*HEADER    DE NOVO PROTEIN                         04-AUG-99   1CQ0              
*TITLE     SOLUTION STRUCTURE OF A HUMAN HYPOCRETIN-2/OREXIN-                    
*TITLE    2 B'SOLUTION STRUCTURE OF A HUMAN HYPOCRETIN-2/OREXIN-B '              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEW HYPOTHALAMIC NEUROPEPTIDE/OREXIN-B28;                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: HUMAN HYPOCRETIN-2;                                        
*COMPND   5 OTHER_DETAILS: SYNTHETIC PEPTIDE                                     
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   3 OTHER_DETAILS: SYNTHETIC                                             
*KEYWDS    OBESITY, HUMAN HCRT-2/OX-B,NEUROPEPTIDE, SOLUTION STRUCTURE,          
*KEYWDS   2 NMR                                                                  
*EXPDTA    NMR                                                                   
*AUTHOR    K.-H.LEE, E.J.BANG, K.-J.CHAE, D.W.LEE, W.LEE                         
*REVDAT   1   12-JAN-00 1CQ0    0                                                



assign (resid 1 and name HA) (resid 1 and name HN) 2.5 0.7 0.2
assign (resid 1 and name HB*) (resid 1 and name HN) 2.5 0.7 1.2
assign (resid 2 and name HA) (resid 2 and name HN) 2.5 0.7 0.2
assign (resid 2 and name HB*) (resid 2 and name HN) 3.0 1.2 1.3
assign (resid 3 and name HA*) (resid 3 and name HN) 2.5 0.7 1.2
assign (resid 4 and name HA) (resid 4 and name HG*) 3.0 1.2 1.3
assign (resid 4 and name HA) (resid 4 and name HD*) 4.0 2.2 2.0
assign (resid 5 and name HA) (resid 5 and name HB*) 2.5 0.7 1.2
assign (resid 5 and name HA) (resid 5 and name HG*) 3.0 1.2 1.3
assign (resid 5 and name HA) (resid 5 and name HD*) 4.0 2.2 2.0
assign (resid 6 and name HA*) (resid 6 and name HN) 3.0 1.2 1.3
assign (resid 7 and name HA) (resid 7 and name HN) 2.5 0.7 0.2
assign (resid 7 and name HB*) (resid 7 and name HN) 2.5 0.7 1.2
assign (resid 7 and name HG) (resid 7 and name HN) 3.0 1.2 0.3
assign (resid 7 and name HD*) (resid 7 and name HN) 3.0 1.2 1.3
assign (resid 7 and name HA) (resid 7 and name HG) 3.0 1.2 0.3
assign (resid 7 and name HA) (resid 7 and name HD*) 3.0 1.2 1.3
assign (resid 7 and name HB*) (resid 7 and name HG) 3.0 1.2 1.3
assign (resid 7 and name HB*) (resid 7 and name HD*) 2.5 0.7 1.2
assign (resid 7 and name HG) (resid 7 and name HD*) 2.5 0.7 1.2
assign (resid 8 and name HA) (resid 8 and name HN) 2.5 0.7 0.2
assign (resid 8 and name HB*) (resid 8 and name HN) 2.5 0.7 1.2
assign (resid 8 and name HG) (resid 8 and name HN) 3.0 1.2 0.3
assign (resid 8 and name HA) (resid 8 and name HB*) 3.0 1.2 1.3
assign (resid 8 and name HA) (resid 8 and name HG) 3.0 1.2 0.3
assign (resid 9 and name HA*) (resid 9 and name HN) 3.0 1.2 1.3
assign (resid 10 and name HA) (resid 10 and name HN) 2.5 0.7 0.2
assign (resid 10 and name HB*) (resid 10 and name HN) 2.5 0.7 1.2
assign (resid 10 and name HG*) (resid 10 and name HN) 3.0 1.2 1.3
assign (resid 10 and name HD*) (resid 10 and name HN) 3.0 1.2 1.3
assign (resid 10 and name HA) (resid 10 and name HB*) 2.5 0.7 1.2
assign (resid 10 and name HA) (resid 10 and name HG*) 3.0 1.2 1.3
assign (resid 10 and name HA) (resid 10 and name HD*) 3.0 1.2 1.3
assign (resid 10 and name HB*) (resid 10 and name HD*) 3.0 1.2 1.3
assign (resid 11 and name HA) (resid 11 and name HN) 2.5 0.7 0.2
assign (resid 11 and name HB*) (resid 11 and name HN) 2.5 0.7 1.2
assign (resid 11 and name HG) (resid 11 and name HN) 3.0 1.2 0.3
assign (resid 11 and name HD*) (resid 11 and name HN) 3.0 1.2 1.3
assign (resid 11 and name HA) (resid 11 and name HB*) 2.5 0.7 1.2
assign (resid 11 and name HA) (resid 11 and name HG) 3.0 1.2 0.3
assign (resid 11 and name HA) (resid 11 and name HD*) 3.0 1.2 1.3
assign (resid 11 and name HB*) (resid 11 and name HD*) 3.0 1.2 1.3
assign (resid 12 and name HA) (resid 12 and name HN) 3.0 1.2 0.3
assign (resid 12 and name HB*) (resid 12 and name HN) 3.0 1.2 1.3
assign (resid 12 and name HG) (resid 12 and name HN) 3.0 1.2 0.3
assign (resid 12 and name HA) (resid 12 and name HB*) 3.0 1.2 1.3
assign (resid 12 and name HB*) (resid 12 and name HG) 2.5 0.7 1.2
assign (resid 13 and name HA) (resid 13 and name HN) 2.5 0.7 0.2
assign (resid 13 and name HB*) (resid 13 and name HN) 2.5 0.7 1.2
assign (resid 13 and name HG*) (resid 13 and name HN) 3.0 1.2 1.3
assign (resid 13 and name HD*) (resid 13 and name HN) 3.0 1.2 1.3
assign (resid 13 and name HA) (resid 13 and name HB*) 2.5 0.7 1.2
assign (resid 13 and name HA) (resid 13 and name HG*) 3.0 1.2 1.3
assign (resid 13 and name HA) (resid 13 and name HD*) 3.0 1.2 1.3
assign (resid 13 and name HB*) (resid 13 and name HD*) 3.0 1.2 1.3
assign (resid 14 and name HA) (resid 14 and name HN) 2.5 0.7 0.2
assign (resid 14 and name HB*) (resid 14 and name HN) 2.5 0.7 1.2
assign (resid 14 and name HG) (resid 14 and name HN) 3.0 1.2 0.3
assign (resid 14 and name HD*) (resid 14 and name HN) 3.0 1.2 1.3
assign (resid 14 and name HA) (resid 14 and name HB*) 2.5 0.7 1.2
assign (resid 14 and name HA) (resid 14 and name HG) 3.0 1.2 0.3
assign (resid 14 and name HA) (resid 14 and name HD*) 3.0 1.2 1.3
assign (resid 14 and name HB*) (resid 14 and name HD*) 3.0 1.2 1.3
assign (resid 15 and name HA) (resid 15 and name HN) 2.5 0.7 0.2
assign (resid 15 and name HB*) (resid 15 and name HN) 2.5 0.7 1.2
assign (resid 15 and name HG) (resid 15 and name HN) 3.0 1.2 0.3
assign (resid 15 and name HD*) (resid 15 and name HN) 3.0 1.2 1.3
assign (resid 15 and name HA) (resid 15 and name HB*) 2.5 0.7 1.2
assign (resid 15 and name HA) (resid 15 and name HG) 3.0 1.2 0.3
assign (resid 15 and name HA) (resid 15 and name HD*) 3.0 1.2 1.3
assign (resid 15 and name HB*) (resid 15 and name HD*) 3.0 1.2 1.3
assign (resid 16 and name HA) (resid 16 and name HN) 2.5 0.7 0.2
assign (resid 16 and name HB*) (resid 16 and name HN) 2.5 0.7 1.2
assign (resid 16 and name HG) (resid 16 and name HN) 3.0 1.2 0.3
assign (resid 16 and name HA) (resid 16 and name HB*) 3.0 1.2 1.3
assign (resid 16 and name HA) (resid 16 and name HG) 3.0 1.2 0.3
assign (resid 17 and name HA) (resid 17 and name HN) 2.5 0.7 0.2
assign (resid 17 and name HB*) (resid 17 and name HN) 2.5 0.7 1.2
assign (resid 17 and name HA) (resid 17 and name HB*) 2.5 0.7 1.2
assign (resid 18 and name HA) (resid 18 and name HN) 2.5 0.7 0.2
assign (resid 18 and name HB*) (resid 18 and name HN) 3.0 1.2 1.3
assign (resid 18 and name HA) (resid 18 and name HB*) 3.0 1.2 1.3
assign (resid 19 and name HA*) (resid 19 and name HN) 3.0 1.2 1.3
assign (resid 20 and name HA) (resid 20 and name HN) 2.5 0.7 0.2
assign (resid 20 and name HB*) (resid 20 and name HN) 3.0 1.2 1.3
assign (resid 20 and name HA) (resid 20 and name HB*) 3.0 1.2 1.3
assign (resid 21 and name HA) (resid 21 and name HN) 2.5 0.7 0.2
assign (resid 21 and name HB*) (resid 21 and name HN) 3.0 1.2 1.3
assign (resid 21 and name HA) (resid 21 and name HB*) 3.0 1.2 1.3
assign (resid 22 and name HA) (resid 22 and name HN) 2.5 0.7 0.2
assign (resid 22 and name HB*) (resid 22 and name HN) 2.5 0.7 1.2
assign (resid 22 and name HA) (resid 22 and name HB*) 2.5 0.7 1.2
assign (resid 23 and name HA) (resid 23 and name HN) 2.5 0.7 0.2
assign (resid 23 and name HB*) (resid 23 and name HN) 2.5 0.7 1.2
assign (resid 23 and name HA) (resid 23 and name HB*) 2.5 0.7 1.2
assign (resid 24 and name HA*) (resid 24 and name HN) 2.5 0.7 1.2
assign (resid 25 and name HA) (resid 25 and name HN) 2.5 0.7 0.2
assign (resid 25 and name HB) (resid 25 and name HN) 2.5 0.7 0.2
assign (resid 25 and name HG*) (resid 25 and name HN) 3.0 1.2 1.3
assign (resid 25 and name HD*) (resid 25 and name HN) 3.0 1.2 1.3
assign (resid 25 and name HA) (resid 25 and name HB) 2.5 0.7 0.2
assign (resid 25 and name HA) (resid 25 and name HG*) 3.0 1.2 1.3
assign (resid 25 and name HA) (resid 25 and name HD*) 3.0 1.2 1.3
assign (resid 25 and name HB) (resid 25 and name HD*) 3.0 1.2 0.3
assign (resid 26 and name HA) (resid 26 and name HN) 2.5 0.7 0.2
assign (resid 26 and name HB*) (resid 26 and name HN) 2.5 0.7 1.2
assign (resid 26 and name HG) (resid 26 and name HN) 3.0 1.2 0.3
assign (resid 26 and name HD*) (resid 26 and name HN) 3.0 1.2 1.3
assign (resid 26 and name HA) (resid 26 and name HB*) 2.5 0.7 1.2
assign (resid 26 and name HA) (resid 26 and name HG) 3.0 1.2 0.3
assign (resid 26 and name HA) (resid 26 and name HD*) 3.0 1.2 1.3
assign (resid 26 and name HB*) (resid 26 and name HD*) 3.0 1.2 1.3
assign (resid 27 and name HA) (resid 27 and name HG*) 2.5 0.7 1.2
assign (resid 28 and name HA) (resid 28 and name HG*) 3.0 1.2 1.3
assign (resid 3 and name HA*) (resid 3 and name HN) 2.5 0.7 1.2
assign (resid 6 and name HA*) (resid 6 and name HN) 2.5 0.7 1.2
assign (resid 7 and name HA) (resid 7 and name HN) 2.5 0.7 1.2
assign (resid 7 and name HB*) (resid 7 and name HN) 3.0 1.2 1.3
assign (resid 7 and name HG*) (resid 7 and name HN) 3.0 1.2 1.3
assign (resid 8 and name HA) (resid 8 and name HN) 2.5 0.7 0.2
assign (resid 8 and name HB*) (resid 8 and name HN) 2.5 0.7 1.2
assign (resid 8 and name HG*) (resid 8 and name HN) 3.0 1.2 1.3
assign (resid 9 and name HA*) (resid 9 and name HN) 2.5 0.7 1.2
assign (resid 10 and name HA) (resid 10 and name HN) 2.5 0.7 0.2
assign (resid 10 and name HB*) (resid 10 and name HN) 2.5 0.7 1.2
assign (resid 10 and name HG*) (resid 10 and name HN) 4.0 2.2 2.0
assign (resid 11 and name HA) (resid 11 and name HN) 2.5 0.7 0.2
assign (resid 11 and name HB*) (resid 11 and name HN) 2.5 0.7 1.2
assign (resid 11 and name HG) (resid 11 and name HN) 3.0 1.2 0.3
assign (resid 12 and name HA) (resid 12 and name HN) 2.5 0.7 0.2
assign (resid 12 and name HB*) (resid 12 and name HN) 2.5 0.7 1.2
assign (resid 12 and name HG*) (resid 12 and name HN) 3.0 1.2 1.3
assign (resid 13 and name HA) (resid 13 and name HN) 2.5 0.7 0.2
assign (resid 13 and name HB*) (resid 13 and name HN) 2.5 0.7 0.2
assign (resid 13 and name HG*) (resid 13 and name HN) 3.0 1.2 1.3
assign (resid 14 and name HA) (resid 14 and name HN) 3.0 1.2 0.3
assign (resid 14 and name HB*) (resid 14 and name HN) 2.5 0.7 1.2
assign (resid 14 and name HG) (resid 14 and name HN) 2.5 0.7 0.2
assign (resid 15 and name HA) (resid 15 and name HN) 3.0 1.2 0.3
assign (resid 15 and name HB*) (resid 15 and name HN) 2.5 0.7 1.2
assign (resid 15 and name HG) (resid 15 and name HN) 3.0 1.2 0.3 
assign (resid 16 and name HA) (resid 16 and name HN) 2.5 0.7 0.2
assign (resid 16 and name HB*) (resid 16 and name HN) 2.5 0.7 1.2
assign (resid 16 and name HG*) (resid 16 and name HN) 4.0 2.2 2.0
assign (resid 17 and name HA) (resid 17 and name HN) 2.5 0.7 0.2
assign (resid 17 and name HB*) (resid 17 and name HN) 2.5 0.7 1.2
assign (resid 18 and name HA) (resid 18 and name HN) 2.5 0.7 0.2
assign (resid 18 and name HB*) (resid 18 and name HN) 2.5 0.7 1.2
assign (resid 20 and name HA) (resid 20 and name HN) 3.0 1.2 0.3
assign (resid 20 and name HB*) (resid 20 and name HN) 2.5 0.7 1.2
assign (resid 21 and name HA) (resid 21 and name HN) 3.0 1.2 0.3
assign (resid 21 and name HB*) (resid 21 and name HN) 2.5 0.7 1.2
assign (resid 22 and name HA) (resid 22 and name HN) 2.5 0.7 0.2
assign (resid 22 and name HB*) (resid 22 and name HN) 2.5 0.7 1.2
assign (resid 23 and name HA) (resid 23 and name HN) 3.0 1.2 0.3
assign (resid 23 and name HB*) (resid 23 and name HN) 2.5 0.7 1.2
assign (resid 24 and name HA*) (resid 24 and name HN) 2.5 0.7 1.2
assign (resid 25 and name HA) (resid 25 and name HN) 4.0 2.2 1.0
assign (resid 25 and name HG*) (resid 25 and name HN) 4.0 2.2 2.0
assign (resid 26 and name HA) (resid 26 and name HN) 4.0 2.2 1.0
assign (resid 26 and name HB*) (resid 26 and name HN) 3.0 1.2 1.3
assign (resid 26 and name HG) (resid 26 and name HN) 3.0 1.2 0.3
assign (resid 27 and name HA) (resid 27 and name HN) 3.0 1.2 0.3
assign (resid 28 and name HA) (resid 28 and name HN) 3.0 1.2 0.3
assign (resid 28 and name HB*) (resid 28 and name HN) 4.0 2.2 2.0
assign (resid 20 and name HB*) (resid 20 and name HD*) 3.0 1.2 1.3
assign (resid 21 and name HB*) (resid 21 and name HD*) 4.0 2.2 2.0
assign (resid 10 and name HD*) (resid 10 and name HH*) 4.0 2.2 2.0
assign (resid 13 and name HD*) (resid 13 and name HH*) 4.0 2.2 2.0
assign (resid 1 and name HA) (resid 2 and name HN) 4.0 2.2 1.0
assign (resid 2 and name HA) (resid 3 and name HN) 2.5 0.7 0.2
assign (resid 5 and name HA) (resid 6 and name HN) 2.5 0.7 0.2
assign (resid 6 and name HA*) (resid 7 and name HN) 2.5 0.7 1.2
assign (resid 7 and name HA) (resid 8 and name HN) 3.0 1.2 0.3
assign (resid 8 and name HA) (resid 9 and name HN) 3.0 1.2 0.3 
assign (resid 9 and name HA*) (resid 10 and name HN) 2.5 0.7 1.2
assign (resid 10 and name HA) (resid 11 and name HN) 3.0 1.2 0.3
assign (resid 11 and name HA) (resid 12 and name HN) 3.0 1.2 0.3
assign (resid 12 and name HA) (resid 13 and name HN) 3.0 1.2 0.3
assign (resid 13 and name HA) (resid 14 and name HN) 3.0 1.2 0.3
assign (resid 14 and name HA) (resid 15 and name HN) 3.0 1.2 0.3
assign (resid 15 and name HA) (resid 16 and name HN) 3.0 1.2 0.3
assign (resid 16 and name HA) (resid 17 and name HN) 3.0 1.2 0.3
assign (resid 17 and name HA) (resid 18 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HA) (resid 19 and name HN) 2.5 0.7 0.2
assign (resid 19 and name HA*) (resid 20 and name HN) 2.5 0.7 1.2
assign (resid 20 and name HA) (resid 21 and name HN) 3.0 1.2 0.3
assign (resid 21 and name HA) (resid 22 and name HN) 2.5 0.7 0.2
assign (resid 22 and name HA) (resid 23 and name HN) 3.0 1.2 0.3
assign (resid 23 and name HA) (resid 24 and name HN) 4.0 2.2 1.0
assign (resid 24 and name HA*) (resid 25 and name HN) 4.0 2.2 2.0
assign (resid 25 and name HA) (resid 26 and name HN) 3.0 1.2 0.3
assign (resid 26 and name HA) (resid 27 and name HN) 3.0 1.2 0.3
assign (resid 27 and name HA) (resid 28 and name HN) 3.0 1.2 0.3
assign (resid 9 and name HA*) (resid 11 and name HN) 4.0 2.2 2.0
assign (resid 23 and name HA) (resid 25 and name HN) 3.0 1.2 0.3
assign (resid 7 and name HA) (resid 10 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HA) (resid 11 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HA*) (resid 12 and name HN) 4.0 2.2 2.0
assign (resid 10 and name HA) (resid 13 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HA) (resid 14 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HA) (resid 15 and name HN) 4.0 2.2 1.0
assign (resid 13 and name HA) (resid 16 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HA) (resid 17 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HA) (resid 18 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HA) (resid 20 and name HN) 4.0 2.2 1.0
assign (resid 22 and name HA) (resid 25 and name HN) 3.0 1.2 0.3
assign (resid 24 and name HA*) (resid 27 and name HN) 4.0 2.2 2.0
assign (resid 5 and name HB*) (resid 6 and name HN) 3.0 1.2 1.3
assign (resid 7 and name HB*) (resid 8 and name HN) 3.0 1.2 1.3
assign (resid 8 and name HB*) (resid 9 and name HN) 2.5 0.7 1.2
assign (resid 10 and name HB*) (resid 11 and name HN) 2.5 0.7 1.2
assign (resid 11 and name HB*) (resid 12 and name HN) 3.0 1.2 1.3
assign (resid 12 and name HB*) (resid 13 and name HN) 2.5 0.7 1.2
assign (resid 13 and name HB*) (resid 14 and name HN) 3.0 1.2 1.3
assign (resid 14 and name HB*) (resid 15 and name HN) 4.0 2.2 2.0
assign (resid 15 and name HB*) (resid 16 and name HN) 2.5 0.7 1.2
assign (resid 16 and name HB*) (resid 17 and name HN) 3.0 1.2 1.3
assign (resid 17 and name HB*) (resid 18 and name HN) 2.5 0.7 1.2
assign (resid 18 and name HB*) (resid 19 and name HN) 4.0 2.2 2.0
assign (resid 20 and name HB*) (resid 21 and name HN) 4.0 2.2 2.0
assign (resid 21 and name HB*) (resid 22 and name HN) 3.0 1.2 1.3
assign (resid 22 and name HB*) (resid 23 and name HN) 4.0 2.2 2.0
assign (resid 25 and name HB*) (resid 26 and name HN) 4.0 2.2 2.0
assign (resid 26 and name HB*) (resid 27 and name HN) 4.0 2.2 2.0
assign (resid 5 and name HG*) (resid 6 and name HN) 3.0 1.2 1.3
assign (resid 7 and name HG*) (resid 8 and name HN) 3.0 1.2 1.3
assign (resid 8 and name HG*) (resid 9 and name HN) 4.0 2.2 2.0
assign (resid 11 and name HG*) (resid 12 and name HN) 3.0 1.2 1.3
assign (resid 14 and name HG*) (resid 15 and name HN) 3.0 1.2 1.3
assign (resid 6 and name HN) (resid 7 and name HN) 2.5 0.7 0.2
assign (resid 7 and name HN) (resid 8 and name HN) 3.0 1.2 0.3
assign (resid 8 and name HN) (resid 9 and name HN) 2.5 0.7 0.2
assign (resid 9 and name HN) (resid 10 and name HN) 2.5 0.7 0.2
assign (resid 10 and name HN) (resid 11 and name HN) 2.5 0.7 0.2
assign (resid 11 and name HN) (resid 12 and name HN) 3.0 1.2 0.3
assign (resid 12 and name HN) (resid 13 and name HN) 2.5 0.7 0.2
assign (resid 13 and name HN) (resid 14 and name HN) 2.5 0.7 0.2
assign (resid 14 and name HN) (resid 15 and name HN) 3.0 1.2 0.3
assign (resid 15 and name HN) (resid 16 and name HN) 2.5 0.7 0.2
assign (resid 16 and name HN) (resid 17 and name HN) 3.0 1.2 0.3
assign (resid 17 and name HN) (resid 18 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HN) (resid 19 and name HN) 2.5 0.7 0.2
assign (resid 19 and name HN) (resid 20 and name HN) 3.0 1.2 0.3
assign (resid 20 and name HN) (resid 21 and name HN) 2.5 0.7 0.2
assign (resid 21 and name HN) (resid 22 and name HN) 2.5 0.7 0.2
assign (resid 22 and name HN) (resid 23 and name HN) 2.5 0.7 0.2
assign (resid 23 and name HN) (resid 24 and name HN) 3.0 1.2 0.3
assign (resid 25 and name HN) (resid 26 and name HN) 2.5 0.7 0.2
assign (resid 26 and name HN) (resid 27 and name HN) 3.0 1.2 0.3
assign (resid 27 and name HN) (resid 28 and name HN) 4.0 2.2 1.0
assign (resid 6 and name HN) (resid 8 and name HN) 4.0 2.2 1.0
assign (resid 7 and name HN) (resid 9 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HN) (resid 10 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HN) (resid 11 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HN) (resid 12 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HN) (resid 13 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HN) (resid 14 and name HN) 4.0 2.2 1.0
assign (resid 13 and name HN) (resid 15 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HN) (resid 16 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HN) (resid 17 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HN) (resid 18 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HN) (resid 19 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HN) (resid 22 and name HN) 4.0 2.2 1.0
assign (resid 23 and name HN) (resid 25 and name HN) 3.0 1.2 0.3
assign (resid 25 and name HN) (resid 27 and name HN) 4.0 2.2 1.0
assign (resid 26 and name HN) (resid 28 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HN) (resid 11 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HN) (resid 12 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HN) (resid 13 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HN) (resid 14 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HN) (resid 15 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HN) (resid 17 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HN) (resid 18 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HN) (resid 19 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HN) (resid 20 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HN) (resid 22 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HN) (resid 23 and name HN) 4.0 2.2 1.0
assign (resid 22 and name HN) (resid 25 and name HN) 4.0 2.2 1.0
assign (resid 24 and name HN) (resid 27 and name HN) 4.0 2.2 1.0
assign (resid 25 and name HN) (resid 28 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HN) (resid 12 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HN) (resid 15 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HN) (resid 16 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HN) (resid 21 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HN) (resid 24 and name HN) 4.0 2.2 1.0
assign (resid 7 and name HA) (resid 10 and name HB*) 4.0 2.2 2.0
assign (resid 8 and name HA) (resid 11 and name HB*) 4.0 2.2 2.0
assign (resid 9 and name HA*) (resid 12 and name HB*) 4.0 2.2 2.0
assign (resid 10 and name HA) (resid 13 and name HB*) 4.0 2.2 2.0
assign (resid 11 and name HA) (resid 14 and name HB*) 4.0 2.2 2.0
assign (resid 12 and name HA) (resid 15 and name HB*) 4.0 2.2 2.0
assign (resid 13 and name HA) (resid 16 and name HB*) 4.0 2.2 2.0
assign (resid 14 and name HA) (resid 17 and name HB*) 4.0 2.2 2.0
assign (resid 15 and name HA) (resid 18 and name HB*) 4.0 2.2 2.0
assign (resid 24 and name HA*) (resid 27 and name HB*) 4.0 2.2 2.0
assign (resid 25 and name HA) (resid 28 and name HB*) 4.0 2.2 2.0
assign (resid 3 and name HA*) (resid 4 and name HD*) 4.0 2.2 2.0
assign (resid 4 and name HA) (resid 5 and name HD*) 4.0 2.2 2.0
assign (resid 17 and name HA) (resid 25 and name HG*) 4.0 2.2 2.0
assign (resid 17 and name HA) (resid 21 and name HB*) 4.0 2.2 2.0
assign (resid 17 and name HB*) (resid 25 and name HG*) 4.0 2.2 2.0
assign (resid 17 and name HB*) (resid 25 and name HD*) 4.0 2.2 2.0
assign (resid 18 and name HA) (resid 22 and name HB*) 4.0 2.2 2.0
assign (resid 6 and name O) (resid 10 and name N) 3.3 0.8 0.2
assign (resid 7 and name O) (resid 11 and name N) 3.3 0.8 0.2
assign (resid 8 and name O) (resid 12 and name N) 3.3 0.8 0.2
assign (resid 9 and name O) (resid 13 and name N) 3.3 0.8 0.2
assign (resid 10 and name O) (resid 14 and name N) 3.3 0.8 0.2
assign (resid 11 and name O) (resid 15 and name N) 3.3 0.8 0.2
assign (resid 12 and name O) (resid 16 and name N) 3.3 0.8 0.2
assign (resid 13 and name O) (resid 17 and name N) 3.3 0.8 0.2
assign (resid 14 and name O) (resid 18 and name N) 3.3 0.8 0.2
assign (resid 15 and name O) (resid 19 and name N) 3.3 0.8 0.2
assign (resid 16 and name O) (resid 20 and name N) 3.3 0.8 0.2
assign (resid 6 and name O) (resid 10 and name HN) 2.3 0.8 0.2
assign (resid 7 and name O) (resid 11 and name HN) 2.3 0.8 0.2
assign (resid 8 and name O) (resid 12 and name HN) 2.3 0.8 0.2
assign (resid 9 and name O) (resid 13 and name HN) 2.3 0.8 0.2
assign (resid 10 and name O) (resid 14 and name HN) 2.3 0.8 0.2
assign (resid 11 and name O) (resid 15 and name HN) 2.3 0.8 0.2
assign (resid 12 and name O) (resid 16 and name HN) 2.3 0.8 0.2
assign (resid 13 and name O) (resid 17 and name HN) 2.3 0.8 0.2
assign (resid 14 and name O) (resid 18 and name HN) 2.3 0.8 0.2
assign (resid 15 and name O) (resid 19 and name HN) 2.3 0.8 0.2
assign (resid 16 and name O) (resid 20 and name HN) 2.3 0.8 0.2 
assign (resid 21 and name O) (resid 25 and name HN) 3.3 0.8 0.2
assign (resid 22 and name O) (resid 26 and name HN) 3.3 0.8 0.2
assign (resid 23 and name O) (resid 27 and name HN) 3.3 0.8 0.2
assign (resid 24 and name O) (resid 28 and name HN) 3.3 0.8 0.2
assign (resid 21 and name O) (resid 25 and name HN) 2.3 0.8 0.2
assign (resid 22 and name O) (resid 26 and name HN) 2.3 0.8 0.2
assign (resid 23 and name O) (resid 27 and name HN) 2.3 0.8 0.2
assign (resid 24 and name O) (resid 28 and name HN) 2.3 0.8 0.2
set echo=true end
set wrnlev=0 end


  Entry H atom name         Submitted Coord H atom name
    1   1H    PHE   1           HT1      PHE   1  14.375   1.340   9.544
    2   2H    PHE   1           HT2      PHE   1  13.043   0.754   8.667
    3   3H    PHE   1           HT3      PHE   1  14.618   0.547   8.065
    4    HA   PHE   1           HA       PHE   1  14.942  -0.703  10.357
    5   1HB   PHE   1           HB2      PHE   1  12.026  -1.118   9.644
    6   2HB   PHE   1           HB1      PHE   1  12.871  -1.689  11.083
    7    HD1  PHE   1           HD1      PHE   1  10.396   0.387  10.443
    8    HD2  PHE   1           HD2      PHE   1  14.439   0.681  11.862
    9    HE1  PHE   1           HE1      PHE   1   9.831   2.499  11.614
   10    HE2  PHE   1           HE2      PHE   1  13.874   2.793  13.034
   11    HZ   PHE   1           HZ       PHE   1  11.570   3.702  12.910
   12    H    SER   2           HN       SER   2  13.101  -1.042   7.328
   13    HA   SER   2           HA       SER   2  14.163  -3.799   6.963
   14   1HB   SER   2           HB2      SER   2  12.281  -4.090   5.684
   15   2HB   SER   2           HB1      SER   2  11.723  -2.661   6.550
   16    HG   SER   2           HG       SER   2  12.311  -1.404   4.838
   17    H    GLY   3           HN       GLY   3  14.525  -4.077   4.338
   18   1HA   GLY   3           HA2      GLY   3  16.826  -2.313   3.769
   19   2HA   GLY   3           HA1      GLY   3  16.416  -3.791   2.896
   20    HA   PRO   4           HA       PRO   4  14.636  -1.322  -0.240
   21   1HB   PRO   4           HB2      PRO   4  12.805  -3.078  -1.266
   22   2HB   PRO   4           HB1      PRO   4  14.553  -3.243  -1.525
   23   1HG   PRO   4           HG2      PRO   4  12.778  -4.681   0.379
   24   2HG   PRO   4           HG1      PRO   4  14.153  -5.284  -0.559
   25   1HD   PRO   4           HD2      PRO   4  14.284  -4.661   2.099
   26   2HD   PRO   4           HD1      PRO   4  15.680  -4.603   1.000
   27    HA   PRO   5           HA       PRO   5  10.961   0.006   1.980
   28   1HB   PRO   5           HB2      PRO   5  11.247   2.656   1.417
   29   2HB   PRO   5           HB1      PRO   5  12.187   1.848   2.687
   30   1HG   PRO   5           HG2      PRO   5  13.027   2.751   0.018
   31   2HG   PRO   5           HG1      PRO   5  13.986   2.500   1.479
   32   1HD   PRO   5           HD2      PRO   5  13.775   0.779  -0.765
   33   2HD   PRO   5           HD1      PRO   5  14.626   0.464   0.763
   34    H    GLY   6           HN       GLY   6  11.208  -0.791  -0.928
   35   1HA   GLY   6           HA2      GLY   6   8.913   0.819  -1.964
   36   2HA   GLY   6           HA1      GLY   6  10.182   0.199  -3.021
   37    H    LEU   7           HN       LEU   7  10.395  -2.382  -1.697
   38    HA   LEU   7           HA       LEU   7   8.413  -3.855  -3.145
   39   1HB   LEU   7           HB2      LEU   7  10.653  -4.305  -1.299
   40   2HB   LEU   7           HB1      LEU   7   9.401  -5.543  -1.204
   41    HG   LEU   7           HG       LEU   7   9.571  -5.338  -3.877
   42   1HD1  LEU   7          HD11      LEU   7  11.508  -3.597  -3.291
   43   2HD1  LEU   7          HD12      LEU   7  11.632  -4.673  -4.683
   44   3HD1  LEU   7          HD13      LEU   7  12.465  -5.074  -3.182
   45   1HD2  LEU   7          HD21      LEU   7  10.761  -7.042  -1.814
   46   2HD2  LEU   7          HD22      LEU   7  11.680  -7.062  -3.319
   47   3HD2  LEU   7          HD23      LEU   7   9.971  -7.498  -3.323
   48    H    GLN   8           HN       GLN   8   8.781  -4.527   0.250
   49    HA   GLN   8           HA       GLN   8   6.142  -5.184   0.805
   50   1HB   GLN   8           HB2      GLN   8   8.564  -4.426   2.256
   51   2HB   GLN   8           HB1      GLN   8   7.096  -4.007   3.138
   52   1HG   GLN   8           HG2      GLN   8   6.281  -6.298   2.957
   53   2HG   GLN   8           HG1      GLN   8   7.665  -6.741   1.957
   54   1HE2  GLN   8          HE21      GLN   8   8.767  -8.173   3.370
   55   2HE2  GLN   8          HE22      GLN   8   9.327  -7.728   4.909
   56    H    GLY   9           HN       GLY   9   7.585  -2.064   0.451
   57   1HA   GLY   9           HA2      GLY   9   5.437  -0.547   1.686
   58   2HA   GLY   9           HA1      GLY   9   6.699   0.116   0.639
   59    H    ARG  10           HN       ARG  10   6.475  -0.713  -1.734
   60    HA   ARG  10           HA       ARG  10   4.083   0.254  -2.857
   61   1HB   ARG  10           HB2      ARG  10   6.353  -0.192  -3.935
   62   2HB   ARG  10           HB1      ARG  10   5.878  -1.889  -4.016
   63   1HG   ARG  10           HG2      ARG  10   3.964  -1.347  -5.406
   64   2HG   ARG  10           HG1      ARG  10   4.269   0.381  -5.219
   65   1HD   ARG  10           HD2      ARG  10   6.402   0.173  -6.410
   66   2HD   ARG  10           HD1      ARG  10   6.177  -1.583  -6.541
   67    HE   ARG  10           HE       ARG  10   3.897  -0.079  -7.560
   68   1HH1  ARG  10          HH11      ARG  10   7.165  -0.791  -8.307
   69   2HH1  ARG  10          HH12      ARG  10   6.857  -1.139  -9.976
   70   1HH2  ARG  10          HH21      ARG  10   3.421  -0.767  -9.694
   71   2HH2  ARG  10          HH22      ARG  10   4.738  -1.125 -10.761
   72    H    LEU  11           HN       LEU  11   4.990  -2.876  -1.697
   73    HA   LEU  11           HA       LEU  11   2.796  -4.390  -2.708
   74   1HB   LEU  11           HB2      LEU  11   4.797  -4.715  -0.474
   75   2HB   LEU  11           HB1      LEU  11   3.603  -5.957  -0.850
   76    HG   LEU  11           HG       LEU  11   5.502  -4.819  -2.914
   77   1HD1  LEU  11          HD11      LEU  11   7.141  -6.036  -1.964
   78   2HD1  LEU  11          HD12      LEU  11   6.190  -7.486  -2.285
   79   3HD1  LEU  11          HD13      LEU  11   6.029  -6.649  -0.740
   80   1HD2  LEU  11          HD21      LEU  11   4.534  -7.531  -3.283
   81   2HD2  LEU  11          HD22      LEU  11   4.380  -6.141  -4.359
   82   3HD2  LEU  11          HD23      LEU  11   3.187  -6.409  -3.088
   83    H    GLN  12           HN       GLN  12   3.473  -3.743   0.686
   84    HA   GLN  12           HA       GLN  12   0.902  -4.073   1.680
   85   1HB   GLN  12           HB2      GLN  12   3.123  -2.183   2.496
   86   2HB   GLN  12           HB1      GLN  12   1.723  -2.536   3.509
   87   1HG   GLN  12           HG2      GLN  12   2.829  -5.016   2.588
   88   2HG   GLN  12           HG1      GLN  12   4.128  -4.041   3.276
   89   1HE2  GLN  12          HE21      GLN  12   4.375  -4.851   5.383
   90   2HE2  GLN  12          HE22      GLN  12   3.106  -5.032   6.495
   91    H    ARG  13           HN       ARG  13   2.336  -1.323   0.083
   92    HA   ARG  13           HA       ARG  13   0.217   0.538   0.594
   93   1HB   ARG  13           HB2      ARG  13   2.493   1.221   0.031
   94   2HB   ARG  13           HB1      ARG  13   2.370   0.392  -1.521
   95   1HG   ARG  13           HG2      ARG  13   0.548   1.898  -2.199
   96   2HG   ARG  13           HG1      ARG  13   0.635   2.718  -0.639
   97   1HD   ARG  13           HD2      ARG  13   3.215   2.963  -1.343
   98   2HD   ARG  13           HD1      ARG  13   2.499   2.885  -2.965
   99    HE   ARG  13           HE       ARG  13   1.689   5.057  -2.551
  100   1HH1  ARG  13          HH21      ARG  13   3.067   4.156   0.322
  101   2HH1  ARG  13          HH22      ARG  13   1.968   5.018   1.348
  102   1HH2  ARG  13          HH11      ARG  13  -0.238   5.785  -1.215
  103   2HH2  ARG  13          HH12      ARG  13   0.097   5.940   0.477
  104    H    LEU  14           HN       LEU  14   1.203  -0.927  -2.455
  105    HA   LEU  14           HA       LEU  14  -1.235  -0.392  -3.833
  106   1HB   LEU  14           HB2      LEU  14  -0.288  -1.732  -5.549
  107   2HB   LEU  14           HB1      LEU  14   1.109  -1.086  -4.691
  108    HG   LEU  14           HG       LEU  14   0.934  -3.263  -3.260
  109   1HD1  LEU  14          HD11      LEU  14  -0.867  -4.519  -3.839
  110   2HD1  LEU  14          HD12      LEU  14   0.100  -5.000  -5.232
  111   3HD1  LEU  14          HD13      LEU  14  -1.062  -3.682  -5.379
  112   1HD2  LEU  14          HD21      LEU  14   2.848  -3.487  -4.439
  113   2HD2  LEU  14          HD22      LEU  14   2.157  -2.663  -5.837
  114   3HD2  LEU  14          HD23      LEU  14   1.906  -4.395  -5.622
  115    H    LEU  15           HN       LEU  15  -0.202  -3.023  -1.800
  116    HA   LEU  15           HA       LEU  15  -2.452  -4.774  -2.342
  117   1HB   LEU  15           HB2      LEU  15  -0.473  -4.574  -0.058
  118   2HB   LEU  15           HB1      LEU  15  -1.577  -5.927  -0.300
  119    HG   LEU  15           HG       LEU  15   0.368  -5.027  -2.434
  120   1HD1  LEU  15          HD11      LEU  15   0.828  -7.417  -0.669
  121   2HD1  LEU  15          HD12      LEU  15   1.360  -5.823  -0.135
  122   3HD1  LEU  15          HD13      LEU  15   1.991  -6.507  -1.633
  123   1HD2  LEU  15          HD21      LEU  15  -1.811  -6.772  -2.446
  124   2HD2  LEU  15          HD22      LEU  15  -0.414  -7.836  -2.283
  125   3HD2  LEU  15          HD23      LEU  15  -0.519  -6.720  -3.644
  126    H    GLN  16           HN       GLN  16  -1.600  -2.915   0.557
  127    HA   GLN  16           HA       GLN  16  -4.132  -3.140   1.804
  128   1HB   GLN  16           HB2      GLN  16  -1.995  -2.381   2.859
  129   2HB   GLN  16           HB1      GLN  16  -2.157  -0.858   1.984
  130   1HG   GLN  16           HG2      GLN  16  -4.315  -0.438   3.100
  131   2HG   GLN  16           HG1      GLN  16  -4.162  -1.963   3.973
  132   1HE2  GLN  16          HE21      GLN  16  -3.804  -1.236   6.111
  133   2HE2  GLN  16          HE22      GLN  16  -2.533  -0.204   6.558
  134    H    ALA  17           HN       ALA  17  -2.827  -0.624  -0.274
  135    HA   ALA  17           HA       ALA  17  -5.133   1.053  -0.310
  136   1HB   ALA  17           HB1      ALA  17  -3.958   2.161  -2.101
  137   2HB   ALA  17           HB2      ALA  17  -3.037   0.703  -2.466
  138   3HB   ALA  17           HB3      ALA  17  -2.737   1.584  -0.968
  139    H    SER  18           HN       SER  18  -3.977  -1.439  -2.608
  140    HA   SER  18           HA       SER  18  -6.564  -1.322  -3.988
  141   1HB   SER  18           HB2      SER  18  -4.087  -1.393  -4.973
  142   2HB   SER  18           HB1      SER  18  -4.323  -3.129  -4.789
  143    HG   SER  18           HG       SER  18  -5.318  -2.927  -6.635
  144    H    GLY  19           HN       GLY  19  -6.231  -2.416  -1.320
  145   1HA   GLY  19           HA2      GLY  19  -7.761  -4.844  -1.637
  146   2HA   GLY  19           HA1      GLY  19  -6.106  -5.214  -1.155
  147    H    ASN  20           HN       ASN  20  -7.610  -2.233  -0.076
  148    HA   ASN  20           HA       ASN  20  -8.585  -3.309   2.445
  149   1HB   ASN  20           HB2      ASN  20  -5.924  -3.259   2.331
  150   2HB   ASN  20           HB1      ASN  20  -6.183  -1.568   2.762
  151   1HD2  ASN  20          HD21      ASN  20  -5.020  -3.698   4.494
  152   2HD2  ASN  20          HD22      ASN  20  -6.033  -3.799   5.853
  153    H    HIS  21           HN       HIS  21  -6.913  -0.329   1.562
  154    HA   HIS  21           HA       HIS  21  -9.400   1.176   2.248
  155   1HB   HIS  21           HB2      HIS  21  -6.500   1.534   2.698
  156   2HB   HIS  21           HB1      HIS  21  -7.349   3.003   2.216
  157    HD1  HIS  21           HD1      HIS  21  -7.929   4.265   4.283
  158    HD2  HIS  21           HD2      HIS  21  -8.489   0.165   4.789
  159    HE1  HIS  21           HE1      HIS  21  -8.897   3.955   6.603
  160    H    ALA  22           HN       ALA  22  -8.881  -0.077  -0.306
  161    HA   ALA  22           HA       ALA  22  -7.919   1.669  -2.297
  162   1HB   ALA  22           HB1      ALA  22  -8.512  -0.134  -3.531
  163   2HB   ALA  22           HB2      ALA  22 -10.215   0.151  -3.172
  164   3HB   ALA  22           HB3      ALA  22  -9.233  -0.821  -2.076
  165    H    ALA  23           HN       ALA  23 -10.958   1.527  -0.621
  166    HA   ALA  23           HA       ALA  23 -12.314   3.450  -2.330
  167   1HB   ALA  23           HB1      ALA  23 -14.098   2.782  -1.069
  168   2HB   ALA  23           HB2      ALA  23 -13.268   3.203   0.429
  169   3HB   ALA  23           HB3      ALA  23 -12.990   1.632  -0.321
  170    H    GLY  24           HN       GLY  24 -10.900   3.580   0.933
  171   1HA   GLY  24           HA2      GLY  24 -11.132   6.424   1.195
  172   2HA   GLY  24           HA1      GLY  24  -9.973   5.413   2.073
  173    H    ILE  25           HN       ILE  25  -9.190   4.361  -0.785
  174    HA   ILE  25           HA       ILE  25  -7.070   6.389  -1.192
  175    HB   ILE  25           HB       ILE  25  -7.665   3.589  -2.150
  176   1HG1  ILE  25          HG12      ILE  25  -6.597   4.085   0.110
  177   2HG1  ILE  25          HG11      ILE  25  -5.661   3.030  -0.950
  178   1HG2  ILE  25          HG21      ILE  25  -5.925   5.654  -3.379
  179   2HG2  ILE  25          HG22      ILE  25  -6.659   4.223  -4.104
  180   3HG2  ILE  25          HG23      ILE  25  -5.185   4.070  -3.148
  181   1HD1  ILE  25          HD11      ILE  25  -4.372   5.033  -1.722
  182   2HD1  ILE  25          HD12      ILE  25  -4.171   4.703  -0.001
  183   3HD1  ILE  25          HD13      ILE  25  -5.239   6.003  -0.530
  184    H    LEU  26           HN       LEU  26  -9.844   4.991  -2.779
  185    HA   LEU  26           HA       LEU  26  -9.483   6.631  -5.211
  186   1HB   LEU  26           HB2      LEU  26 -11.118   4.342  -4.265
  187   2HB   LEU  26           HB1      LEU  26 -11.909   5.405  -5.429
  188    HG   LEU  26           HG       LEU  26  -9.114   4.368  -5.895
  189   1HD1  LEU  26          HD11      LEU  26 -11.768   3.058  -6.525
  190   2HD1  LEU  26          HD12      LEU  26 -10.398   2.363  -5.658
  191   3HD1  LEU  26          HD13      LEU  26 -10.284   2.663  -7.392
  192   1HD2  LEU  26          HD21      LEU  26 -10.296   4.644  -8.313
  193   2HD2  LEU  26          HD22      LEU  26  -9.453   5.967  -7.507
  194   3HD2  LEU  26          HD23      LEU  26 -11.209   5.847  -7.402
  195    H    THR  27           HN       THR  27 -10.661   7.147  -2.132
  196    HA   THR  27           HA       THR  27 -12.142   9.542  -2.964
  197    HB   THR  27           HB       THR  27 -13.499   7.307  -1.422
  198    HG1  THR  27           HG1      THR  27 -14.302   6.653  -3.273
  199   1HG2  THR  27          HG21      THR  27 -15.390   9.018  -2.541
  200   2HG2  THR  27          HG22      THR  27 -14.120  10.103  -1.973
  201   3HG2  THR  27          HG23      THR  27 -14.893   8.985  -0.849
  202    H    MET  28           HN       MET  28  -9.767   8.745  -1.270
  203    HA   MET  28           HA       MET  28 -10.042   8.773   1.468
  204   1HB   MET  28           HB2      MET  28  -8.031   9.145  -0.274
  205   2HB   MET  28           HB1      MET  28  -8.216  10.812   0.274
  206   1HG   MET  28           HG2      MET  28  -8.257   9.686   2.667
  207   2HG   MET  28           HG1      MET  28  -7.410   8.383   1.834
  208   1HE   MET  28           HE1      MET  28  -5.566   8.283   0.883
  209   2HE   MET  28           HE2      MET  28  -4.470   8.665   2.208
  210   3HE   MET  28           HE3      MET  28  -4.271   9.466   0.651