10           2HB      HIS  10  -5.970   0.879  -3.669
   91    HB3  HIS  10           1HB      HIS  10  -4.598   1.983  -3.577
   92    HD1  HIS  10           1HD      HIS  10  -3.108   2.242  -5.668
   93    HD2  HIS  10           2HD      HIS  10  -6.215  -0.509  -6.166
   94    HE1  HIS  10           1HE      HIS  10  -3.190   1.690  -8.146
   95    HE2  HIS  10           2HE      HIS  10  -5.059  -0.008  -8.465
   96    H    HIS  11           H        HIS  11  -5.267   0.004  -1.103
   97    HA   HIS  11           HA       HIS  11  -4.067   1.859   0.494
   98    HB2  HIS  11           2HB      HIS  11  -5.602  -0.607   0.787
   99    HB3  HIS  11           1HB      HIS  11  -4.521  -0.321   2.162
  100    HD1  HIS  11           1HD      HIS  11  -4.720   2.179   3.243
  101    HD2  HIS  11           2HD      HIS  11  -7.895   0.904   0.854
  102    HE1  HIS  11           1HE      HIS  11  -6.682   3.693   3.789
  103    HE2  HIS  11           2HE      HIS  11  -8.631   2.930   2.335
  104    H    LEU  12           H        LEU  12  -3.143  -1.450  -0.128
  105    HA   LEU  12           HA       LEU  12  -0.758  -1.315   1.518
  106    HB2  LEU  12           2HB      LEU  12  -1.588  -3.416  -0.501
  107    HB3  LEU  12           1HB      LEU  12  -0.339  -3.588   0.732
  108    HG   LEU  12           HG       LEU  12  -3.242  -3.004   1.371
  109   HD11  LEU  12          1HD1      LEU  12  -3.555  -5.144   0.652
  110   HD12  LEU  12          2HD1      LEU  12  -2.833  -5.558   2.208
  111   HD13  LEU  12          3HD1      LEU  12  -1.839  -5.539   0.752
  112   HD21  LEU  12          3HD2      LEU  12  -0.734  -3.382   2.920
  113   HD22  LEU  12          1HD2      LEU  12  -2.153  -4.216   3.552
  114   HD23  LEU  12          2HD2      LEU  12  -2.186  -2.468   3.329
  115    H    ALA  13           H        ALA  13  -1.582  -1.556  -1.880
  116    HA   ALA  13           HA       ALA  13   0.928  -1.496  -3.062
  117    HB1  ALA  13           1HB      ALA  13  -0.120  -0.811  -5.026
  118    HB2  ALA  13           2HB      ALA  13  -1.226   0.270  -4.175
  119    HB3  ALA  13           3HB      ALA  13  -1.487  -1.475  -4.128
  120    H    HIS  14           H        HIS  14  -0.869   0.976  -1.461
  121    HA   HIS  14           HA       HIS  14   0.718   3.221  -2.215
  122    HB2  HIS  14           2HB      HIS  14  -1.260   3.929  -1.393
  123    HB3  HIS  14           1HB      HIS  14  -1.414   2.610  -0.258
  124    HD1  HIS  14           1HD      HIS  14   1.221   5.364  -0.591
  125    HD2  HIS  14           2HD      HIS  14  -1.382   3.734   2.234
  126    HE1  HIS  14           1HE      HIS  14   1.673   6.582   1.589
  127    HE2  HIS  14           2HE      HIS  14   0.101   5.595   3.328
  128    H    LEU  15           H        LEU  15   0.535   1.329   0.770
  129    HA   LEU  15           HA       LEU  15   2.805   2.436   2.029
  130    HB2  LEU  15           2HB      LEU  15   1.486  -0.278   2.149
  131    HB3  LEU  15           1HB      LEU  15   2.983   0.024   3.020
  132    HG   LEU  15           HG       LEU  15   1.965   1.374   4.575
  133   HD11  LEU  15          1HD1      LEU  15  -0.119   2.686   4.096
  134   HD12  LEU  15          2HD1      LEU  15  -0.033   2.109   2.432
  135   HD13  LEU  15          3HD1      LEU  15   1.247   3.135   3.078
  136   HD21  LEU  15          3HD2      LEU  15   0.798  -0.824   4.566
  137   HD22  LEU  15          1HD2      LEU  15  -0.417  -0.149   3.486
  138   HD23  LEU  15          2HD2      LEU  15  -0.250   0.479   5.125
  139    H    ALA  16           H        ALA  16   2.223  -0.001  -0.281
  140    HA   ALA  16           HA       ALA  16   4.859  -1.050  -0.454
  141    HB1  ALA  16           1HB      ALA  16   4.020  -2.416  -2.074
  142    HB2  ALA  16           2HB      ALA  16   3.170  -1.103  -2.887
  143    HB3  ALA  16           3HB      ALA  16   2.477  -1.843  -1.443
  144    H    LEU  17           H        LEU  17   3.241   1.647  -1.915
  145    HA   LEU  17           HA       LEU  17   5.029   2.127  -4.016
  146    HB2  LEU  17           2HB      LEU  17   3.280   3.501  -4.399
  147    HB3  LEU  17           1HB      LEU  17   2.869   3.603  -2.697
  148    HG   LEU  17           HG       LEU  17   5.360   5.025  -3.426
  149   HD11  LEU  17          1HD1      LEU  17   3.907   6.973  -4.297
  150   HD12  LEU  17          2HD1      LEU  17   2.688   5.742  -4.624
  151   HD13  LEU  17          3HD1      LEU  17   4.263   5.658  -5.415
  152   HD21  LEU  17          3HD2      LEU  17   4.751   6.328  -1.661
  153   HD22  LEU  17          1HD2      LEU  17   3.634   5.016  -1.301
  154   HD23  LEU  17          2HD2      LEU  17   3.076   6.430  -2.190
  155    H    HIS  18           H        HIS  18   5.029   3.374  -0.693
  156    HA   HIS  18           HA       HIS  18   7.551   4.720  -1.240
  157    HB2  HIS  18           2HB      HIS  18   7.547   5.406   1.064
  158    HB3  HIS  18           1HB      HIS  18   5.976   5.647   0.348
  159    HD1  HIS  18           1HD      HIS  18   7.718   3.708   2.992
  160    HD2  HIS  18           2HD      HIS  18   3.904   4.007   1.328
  161    HE1  HIS  18           1HE      HIS  18   6.130   2.619   4.639
  162    HE2  HIS  18           2HE      HIS  18   3.803   2.795   3.648
  163    H    LEU  19           H        LEU  19   6.448   1.902   0.470
  164    HA   LEU  19           HA       LEU  19   8.884   0.947   1.491
  165    HB2  LEU  19           2HB      LEU  19   6.331  -0.272   0.657
  166    HB3  LEU  19           1HB      LEU  19   7.714  -1.342   0.491
  167    HG   LEU  19           HG       LEU  19   8.248  -1.176   2.793
  168   HD11  LEU  19          1HD1      LEU  19   8.092   1.085   3.330
  169   HD12  LEU  19          2HD1      LEU  19   6.714   0.415   4.202
  170   HD13  LEU  19          3HD1      LEU  19   6.473   1.225   2.653
  171   HD21  LEU  19          3HD2      LEU  19   5.219  -1.138   2.678
  172   HD22  LEU  19          1HD2      LEU  19   6.227  -1.974   3.861
  173   HD23  LEU  19          2HD2      LEU  19   6.194  -2.522   2.186
  174    H    ALA  20           H        ALA  20   7.550   1.124  -1.676
  175    HA   ALA  20           HA       ALA  20   9.375  -0.586  -3.038
  176    HB1  ALA  20           1HB      ALA  20   8.651   1.482  -4.810
  177    HB2  ALA  20           2HB      ALA  20   7.258   1.224  -3.766
  178    HB3  ALA  20           3HB      ALA  20   7.925  -0.117  -4.687
  179    H    LEU  21           H        LEU  21   9.232   2.927  -2.884
  180    HA   LEU  21           HA       LEU  21  11.603   3.566  -4.112
  181    HB2  LEU  21           2HB      LEU  21   9.755   5.074  -2.974
  182    HB3  LEU  21           1HB      LEU  21  10.885   5.056  -1.621
  183    HG   LEU  21           HG       LEU  21  12.206   5.531  -4.203
  184   HD11  LEU  21          1HD1      LEU  21  10.102   6.672  -4.717
  185   HD12  LEU  21          2HD1      LEU  21  11.368   7.865  -4.420
  186   HD13  LEU  21          3HD1      LEU  21  10.168   7.527  -3.173
  187   HD21  LEU  21          3HD2      LEU  21  12.095   7.219  -1.687
  188   HD22  LEU  21          1HD2      LEU  21  13.345   7.234  -2.927
  189   HD23  LEU  21          2HD2      LEU  21  13.162   5.830  -1.877
  190    H    ALA  22           H        ALA  22  11.064   2.809  -0.722
  191    HA   ALA  22           HA       ALA  22  13.655   3.103   0.244
  192    HB1  ALA  22           1HB      ALA  22  12.978   1.283   1.910
  193    HB2  ALA  22           2HB      ALA  22  11.442   1.218   1.045
  194    HB3  ALA  22           3HB      ALA  22  11.947   2.710   1.842
  195    H    LEU  23           H        LEU  23  12.148   0.276  -1.221
  196    HA   LEU  23           HA       LEU  23  14.526  -1.341  -1.093
  197    HB2  LEU  23           2HB      LEU  23  11.959  -1.637  -2.668
  198    HB3  LEU  23           1HB      LEU  23  13.231  -2.857  -2.604
  199    HG   LEU  23           HG       LEU  23  11.973  -1.756  -0.091
  200   HD11  LEU  23          1HD1      LEU  23  10.484  -3.727  -0.119
  201   HD12  LEU  23          2HD1      LEU  23  11.083  -4.155  -1.718
  202   HD13  LEU  23          3HD1      LEU  23  10.166  -2.667  -1.492
  203   HD21  LEU  23          3HD2      LEU  23  12.669  -4.344   0.368
  204   HD22  LEU  23          1HD2      LEU  23  13.760  -2.985   0.635
  205   HD23  LEU  23          2HD2      LEU  23  13.860  -3.914  -0.860
  206    H    LYS  24           H        LYS  24  12.778   0.398  -3.570
  207    HA   LYS  24           HA       LYS  24  14.322  -0.142  -5.802
  208    HB2  LYS  24           2HB      LYS  24  12.260   1.102  -6.020
  209    HB3  LYS  24           1HB      LYS  24  12.882   2.397  -5.004
  210    HG2  LYS  24           2HG      LYS  24  14.546   1.760  -7.364
  211    HG3  LYS  24           1HG      LYS  24  12.959   2.433  -7.732
  212    HD2  LYS  24           2HD      LYS  24  13.570   4.486  -7.036
  213    HD3  LYS  24           1HD      LYS  24  14.238   3.853  -5.531
  214    HE2  LYS  24           2HE      LYS  24  16.017   4.902  -6.829
  215    HE3  LYS  24           1HE      LYS  24  16.287   3.166  -6.760
  216    HZ1  LYS  24           3HZ      LYS  24  15.764   4.836  -9.021
  217    HZ2  LYS  24           1HZ      LYS  24  14.721   3.503  -8.965
  218    HZ3  LYS  24           2HZ      LYS  24  16.400   3.263  -8.966
  219    H    LYS  25           H        LYS  25  14.740   2.348  -3.341
  220    HA   LYS  25           HA       LYS  25  17.326   3.121  -4.474
  221    HB2  LYS  25           2HB      LYS  25  15.449   4.650  -3.327
  222    HB3  LYS  25           1HB      LYS  25  16.344   4.221  -1.876
  223    HG2  LYS  25           2HG      LYS  25  17.321   5.714  -4.318
  224    HG3  LYS  25           1HG      LYS  25  17.376   6.221  -2.633
  225    HD2  LYS  25           2HD      LYS  25  18.907   3.766  -3.487
  226    HD3  LYS  25           1HD      LYS  25  19.563   5.356  -3.828
  227    HE2  LYS  25           2HE      LYS  25  20.205   4.184  -1.589
  228    HE3  LYS  25           1HE      LYS  25  19.798   5.898  -1.565
  229    HZ1  LYS  25           3HZ      LYS  25  17.953   3.649  -0.920
  230    HZ2  LYS  25           1HZ      LYS  25  17.536   5.300  -0.916
  231    HZ3  LYS  25           2HZ      LYS  25  18.673   4.713   0.200
  232    H    ALA  26           H        ALA  26  18.285   1.031  -4.077
  233    HA   ALA  26           HA       ALA  26  18.745   0.299  -1.276
  234    HB1  ALA  26           1HB      ALA  26  18.175  -1.504  -2.821
  235    HB2  ALA  26           2HB      ALA  26  19.826  -1.709  -2.237
  236    HB3  ALA  26           3HB      ALA  26  19.530  -1.072  -3.855
  Start of MODEL   20
    1    H1   LYS   1           1HT      LYS   1 -19.230  -1.384   3.829
    2    H2   LYS   1           2HT      LYS   1 -19.032   0.106   4.612
    3    H3   LYS   1           3HT      LYS   1 -18.040  -0.300   3.297
    4    HA   LYS   1           HA       LYS   1 -20.977   0.019   3.103
    5    HB2  LYS   1           2HB      LYS   1 -18.710   1.975   2.646
    6    HB3  LYS   1           1HB      LYS   1 -20.283   2.168   1.874
    7    HG2  LYS   1           2HG      LYS   1 -21.275   1.958   4.245
    8    HG3  LYS   1           1HG      LYS   1 -19.628   2.221   4.821
    9    HD2  LYS   1           2HD      LYS   1 -19.709   4.258   3.124
   10    HD3  LYS   1           1HD      LYS   1 -21.450   4.104   3.363
   11    HE2  LYS   1           2HE      LYS   1 -19.414   4.395   5.596
   12    HE3  LYS   1           1HE      LYS   1 -20.431   5.696   4.984
   13    HZ1  LYS   1           2HZ      LYS   1 -21.093   3.547   6.766
   14    HZ2  LYS   1           3HZ      LYS   1 -22.192   3.686   5.481
   15    HZ3  LYS   1           1HZ      LYS   1 -21.901   5.015   6.491
   16    H    LYS   2           H        LYS   2 -21.660   0.078   0.893
   17    HA   LYS   2           HA       LYS   2 -20.154  -1.745  -0.751
   18    HB2  LYS   2           2HB      LYS   2 -22.697  -0.226  -1.366
   19    HB3  LYS   2           1HB      LYS   2 -22.041  -1.573  -2.295
   20    HG2  LYS   2           2HG      LYS   2 -22.072  -2.617   0.247
   21    HG3  LYS   2           1HG      LYS   2 -23.508  -1.596   0.268
   22    HD2  LYS   2           2HD      LYS   2 -23.021  -3.407  -2.084
   23    HD3  LYS   2           1HD      LYS   2 -23.686  -4.082  -0.595
   24    HE2  LYS   2           2HE      LYS   2 -24.842  -1.799  -2.219
   25    HE3  LYS   2           1HE      LYS   2 -25.521  -3.418  -2.053
   26    HZ1  LYS   2           3HZ      LYS   2 -25.662  -1.177  -0.257
   27    HZ2  LYS   2           1HZ      LYS   2 -25.219  -2.621   0.514
   28    HZ3  LYS   2           2HZ      LYS   2 -26.661  -2.544  -0.372
   29    H    ALA   3           H        ALA   3 -20.621  -0.806  -3.320
   30    HA   ALA   3           HA       ALA   3 -19.427   0.390  -4.909
   31    HB1  ALA   3           1HB      ALA   3 -20.598   2.469  -3.075
   32    HB2  ALA   3           2HB      ALA   3 -21.061   2.059  -4.725
   33    HB3  ALA   3           3HB      ALA   3 -19.575   2.954  -4.424
   34    H    LEU   4           H        LEU   4 -17.826  -0.764  -2.924
   35    HA   LEU   4           HA       LEU   4 -15.902   1.215  -2.032
   36    HB2  LEU   4           2HB      LEU   4 -16.686  -1.137  -0.969
   37    HB3  LEU   4           1HB      LEU   4 -15.278  -1.683  -1.884
   38    HG   LEU   4           HG       LEU   4 -14.215   0.519  -0.761
   39   HD11  LEU   4          1HD1      LEU   4 -16.472   0.906   0.412
   40   HD12  LEU   4          2HD1      LEU   4 -15.034   0.924   1.434
   41   HD13  LEU   4          3HD1      LEU   4 -16.068  -0.500   1.394
   42   HD21  LEU   4          3HD2      LEU   4 -13.884  -1.325   1.280
   43   HD22  LEU   4          1HD2      LEU   4 -12.926  -1.271  -0.202
   44   HD23  LEU   4          2HD2      LEU   4 -14.323  -2.341  -0.089
   45    H    LEU   5           H        LEU   5 -13.579   0.868  -2.447
   46    HA   LEU   5           HA       LEU   5 -13.073  -0.022  -5.225
   47    HB2  LEU   5           2HB      LEU   5 -12.573   2.515  -3.917
   48    HB3  LEU   5           1HB      LEU   5 -11.052   1.789  -4.431
   49    HG   LEU   5           HG       LEU   5 -12.074   3.231  -6.191
   50   HD11  LEU   5          1HD1      LEU   5 -10.621   1.264  -6.747
   51   HD12  LEU   5          2HD1      LEU   5 -11.776   1.667  -8.014
   52   HD13  LEU   5          3HD1      LEU   5 -12.079   0.295  -6.954
   53   HD21  LEU   5          3HD2      LEU   5 -14.186   1.144  -6.610
   54   HD22  LEU   5          1HD2      LEU   5 -14.173   2.834  -7.105
   55   HD23  LEU   5          2HD2      LEU   5 -14.462   2.413  -5.416
   56    H    ALA   6           H        ALA   6 -10.477  -0.232  -5.379
   57    HA   ALA   6           HA       ALA   6  -9.806  -2.437  -3.683
   58    HB1  ALA   6           1HB      ALA   6  -7.697  -2.463  -4.891
   59    HB2  ALA   6           2HB      ALA   6  -8.009  -0.847  -5.525
   60    HB3  ALA   6           3HB      ALA   6  -9.015  -2.202  -6.034
   61    H    LEU   7           H        LEU   7 -10.401  -0.407  -2.011
   62    HA   LEU   7           HA       LEU   7  -8.475   1.371  -1.152
   63    HB2  LEU   7           2HB      LEU   7 -10.455  -0.239   0.485
   64    HB3  LEU   7           1HB      LEU   7  -9.503   1.099   1.128
   65    HG   LEU   7           HG       LEU   7 -11.315   1.356  -1.285
   66   HD11  LEU   7          1HD1      LEU   7 -12.946   2.379   0.205
   67   HD12  LEU   7          2HD1      LEU   7 -11.855   2.203   1.575
   68   HD13  LEU   7          3HD1      LEU   7 -12.554   0.772   0.827
   69   HD21  LEU   7          3HD2      LEU   7  -9.807   3.142  -1.366
   70   HD22  LEU   7          1HD2      LEU   7  -9.631   3.205   0.382
   71   HD23  LEU   7          2HD2      LEU   7 -11.094   3.828  -0.376
   72    H    ALA   8           H        ALA   8  -9.035  -1.317   1.002
   73    HA   ALA   8           HA       ALA   8  -6.652  -1.462   2.256
   74    HB1  ALA   8           1HB      ALA   8  -8.028  -4.001   1.398
   75    HB2  ALA   8           2HB      ALA   8  -8.733  -2.924   2.603
   76    HB3  ALA   8           3HB      ALA   8  -7.168  -3.678   2.900
   77    H    LEU   9           H        LEU   9  -7.296  -2.519  -0.948
   78    HA   LEU   9           HA       LEU   9  -4.876  -4.026  -1.300
   79    HB2  LEU   9           2HB      LEU   9  -7.171  -3.176  -2.895
   80    HB3  LEU   9           1HB      LEU   9  -5.653  -3.183  -3.791
   81    HG   LEU   9           HG       LEU   9  -5.262  -5.535  -2.833
   82   HD11  LEU   9          1HD1      LEU   9  -7.246  -6.738  -2.062
   83   HD12  LEU   9          2HD1      LEU   9  -8.242  -5.309  -2.309
   84   HD13  LEU   9          3HD1      LEU   9  -7.014  -5.311  -1.049
   85   HD21  LEU   9          3HD2      LEU   9  -6.008  -5.074  -5.184
   86   HD22  LEU   9          1HD2      LEU   9  -7.679  -5.166  -4.632
   87   HD23  LEU   9          2HD2      LEU   9  -6.646  -6.592  -4.546
   88    H    HIS  10           H        HIS  10  -5.974  -1.074  -2.855
   89    HA   HIS  10           HA       HIS  10  -3.498  -0.177  -3.793
   90    HB2  HIS  10           2HB      HIS  10  -5.969   1.324  -2.915
   91    HB3  HIS  10           1HB      HIS  10  -4.554   2.134  -3.572
   92    HD1  HIS  10           1HD      HIS  10  -6.395   2.754  -5.537
   93    HD2  HIS  10           2HD      HIS  10  -5.131  -1.215  -5.325
   94    HE1  HIS  10           1HE      HIS  10  -6.954   1.701  -7.775
   95    HE2  HIS  10           2HE      HIS  10  -6.235  -0.733  -7.641
   96    H    HIS  11           H        HIS  11  -5.154   0.195  -0.802
   97    HA   HIS  11           HA       HIS  11  -3.691   1.971   0.672
   98    HB2  HIS  11           2HB      HIS  11  -5.227  -0.507   1.151
   99    HB3  HIS  11           1HB      HIS  11  -4.145  -0.007   2.462
  100    HD1  HIS  11           1HD      HIS  11  -5.604   1.221   4.116
  101    HD2  HIS  11           2HD      HIS  11  -6.457   2.307   0.181
  102    HE1  HIS  11           1HE      HIS  11  -7.296   3.104   4.238
  103    HE2  HIS  11           2HE      HIS  11  -7.793   3.804   1.844
  104    H    LEU  12           H        LEU  12  -3.024  -1.380  -0.056
  105    HA   LEU  12           HA       LEU  12  -0.516  -1.385   1.417
  106    HB2  LEU  12           2HB      LEU  12  -2.216  -3.377   0.071
  107    HB3  LEU  12           1HB      LEU  12  -0.491  -3.647  -0.165
  108    HG   LEU  12           HG       LEU  12  -1.398  -4.784   1.870
  109   HD11  LEU  12          1HD1      LEU  12   0.494  -4.335   3.164
  110   HD12  LEU  12          2HD1      LEU  12   0.474  -2.616   2.773
  111   HD13  LEU  12          3HD1      LEU  12   1.003  -3.790   1.571
  112   HD21  LEU  12          3HD2      LEU  12  -2.409  -3.632   3.600
  113   HD22  LEU  12          1HD2      LEU  12  -2.900  -2.591   2.268
  114   HD23  LEU  12          2HD2      LEU  12  -1.521  -2.144   3.271
  115    H    ALA  13           H        ALA  13  -1.671  -1.419  -1.869
  116    HA   ALA  13           HA       ALA  13   0.789  -1.530  -3.227
  117    HB1  ALA  13           1HB      ALA  13  -0.409  -1.031  -5.110
  118    HB2  ALA  13           2HB      ALA  13  -1.235   0.326  -4.349
  119    HB3  ALA  13           3HB      ALA  13  -1.790  -1.322  -4.056
  120    H    HIS  14           H        HIS  14  -0.839   0.958  -1.506
  121    HA   HIS  14           HA       HIS  14   0.773   3.158  -2.361
  122    HB2  HIS  14           2HB      HIS  14  -1.204   3.899  -1.544
  123    HB3  HIS  14           1HB      HIS  14  -1.335   2.637  -0.342
  124    HD1  HIS  14           1HD      HIS  14   0.988   5.621  -0.958
  125    HD2  HIS  14           2HD      HIS  14  -0.947   3.645   2.169
  126    HE1  HIS  14           1HE      HIS  14   1.573   6.886   1.159
  127    HE2  HIS  14           2HE      HIS  14   0.449   5.663   3.090
  128    H    LEU  15           H        LEU  15   0.607   1.208   0.582
  129    HA   LEU  15           HA       LEU  15   2.864   2.288   1.879
  130    HB2  LEU  15           2HB      LEU  15   1.457  -0.371   1.959
  131    HB3  LEU  15           1HB      LEU  15   3.029  -0.222   2.732
  132    HG   LEU  15           HG       LEU  15   2.213   1.040   4.441
  133   HD11  LEU  15          1HD1      LEU  15   0.218   2.615   4.110
  134   HD12  LEU  15          2HD1      LEU  15   0.362   2.258   2.391
  135   HD13  LEU  15          3HD1      LEU  15   1.691   3.044   3.243
  136   HD21  LEU  15          3HD2      LEU  15   0.715  -0.997   4.133
  137   HD22  LEU  15          1HD2      LEU  15  -0.466   0.101   3.416
  138   HD23  LEU  15          2HD2      LEU  15   0.034   0.317   5.094
  139    H    ALA  16           H        ALA  16   2.264  -0.092  -0.493
  140    HA   ALA  16           HA       ALA  16   4.900  -1.134  -0.746
  141    HB1  ALA  16           1HB      ALA  16   2.867  -0.997  -2.965
  142    HB2  ALA  16           2HB      ALA  16   2.765  -2.175  -1.657
  143    HB3  ALA  16           3HB      ALA  16   4.152  -2.182  -2.745
  144    H    LEU  17           H        LEU  17   3.252   1.621  -2.062
  145    HA   LEU  17           HA       LEU  17   4.989   2.244  -4.149
  146    HB2  LEU  17           2HB      LEU  17   3.557   3.944  -4.432
  147    HB3  LEU  17           1HB      LEU  17   2.723   3.379  -2.997
  148    HG   LEU  17           HG       LEU  17   4.313   4.825  -1.632
  149   HD11  LEU  17          1HD1      LEU  17   4.889   6.704  -3.714
  150   HD12  LEU  17          2HD1      LEU  17   5.518   5.135  -4.211
  151   HD13  LEU  17          3HD1      LEU  17   6.031   5.848  -2.681
  152   HD21  LEU  17          3HD2      LEU  17   2.783   6.516  -3.595
  153   HD22  LEU  17          1HD2      LEU  17   2.933   6.705  -1.845
  154   HD23  LEU  17          2HD2      LEU  17   1.922   5.420  -2.513
  155    H    HIS  18           H        HIS  18   5.071   3.275  -0.769
  156    HA   HIS  18           HA       HIS  18   7.620   4.597  -1.255
  157    HB2  HIS  18           2HB      HIS  18   7.637   5.162   1.078
  158    HB3  HIS  18           1HB      HIS  18   6.061   5.479   0.394
  159    HD1  HIS  18           1HD      HIS  18   7.792   3.349   2.900
  160    HD2  HIS  18           2HD      HIS  18   3.963   3.807   1.295
  161    HE1  HIS  18           1HE      HIS  18   6.209   2.104   4.449
  162    HE2  HIS  18           2HE      HIS  18   3.863   2.406   3.510
  163    H    LEU  19           H        LEU  19   6.417   1.736   0.297
  164    HA   LEU  19           HA       LEU  19   8.773   0.613   1.298
  165    HB2  LEU  19           2HB      LEU  19   6.194  -0.398   0.384
  166    HB3  LEU  19           1HB      LEU  19   7.494  -1.514   0.006
  167    HG   LEU  19           HG       LEU  19   8.056  -1.829   2.238
  168   HD11  LEU  19          1HD1      LEU  19   7.017   0.933   2.535
  169   HD12  LEU  19          2HD1      LEU  19   8.411   0.167   3.302
  170   HD13  LEU  19          3HD1      LEU  19   6.790  -0.125   3.931
  171   HD21  LEU  19          3HD2      LEU  19   5.792  -2.706   1.714
  172   HD22  LEU  19          1HD2      LEU  19   5.093  -1.198   2.313
  173   HD23  LEU  19          2HD2      LEU  19   5.956  -2.271   3.417
  174    H    ALA  20           H        ALA  20   7.519   0.998  -1.898
  175    HA   ALA  20           HA       ALA  20   9.433  -0.624  -3.275
  176    HB1  ALA  20           1HB      ALA  20   8.753   0.580  -5.297
  177    HB2  ALA  20           2HB      ALA  20   7.916   1.775  -4.313
  178    HB3  ALA  20           3HB      ALA  20   7.338   0.110  -4.358
  179    H    LEU  21           H        LEU  21   9.176   2.890  -3.069
  180    HA   LEU  21           HA       LEU  21  11.666   3.554  -4.079
  181    HB2  LEU  21           2HB      LEU  21  10.155   4.903  -1.826
  182    HB3  LEU  21           1HB      LEU  21  11.501   5.622  -2.709
  183    HG   LEU  21           HG       LEU  21   8.843   4.757  -3.892
  184   HD11  LEU  21          1HD1      LEU  21   8.177   6.894  -3.592
  185   HD12  LEU  21          2HD1      LEU  21   9.677   7.516  -4.275
  186   HD13  LEU  21          3HD1      LEU  21   9.594   7.112  -2.562
  187   HD21  LEU  21          3HD2      LEU  21  10.027   6.156  -5.850
  188   HD22  LEU  21          1HD2      LEU  21  10.270   4.416  -5.683
  189   HD23  LEU  21          2HD2      LEU  21  11.479   5.542  -5.066
  190    H    ALA  22           H        ALA  22  10.739   2.913  -0.750
  191    HA   ALA  22           HA       ALA  22  13.197   3.215   0.504
  192    HB1  ALA  22           1HB      ALA  22  12.228   1.206   1.969
  193    HB2  ALA  22           2HB      ALA  22  10.766   1.598   1.067
  194    HB3  ALA  22           3HB      ALA  22  11.549   2.831   2.053
  195    H    LEU  23           H        LEU  23  11.942   0.497  -1.304
  196    HA   LEU  23           HA       LEU  23  14.261  -1.164  -0.764
  197    HB2  LEU  23           2HB      LEU  23  11.642  -1.497  -2.070
  198    HB3  LEU  23           1HB      LEU  23  12.961  -2.348  -2.874
  199    HG   LEU  23           HG       LEU  23  13.563  -3.066  -0.391
  200   HD11  LEU  23          1HD1      LEU  23  11.585  -3.346   0.997
  201   HD12  LEU  23          2HD1      LEU  23  10.560  -2.662  -0.262
  202   HD13  LEU  23          3HD1      LEU  23  11.732  -1.641   0.570
  203   HD21  LEU  23          3HD2      LEU  23  12.310  -5.113  -0.759
  204   HD22  LEU  23          1HD2      LEU  23  12.904  -4.539  -2.319
  205   HD23  LEU  23          2HD2      LEU  23  11.217  -4.286  -1.868
  206    H    LYS  24           H        LYS  24  12.793   0.347  -3.586
  207    HA   LYS  24           HA       LYS  24  14.782  -0.191  -5.461
  208    HB2  LYS  24           2HB      LYS  24  12.680   1.904  -5.164
  209    HB3  LYS  24           1HB      LYS  24  13.930   2.155  -6.382
  210    HG2  LYS  24           2HG      LYS  24  13.093  -0.563  -6.595
  211    HG3  LYS  24           1HG      LYS  24  11.636   0.424  -6.509
  212    HD2  LYS  24           2HD      LYS  24  12.395   0.161  -8.844
  213    HD3  LYS  24           1HD      LYS  24  12.475   1.846  -8.333
  214    HE2  LYS  24           2HE      LYS  24  14.649   1.875  -8.907
  215    HE3  LYS  24           1HE      LYS  24  14.971   0.697  -7.637
  216    HZ1  LYS  24           3HZ      LYS  24  15.609  -0.575  -9.351
  217    HZ2  LYS  24           1HZ      LYS  24  14.746   0.330 -10.493
  218    HZ3  LYS  24           2HZ      LYS  24  13.952  -0.855  -9.566
  219    H    LYS  25           H        LYS  25  14.387   2.691  -3.456
  220    HA   LYS  25           HA       LYS  25  17.119   3.533  -4.114
  221    HB2  LYS  25           2HB      LYS  25  15.327   5.211  -4.320
  222    HB3  LYS  25           1HB      LYS  25  14.883   4.963  -2.637
  223    HG2  LYS  25           2HG      LYS  25  16.497   6.959  -3.405
  224    HG3  LYS  25           1HG      LYS  25  16.690   6.170  -1.848
  225    HD2  LYS  25           2HD      LYS  25  18.375   4.623  -2.942
  226    HD3  LYS  25           1HD      LYS  25  18.251   5.622  -4.389
  227    HE2  LYS  25           2HE      LYS  25  20.167   6.266  -2.910
  228    HE3  LYS  25           1HE      LYS  25  19.022   7.578  -3.171
  229    HZ1  LYS  25           3HZ      LYS  25  18.189   6.089  -0.927
  230    HZ2  LYS  25           1HZ      LYS  25  18.707   7.702  -0.997
  231    HZ3  LYS  25           2HZ      LYS  25  19.834   6.462  -0.744
  232    H    ALA  26           H        ALA  26  16.123   4.789  -1.189
  233    HA   ALA  26           HA       ALA  26  16.545   2.893   0.762
  234    HB1  ALA  26           1HB      ALA  26  18.722   2.338   0.675
  235    HB2  ALA  26           2HB      ALA  26  19.127   4.021   1.003
  236    HB3  ALA  26           3HB      ALA  26  18.986   3.460  -0.658