*HEADER    LIPID TRANSPORT                         20-NOV-02   1N89              
*TITLE     SOLUTION STRUCTURE OF A LIGANDED TYPE 2 WHEAT NON-SPECIFIC            
*TITLE    2 LIPID TRANSFER PROTEIN                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LIPID TRANSFER PROTEIN;                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: TRITICUM TURGIDUM SUBSP. DURUM;                 
*SOURCE   3 ORGANISM_COMMON: DURUM WHEAT;                                        
*SOURCE   4 EXPRESSION_SYSTEM: PICHIA PASTORIS;                                  
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: FUNGI;                                     
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: GS115                                      
*KEYWDS    LIPID TRANSFER PROTEIN                                                
*EXPDTA    NMR, 9 STRUCTURES                                                     
*AUTHOR    J.L.PONS, F.LAMOTTE, M.F.GAUTIER, M.A.DELSUC                          
*REVDAT   1   18-MAR-03 1N89    0                                                
i! INTRAMOLECULAR NOE CONSTRAINTS
assign (resid 1   and  name  HA)(resid 2   and  name  HN) 2.6 0.8 0.8 !  1 ALA:HA - 2 CYS:HN
assign (resid 1   and  name HB#)(resid 1   and  name  HA) 2.8 1.0 1.0 !  1 ALA:HB# - 1 ALA:HA
assign (resid 1   and  name HB#)(resid 2   and  name  HN) 3.0 1.2 1.2 !  1 ALA:HB# - 2 CYS:HN
assign (resid 10  and  name  HA)(resid 10  and  name  HN) 3.1 1.3 1.3 !  10 CYS:HA - 10 CYS:HN
assign (resid 10  and  name  HA)(resid 13  and  name HB#) 3.2 1.4 1.4 !  10 CYS:HA - 13 ALA:HB#
assign (resid 10  and  name  HN)(resid 11  and  name  HN) 2.3 0.5 0.5 !  10 CYS:HN - 11 ALA:HN
assign (resid 10  and  name  HN)(resid 9   and  name  HA) 2.6 0.8 0.8 !  10 CYS:HN - 9 VAL:HA
assign (resid 10  and  name  HN)(resid 9   and  name HG#) 3.2 1.4 1.4 !  10 CYS:HN - 9 VAL:HG#
assign (resid 10  and  name HB1)(resid 10  and  name  HA) 2.7 0.9 0.9 !  10 CYS:HB1 - 10 CYS:HA
assign (resid 10  and  name HB1)(resid 10  and  name  HN) 2.6 0.8 0.8 !  10 CYS:HB1 - 10 CYS:HN
assign (resid 10  and  name HB1)(resid 11  and  name  HN) 2.7 0.9 0.9 !  10 CYS:HB1 - 11 ALA:HN
assign (resid 10  and  name HB1)(resid 14  and  name HD1#) 2.8 1.0 1.0 !  10 CYS:HB1 - 14 ILE:HD1#
assign (resid 10  and  name HB2)(resid 10  and  name  HA) 2.7 0.9 0.9 !  10 CYS:HB2 - 10 CYS:HA
assign (resid 10  and  name HB2)(resid 10  and  name  HN) 2.3 0.5 0.5 !  10 CYS:HB2 - 10 CYS:HN
assign (resid 10  and  name HB2)(resid 10  and  name HB1) 2.3 0.5 0.5 !  10 CYS:HB2 - 10 CYS:HB1
assign (resid 10  and  name HB2)(resid 11  and  name  HN) 2.7 0.9 0.9 !  10 CYS:HB2 - 11 ALA:HN
assign (resid 10  and  name HB2)(resid 14  and  name HD1#) 2.8 1.0 1.0 !  10 CYS:HB2 - 14 ILE:HD1#
assign (resid 11  and  name  HA)(resid 11  and  name  HN) 2.2 0.5 0.5 !  11 ALA:HA - 11 ALA:HN
assign (resid 11  and  name  HA)(resid 14  and  name  HN) 2.7 0.9 0.9 !  11 ALA:HA - 14 ILE:HN
assign (resid 11  and  name  HA)(resid 14  and  name HD1#) 3.2 1.4 1.4 !  11 ALA:HA - 14 ILE:HD1#
assign (resid 11  and  name HB#)(resid 11  and  name  HA) 2.8 1.0 1.0 !  11 ALA:HB# - 11 ALA:HA
assign (resid 11  and  name HB#)(resid 11  and  name  HN) 2.8 1.0 1.0 !  11 ALA:HB# - 11 ALA:HN
assign (resid 12  and  name  HA)(resid 12  and  name  HN) 2.2 0.5 0.5 !  12 SER:HA - 12 SER:HN
assign (resid 12  and  name  HA)(resid 12  and  name HB#) 2.3 0.5 0.5 !  12 SER:HA - 12 SER:HB#
assign (resid 12  and  name  HN)(resid 11  and  name  HA) 2.6 0.8 0.8 !  12 SER:HN - 11 ALA:HA
assign (resid 12  and  name  HN)(resid 11  and  name  HN) 2.3 0.5 0.5 !  12 SER:HN - 11 ALA:HN
assign (resid 12  and  name  HN)(resid 11  and  name HB#) 2.8 1.0 1.0 !  12 SER:HN - 11 ALA:HB#
assign (resid 12  and  name  HN)(resid 13  and  name  HN) 2.3 0.5 0.5 !  12 SER:HN - 13 ALA:HN
assign (resid 12  and  name HB#)(resid 12  and  name  HA) 2.3 0.5 0.5 !  12 SER:HB# - 12 SER:HA
assign (resid 12  and  name HB#)(resid 12  and  name  HN) 2.6 0.8 0.8 !  12 SER:HB# - 12 SER:HN
assign (resid 12  and  name HB#)(resid 13  and  name  HN) 2.3 0.5 0.5 !  12 SER:HB# - 13 ALA:HN
assign (resid 12  and  name HB#)(resid 18  and  name HB#) 2.8 1.0 1.0 !  12 SER:HB# - 18 ALA:HB#
assign (resid 13  and  name  HA)(resid 13  and  name  HN) 2.3 0.5 0.5 !  13 ALA:HA - 13 ALA:HN
assign (resid 13  and  name  HA)(resid 14  and  name  HN) 2.7 0.9 0.9 !  13 ALA:HA - 14 ILE:HN
assign (resid 13  and  name  HA)(resid 18  and  name  HN) 2.3 0.5 0.5 !  13 ALA:HA - 18 ALA:HN
assign (resid 13  and  name  HA)(resid 18  and  name HB#) 2.8 1.0 1.0 !  13 ALA:HA - 18 ALA:HB#
assign (resid 13  and  name  HN)(resid 14  and  name  HN) 2.3 0.5 0.5 !  13 ALA:HN - 14 ILE:HN
assign (resid 13  and  name HB#)(resid 13  and  name  HA) 2.8 1.0 1.0 !  13 ALA:HB# - 13 ALA:HA
assign (resid 13  and  name HB#)(resid 13  and  name  HN) 2.8 1.0 1.0 !  13 ALA:HB# - 13 ALA:HN
assign (resid 13  and  name HB#)(resid 14  and  name  HN) 2.8 1.0 1.0 !  13 ALA:HB# - 14 ILE:HN
assign (resid 13  and  name HB#)(resid 18  and  name  HN) 3.2 1.4 1.4 !  13 ALA:HB# - 18 ALA:HN
assign (resid 13  and  name HB#)(resid 18  and  name HB#) 3.3 1.5 1.5 !  13 ALA:HB# - 18 ALA:HB#
assign (resid 14  and  name  HA)(resid 14  and  name  HN) 2.7 0.9 0.9 !  14 ILE:HA - 14 ILE:HN
assign (resid 14  and  name  HB)(resid 14  and  name  HA) 2.7 0.9 0.9 !  14 ILE:HB - 14 ILE:HA
assign (resid 14  and  name  HB)(resid 14  and  name  HN) 2.8 1.0 1.0 !  14 ILE:HB - 14 ILE:HN
assign (resid 14  and  name  HB)(resid 14  and  name HD1#) 3.3 1.5 1.5 !  14 ILE:HB - 14 ILE:HD1#
assign (resid 14  and  name  HB)(resid 14  and  name HG1#) 3.7 1.9 1.9 !  14 ILE:HB - 14 ILE:HG1#
assign (resid 14  and  name  HB)(resid 15  and  name HD#) 3.2 1.4 1.4 !  14 ILE:HB - 15 LEU:HD#
assign (resid 14  and  name HD1#)(resid 14  and  name  HA) 3.2 1.4 1.4 !  14 ILE:HD1# - 14 ILE:HA
assign (resid 14  and  name HD1#)(resid 14  and  name  HN) 3.2 1.4 1.4 !  14 ILE:HD1# - 14 ILE:HN
assign (resid 14  and  name HD1#)(resid 14  and  name HG1#) 3.3 1.5 1.5 !  14 ILE:HD1# - 14 ILE:HG1#
assign (resid 14  and  name HG1#)(resid 14  and  name  HA) 2.8 1.0 1.0 !  14 ILE:HG1# - 14 ILE:HA
assign (resid 14  and  name HG1#)(resid 14  and  name  HN) 3.2 1.4 1.4 !  14 ILE:HG1# - 14 ILE:HN
assign (resid 14  and  name HG1#)(resid 47  and  name HB1) 3.2 1.4 1.4 !  14 ILE:HG1# - 47 TYR:HB1
assign (resid 14  and  name HG1#)(resid 47  and  name HB2) 3.7 1.9 1.9 !  14 ILE:HG1# - 47 TYR:HB2
assign (resid 15  and  name  HA)(resid 15  and  name  HN) 2.7 0.9 0.9 !  15 LEU:HA - 15 LEU:HN
assign (resid 15  and  name  HG)(resid 15  and  name  HA) 2.7 0.9 0.9 !  15 LEU:HG - 15 LEU:HA
assign (resid 15  and  name  HG)(resid 15  and  name  HN) 2.3 0.5 0.5 !  15 LEU:HG - 15 LEU:HN
assign (resid 15  and  name  HG)(resid 15  and  name HB#) 2.3 0.5 0.5 !  15 LEU:HG - 15 LEU:HB#
assign (resid 15  and  name  HN)(resid 14  and  name  HA) 2.7 0.9 0.9 !  15 LEU:HN - 14 ILE:HA
assign (resid 15  and  name  HN)(resid 14  and  name  HN) 2.3 0.5 0.5 !  15 LEU:HN - 14 ILE:HN
assign (resid 15  and  name  HN)(resid 14  and  name HG1#) 3.2 1.4 1.4 !  15 LEU:HN - 14 ILE:HG1#
assign (resid 15  and  name HB#)(resid 15  and  name  HA) 2.7 0.9 0.9 !  15 LEU:HB# - 15 LEU:HA
assign (resid 15  and  name HB#)(resid 15  and  name  HG) 2.7 0.9 0.9 !  15 LEU:HB# - 15 LEU:HG
assign (resid 15  and  name HB#)(resid 15  and  name  HN) 2.7 0.9 0.9 !  15 LEU:HB# - 15 LEU:HN
assign (resid 15  and  name HD#)(resid 15  and  name  HA) 3.2 1.4 1.4 !  15 LEU:HD# - 15 LEU:HA
assign (resid 15  and  name HD#)(resid 15  and  name  HG) 2.8 1.0 1.0 !  15 LEU:HD# - 15 LEU:HG
assign (resid 15  and  name HD#)(resid 15  and  name  HN) 3.2 1.4 1.4 !  15 LEU:HD# - 15 LEU:HN
assign (resid 15  and  name HD#)(resid 15  and  name HB#) 3.2 1.4 1.4 !  15 LEU:HD# - 15 LEU:HB#
assign (resid 15  and  name HD#)(resid 47  and  name  HA) 3.2 1.4 1.4 !  15 LEU:HD# - 47 TYR:HA
assign (resid 16  and  name  HA)(resid 16  and  name  HN) 3.1 1.3 1.3 !  16 SER:HA - 16 SER:HN
assign (resid 16  and  name  HA)(resid 16  and  name HB#) 2.7 0.9 0.9 !  16 SER:HA - 16 SER:HB#
assign (resid 16  and  name  HN)(resid 15  and  name  HA) 2.7 0.9 0.9 !  16 SER:HN - 15 LEU:HA
assign (resid 16  and  name  HN)(resid 15  and  name  HN) 2.7 0.9 0.9 !  16 SER:HN - 15 LEU:HN
assign (resid 16  and  name  HN)(resid 15  and  name HB#) 2.7 0.9 0.9 !  16 SER:HN - 15 LEU:HB#
assign (resid 16  and  name HB#)(resid 16  and  name  HN) 2.7 0.9 0.9 !  16 SER:HB# - 16 SER:HN
assign (resid 16  and  name HB#)(resid 18  and  name  HN) 2.8 1.0 1.0 !  16 SER:HB# - 18 ALA:HN
assign (resid 17  and  name  HN)(resid 18  and  name  HN) 2.3 0.5 0.5 !  17 GLY:HN - 18 ALA:HN
assign (resid 17  and  name HA#)(resid 17  and  name  HN) 2.7 0.9 0.9 !  17 GLY:HA# - 17 GLY:HN
assign (resid 18  and  name  HA)(resid 18  and  name  HN) 2.3 0.5 0.5 !  18 ALA:HA - 18 ALA:HN
assign (resid 18  and  name HB#)(resid 18  and  name  HA) 2.8 1.0 1.0 !  18 ALA:HB# - 18 ALA:HA
assign (resid 18  and  name HB#)(resid 18  and  name  HN) 2.8 1.0 1.0 !  18 ALA:HB# - 18 ALA:HN
assign (resid 19  and  name  HA)(resid 19  and  name  HN) 2.3 0.5 0.5 !  19 LYS:HA - 19 LYS:HN
assign (resid 19  and  name  HN)(resid 18  and  name  HA) 2.6 0.8 0.8 !  19 LYS:HN - 18 ALA:HA
assign (resid 19  and  name  HN)(resid 18  and  name  HN) 2.7 0.9 0.9 !  19 LYS:HN - 18 ALA:HN
assign (resid 19  and  name  HN)(resid 18  and  name HB#) 2.8 1.0 1.0 !  19 LYS:HN - 18 ALA:HB#
assign (resid 19  and  name HD#)(resid 19  and  name  HA) 3.2 1.4 1.4 !  19 LYS:HD# - 19 LYS:HA
assign (resid 19  and  name HD#)(resid 19  and  name  HN) 2.8 1.0 1.0 !  19 LYS:HD# - 19 LYS:HN
assign (resid 19  and  name HD#)(resid 19  and  name HE#) 3.7 1.9 1.9 !  19 LYS:HD# - 19 LYS:HE#
assign (resid 19  and  name HE#)(resid 19  and  name  HA) 3.6 1.8 1.8 !  19 LYS:HE# - 19 LYS:HA
assign (resid 19  and  name HE#)(resid 19  and  name  HN) 3.2 1.4 1.4 !  19 LYS:HE# - 19 LYS:HN
assign (resid 19  and  name HG#)(resid 19  and  name  HA) 3.1 1.3 1.3 !  19 LYS:HG# - 19 LYS:HA
assign (resid 19  and  name HG#)(resid 19  and  name  HN) 2.7 0.9 0.9 !  19 LYS:HG# - 19 LYS:HN
assign (resid 19  and  name HG#)(resid 19  and  name HD#) 2.8 1.0 1.0 !  19 LYS:HG# - 19 LYS:HD#
assign (resid 19  and  name HG#)(resid 19  and  name HE#) 3.6 1.8 1.8 !  19 LYS:HG# - 19 LYS:HE#
assign (resid 2   and  name  HN)(resid 3   and  name  HN) 2.7 0.9 0.9 !  2 CYS:HN - 3 GLN:HN
assign (resid 2   and  name HB#)(resid 2   and  name  HA) 2.7 0.9 0.9 !  2 CYS:HB# - 2 CYS:HA
assign (resid 2   and  name HB#)(resid 34  and  name HB1) 2.7 0.9 0.9 !  2 CYS:HB# - 34 CYS:HB1
assign (resid 20  and  name  HA)(resid 13  and  name HB#) 2.8 1.0 1.0 !  20 PRO:HA - 13 ALA:HB#
assign (resid 20  and  name  HA)(resid 21  and  name  HN) 2.3 0.5 0.5 !  20 PRO:HA - 21 SER:HN
assign (resid 20  and  name HB#)(resid 13  and  name HB#) 3.3 1.5 1.5 !  20 PRO:HB# - 13 ALA:HB#
assign (resid 20  and  name HB#)(resid 20  and  name  HA) 2.8 1.0 1.0 !  20 PRO:HB# - 20 PRO:HA
assign (resid 20  and  name HB#)(resid 20  and  name HG#) 2.8 1.0 1.0 !  20 PRO:HB# - 20 PRO:HG#
assign (resid 20  and  name HB#)(resid 21  and  name  HN) 2.8 1.0 1.0 !  20 PRO:HB# - 21 SER:HN
assign (resid 20  and  name HD#)(resid 19  and  name  HA) 2.3 0.5 0.5 !  20 PRO:HD# - 19 LYS:HA
assign (resid 20  and  name HD#)(resid 20  and  name  HA) 3.1 1.3 1.3 !  20 PRO:HD# - 20 PRO:HA
assign (resid 20  and  name HD#)(resid 20  and  name HB#) 3.2 1.4 1.4 !  20 PRO:HD# - 20 PRO:HB#
assign (resid 20  and  name HD#)(resid 20  and  name HG#) 2.3 0.5 0.5 !  20 PRO:HD# - 20 PRO:HG#
assign (resid 20  and  name HG#)(resid 20  and  name  HA) 2.7 0.9 0.9 !  20 PRO:HG# - 20 PRO:HA
assign (resid 20  and  name HG#)(resid 20  and  name HD#) 2.7 0.9 0.9 !  20 PRO:HG# - 20 PRO:HD#
assign (resid 21  and  name  HA)(resid 21  and  name  HN) 2.3 0.5 0.5 !  21 SER:HA - 21 SER:HN
assign (resid 21  and  name  HA)(resid 22  and  name  HN) 2.3 0.5 0.5 !  21 SER:HA - 22 GLY:HN
assign (resid 21  and  name  HN)(resid 22  and  name  HN) 3.0 1.2 1.2 !  21 SER:HN - 22 GLY:HN
assign (resid 21  and  name  HN)(resid 24  and  name HB#) 2.7 0.9 0.9 !  21 SER:HN - 24 CYS:HB#
assign (resid 21  and  name HB#)(resid 21  and  name  HA) 2.3 0.5 0.5 !  21 SER:HB# - 21 SER:HA
assign (resid 21  and  name HB#)(resid 21  and  name  HN) 2.7 0.9 0.9 !  21 SER:HB# - 21 SER:HN
assign (resid 21  and  name HB#)(resid 22  and  name  HN) 2.7 0.9 0.9 !  21 SER:HB# - 22 GLY:HN
assign (resid 21  and  name HB#)(resid 24  and  name  HN) 2.7 0.9 0.9 !  21 SER:HB# - 24 CYS:HN
assign (resid 22  and  name HA#)(resid 22  and  name  HN) 2.3 0.5 0.5 !  22 GLY:HA# - 22 GLY:HN
assign (resid 22  and  name HA#)(resid 25  and  name  HN) 2.7 0.9 0.9 !  22 GLY:HA# - 25 CYS:HN
assign (resid 23  and  name  HA)(resid 23  and  name  HN) 2.3 0.5 0.5 !  23 GLU:HA - 23 GLU:HN
assign (resid 23  and  name  HN)(resid 22  and  name  HN) 2.3 0.5 0.5 !  23 GLU:HN - 22 GLY:HN
assign (resid 23  and  name  HN)(resid 22  and  name HA#) 2.7 0.9 0.9 !  23 GLU:HN - 22 GLY:HA#
assign (resid 23  and  name HB1)(resid 23  and  name  HA) 2.7 0.9 0.9 !  23 GLU:HB1 - 23 GLU:HA
assign (resid 23  and  name HB1)(resid 23  and  name  HN) 2.6 0.8 0.8 !  23 GLU:HB1 - 23 GLU:HN
assign (resid 23  and  name HB1)(resid 23  and  name HG#) 2.7 0.9 0.9 !  23 GLU:HB1 - 23 GLU:HG#
assign (resid 23  and  name HB2)(resid 23  and  name  HA) 2.7 0.9 0.9 !  23 GLU:HB2 - 23 GLU:HA
assign (resid 23  and  name HB2)(resid 23  and  name  HN) 2.6 0.8 0.8 !  23 GLU:HB2 - 23 GLU:HN
assign (resid 23  and  name HB2)(resid 23  and  name HB1) 2.3 0.5 0.5 !  23 GLU:HB2 - 23 GLU:HB1
assign (resid 23  and  name HB2)(resid 23  and  name HG#) 2.7 0.9 0.9 !  23 GLU:HB2 - 23 GLU:HG#
assign (resid 23  and  name HG#)(resid 23  and  name  HA) 2.7 0.9 0.9 !  23 GLU:HG# - 23 GLU:HA
assign (resid 23  and  name HG#)(resid 23  and  name  HN) 2.7 0.9 0.9 !  23 GLU:HG# - 23 GLU:HN
assign (resid 24  and  name  HA)(resid 24  and  name  HN) 2.2 0.5 0.5 !  24 CYS:HA - 24 CYS:HN
assign (resid 24  and  name  HA)(resid 25  and  name  HN) 2.6 0.8 0.8 !  24 CYS:HA - 25 CYS:HN
assign (resid 24  and  name  HN)(resid 23  and  name  HN) 2.3 0.5 0.5 !  24 CYS:HN - 23 GLU:HN
assign (resid 24  and  name  HN)(resid 25  and  name  HN) 2.7 0.9 0.9 !  24 CYS:HN - 25 CYS:HN
assign (resid 24  and  name HB#)(resid 24  and  name  HA) 2.3 0.5 0.5 !  24 CYS:HB# - 24 CYS:HA
assign (resid 24  and  name HB#)(resid 24  and  name  HN) 2.3 0.5 0.5 !  24 CYS:HB# - 24 CYS:HN
assign (resid 24  and  name HB#)(resid 25  and  name  HN) 2.7 0.9 0.9 !  24 CYS:HB# - 25 CYS:HN
assign (resid 25  and  name  HA)(resid 25  and  name  HN) 2.7 0.9 0.9 !  25 CYS:HA - 25 CYS:HN
assign (resid 25  and  name HB#)(resid 25  and  name  HA) 2.7 0.9 0.9 !  25 CYS:HB# - 25 CYS:HA
assign (resid 25  and  name HB#)(resid 25  and  name  HN) 2.3 0.5 0.5 !  25 CYS:HB# - 25 CYS:HN
assign (resid 26  and  name  HN)(resid 23  and  name  HA) 2.7 0.9 0.9 !  26 GLY:HN - 23 GLU:HA
assign (resid 26  and  name  HN)(resid 25  and  name  HA) 3.1 1.3 1.3 !  26 GLY:HN - 25 CYS:HA
assign (resid 26  and  name  HN)(resid 25  and  name  HN) 2.3 0.5 0.5 !  26 GLY:HN - 25 CYS:HN
assign (resid 26  and  name  HN)(resid 25  and  name HB#) 2.7 0.9 0.9 !  26 GLY:HN - 25 CYS:HB#
assign (resid 26  and  name  HN)(resid 27  and  name  HN) 2.3 0.5 0.5 !  26 GLY:HN - 27 ASN:HN
assign (resid 26  and  name HA#)(resid 26  and  name  HN) 2.2 0.5 0.5 !  26 GLY:HA# - 26 GLY:HN
assign (resid 26  and  name HA#)(resid 27  and  name  HN) 2.6 0.8 0.8 !  26 GLY:HA# - 27 ASN:HN
assign (resid 26  and  name HA#)(resid 29  and  name  HN) 2.7 0.9 0.9 !  26 GLY:HA# - 29 ARG:HN
assign (resid 27  and  name  HA)(resid 27  and  name  HN) 2.2 0.5 0.5 !  27 ASN:HA - 27 ASN:HN
assign (resid 27  and  name  HA)(resid 28  and  name  HN) 2.6 0.8 0.8 !  27 ASN:HA - 28 LEU:HN
assign (resid 27  and  name  HA)(resid 7   and  name HD#) 3.6 1.8 1.8 !  27 ASN:HA - 7 LEU:HD#
assign (resid 27  and  name  HN)(resid 24  and  name  HA) 2.7 0.9 0.9 !  27 ASN:HN - 24 CYS:HA
assign (resid 27  and  name  HN)(resid 28  and  name  HN) 2.3 0.5 0.5 !  27 ASN:HN - 28 LEU:HN
assign (resid 27  and  name HB#)(resid 24  and  name  HA) 2.7 0.9 0.9 !  27 ASN:HB# - 24 CYS:HA
assign (resid 27  and  name HB#)(resid 27  and  name  HA) 2.7 0.9 0.9 !  27 ASN:HB# - 27 ASN:HA
assign (resid 27  and  name HB#)(resid 27  and  name  HN) 2.6 0.8 0.8 !  27 ASN:HB# - 27 ASN:HN
assign (resid 27  and  name HB#)(resid 28  and  name  HN) 2.7 0.9 0.9 !  27 ASN:HB# - 28 LEU:HN
assign (resid 27  and  name HB#)(resid 7   and  name HD#) 2.8 1.0 1.0 !  27 ASN:HB# - 7 LEU:HD#
assign (resid 27  and  name HD21)(resid 27  and  name  HA) 3.1 1.3 1.3 !  27 ASN:HD21 - 27 ASN:HA
assign (resid 27  and  name HD21)(resid 27  and  name  HN) 3.1 1.3 1.3 !  27 ASN:HD21 - 27 ASN:HN
assign (resid 27  and  name HD21)(resid 27  and  name HB#) 2.3 0.5 0.5 !  27 ASN:HD21 - 27 ASN:HB#
assign (resid 27  and  name HD21)(resid 6   and  name  HA) 2.7 0.9 0.9 !  27 ASN:HD21 - 6 GLN:HA
assign (resid 27  and  name HD21)(resid 6   and  name HB#) 2.7 0.9 0.9 !  27 ASN:HD21 - 6 GLN:HB#
assign (resid 27  and  name HD21)(resid 9   and  name HG#) 3.2 1.4 1.4 !  27 ASN:HD21 - 9 VAL:HG#
assign (resid 27  and  name HD22)(resid 27  and  name  HA) 3.1 1.3 1.3 !  27 ASN:HD22 - 27 ASN:HA
assign (resid 27  and  name HD22)(resid 27  and  name  HN) 3.1 1.3 1.3 !  27 ASN:HD22 - 27 ASN:HN
assign (resid 27  and  name HD22)(resid 27  and  name HB#) 3.1 1.3 1.3 !  27 ASN:HD22 - 27 ASN:HB#
assign (resid 27  and  name HD22)(resid 9   and  name HG#) 3.2 1.4 1.4 !  27 ASN:HD22 - 9 VAL:HG#
assign (resid 28  and  name  HA)(resid 28  and  name  HN) 2.2 0.5 0.5 !  28 LEU:HA - 28 LEU:HN
assign (resid 28  and  name  HA)(resid 7   and  name HD#) 2.8 1.0 1.0 !  28 LEU:HA - 7 LEU:HD#
assign (resid 28  and  name  HG)(resid 28  and  name  HA) 2.7 0.9 0.9 !  28 LEU:HG - 28 LEU:HA
assign (resid 28  and  name  HG)(resid 28  and  name  HN) 2.7 0.9 0.9 !  28 LEU:HG - 28 LEU:HN
assign (resid 28  and  name  HG)(resid 28  and  name HB#) 2.3 0.5 0.5 !  28 LEU:HG - 28 LEU:HB#
assign (resid 28  and  name  HG)(resid 28  and  name HD#) 2.8 1.0 1.0 !  28 LEU:HG - 28 LEU:HD#
assign (resid 28  and  name  HG)(resid 35  and  name HD#) 3.5 1.7 1.7 !  28 LEU:HG - 35 PHE:HD#
assign (resid 28  and  name  HG)(resid 7   and  name HD#) 3.2 1.4 1.4 !  28 LEU:HG - 7 LEU:HD#
assign (resid 28  and  name  HN)(resid 25  and  name  HA) 3.1 1.3 1.3 !  28 LEU:HN - 25 CYS:HA
assign (resid 28  and  name  HN)(resid 7   and  name HD#) 3.2 1.4 1.4 !  28 LEU:HN - 7 LEU:HD#
assign (resid 28  and  name HB#)(resid 28  and  name  HA) 3.1 1.3 1.3 !  28 LEU:HB# - 28 LEU:HA
assign (resid 28  and  name HB#)(resid 28  and  name  HN) 2.3 0.5 0.5 !  28 LEU:HB# - 28 LEU:HN
assign (resid 28  and  name HD#)(resid 28  and  name  HA) 3.2 1.4 1.4 !  28 LEU:HD# - 28 LEU:HA
assign (resid 28  and  name HD#)(resid 28  and  name  HN) 3.2 1.4 1.4 !  28 LEU:HD# - 28 LEU:HN
assign (resid 28  and  name HD#)(resid 28  and  name HB#) 2.8 1.0 1.0 !  28 LEU:HD# - 28 LEU:HB#
assign (resid 29  and  name  HA)(resid 29  and  name  HE) 2.7 0.9 0.9 !  29 ARG:HA - 29 ARG:HE
assign (resid 29  and  name  HA)(resid 29  and  name  HN) 2.2 0.5 0.5 !  29 ARG:HA - 29 ARG:HN
assign (resid 29  and  name  HA)(resid 31  and  name  HN) 2.7 0.9 0.9 !  29 ARG:HA - 31 GLN:HN
assign (resid 29  and  name  HA)(resid 62  and  name HD#) 2.8 1.0 1.0 !  29 ARG:HA - 62 LEU:HD#
assign (resid 29  and  name  HE)(resid 28  and  name HD#) 3.2 1.4 1.4 !  29 ARG:HE - 28 LEU:HD#
assign (resid 29  and  name  HN)(resid 28  and  name  HA) 2.6 0.8 0.8 !  29 ARG:HN - 28 LEU:HA
assign (resid 29  and  name  HN)(resid 28  and  name  HN) 2.3 0.5 0.5 !  29 ARG:HN - 28 LEU:HN
assign (resid 29  and  name  HN)(resid 28  and  name HB#) 2.7 0.9 0.9 !  29 ARG:HN - 28 LEU:HB#
assign (resid 29  and  name HB#)(resid 29  and  name  HA) 2.8 1.0 1.0 !  29 ARG:HB# - 29 ARG:HA
assign (resid 29  and  name HB#)(resid 29  and  name  HE) 3.2 1.4 1.4 !  29 ARG:HB# - 29 ARG:HE
assign (resid 29  and  name HB#)(resid 29  and  name  HN) 2.8 1.0 1.0 !  29 ARG:HB# - 29 ARG:HN
assign (resid 29  and  name HB#)(resid 29  and  name HD#) 3.2 1.4 1.4 !  29 ARG:HB# - 29 ARG:HD#
assign (resid 29  and  name HB#)(resid 62  and  name HD#) 3.3 1.5 1.5 !  29 ARG:HB# - 62 LEU:HD#
assign (resid 29  and  name HD#)(resid 29  and  name  HA) 2.7 0.9 0.9 !  29 ARG:HD# - 29 ARG:HA
assign (resid 29  and  name HD#)(resid 29  and  name  HE) 2.3 0.5 0.5 !  29 ARG:HD# - 29 ARG:HE
assign (resid 29  and  name HD#)(resid 29  and  name  HN) 2.7 0.9 0.9 !  29 ARG:HD# - 29 ARG:HN
assign (resid 29  and  name HD#)(resid 62  and  name HD#) 3.2 1.4 1.4 !  29 ARG:HD# - 62 LEU:HD#
assign (resid 29  and  name HG#)(resid 29  and  name  HA) 2.3 0.5 0.5 !  29 ARG:HG# - 29 ARG:HA
assign (resid 29  and  name HG#)(resid 29  and  name  HE) 2.7 0.9 0.9 !  29 ARG:HG# - 29 ARG:HE
assign (resid 29  and  name HG#)(resid 29  and  name  HN) 2.7 0.9 0.9 !  29 ARG:HG# - 29 ARG:HN
assign (resid 29  and  name HG#)(resid 29  and  name HB#) 2.8 1.0 1.0 !  29 ARG:HG# - 29 ARG:HB#
assign (resid 29  and  name HG#)(resid 29  and  name HD#) 2.3 0.5 0.5 !  29 ARG:HG# - 29 ARG:HD#
assign (resid 29  and  name HG#)(resid 62  and  name HD#) 3.2 1.4 1.4 !  29 ARG:HG# - 62 LEU:HD#
assign (resid 3   and  name  HA)(resid 3   and  name  HN) 3.1 1.3 1.3 !  3 GLN:HA - 3 GLN:HN
assign (resid 3   and  name  HA)(resid 4   and  name  HN) 2.7 0.9 0.9 !  3 GLN:HA - 4 ALA:HN
assign (resid 3   and  name HB#)(resid 3   and  name  HA) 3.1 1.3 1.3 !  3 GLN:HB# - 3 GLN:HA
assign (resid 3   and  name HB#)(resid 3   and  name  HN) 2.3 0.5 0.5 !  3 GLN:HB# - 3 GLN:HN
assign (resid 3   and  name HB#)(resid 3   and  name HG#) 2.8 1.0 1.0 !  3 GLN:HB# - 3 GLN:HG#
assign (resid 3   and  name HB#)(resid 4   and  name  HN) 2.7 0.9 0.9 !  3 GLN:HB# - 4 ALA:HN
assign (resid 3   and  name HE2#)(resid 3   and  name HG#) 3.2 1.4 1.4 !  3 GLN:HE2# - 3 GLN:HG#
assign (resid 3   and  name HG#)(resid 3   and  name  HA) 3.6 1.8 1.8 !  3 GLN:HG# - 3 GLN:HA
assign (resid 3   and  name HG#)(resid 3   and  name  HN) 3.2 1.4 1.4 !  3 GLN:HG# - 3 GLN:HN
assign (resid 3   and  name HG#)(resid 4   and  name  HN) 3.2 1.4 1.4 !  3 GLN:HG# - 4 ALA:HN
assign (resid 30  and  name  HA)(resid 30  and  name  HN) 2.2 0.5 0.5 !  30 ALA:HA - 30 ALA:HN
assign (resid 30  and  name  HA)(resid 31  and  name  HN) 2.6 0.8 0.8 !  30 ALA:HA - 31 GLN:HN
assign (resid 30  and  name  HN)(resid 27  and  name  HA) 2.7 0.9 0.9 !  30 ALA:HN - 27 ASN:HA
assign (resid 30  and  name  HN)(resid 29  and  name  HA) 2.6 0.8 0.8 !  30 ALA:HN - 29 ARG:HA
assign (resid 30  and  name  HN)(resid 29  and  name  HN) 2.3 0.5 0.5 !  30 ALA:HN - 29 ARG:HN
assign (resid 30  and  name  HN)(resid 29  and  name HB#) 2.8 1.0 1.0 !  30 ALA:HN - 29 ARG:HB#
assign (resid 30  and  name  HN)(resid 31  and  name  HN) 2.3 0.5 0.5 !  30 ALA:HN - 31 GLN:HN
assign (resid 30  and  name HB#)(resid 27  and  name  HA) 2.8 1.0 1.0 !  30 ALA:HB# - 27 ASN:HA
assign (resid 30  and  name HB#)(resid 30  and  name  HA) 2.8 1.0 1.0 !  30 ALA:HB# - 30 ALA:HA
assign (resid 30  and  name HB#)(resid 30  and  name  HN) 2.8 1.0 1.0 !  30 ALA:HB# - 30 ALA:HN
assign (resid 30  and  name HB#)(resid 31  and  name  HN) 2.8 1.0 1.0 !  30 ALA:HB# - 31 GLN:HN
assign (resid 30  and  name HB#)(resid 31  and  name HB#) 3.2 1.4 1.4 !  30 ALA:HB# - 31 GLN:HB#
assign (resid 30  and  name HB#)(resid 31  and  name HG#) 3.2 1.4 1.4 !  30 ALA:HB# - 31 GLN:HG#
assign (resid 31  and  name  HA)(resid 31  and  name  HN) 2.7 0.9 0.9 !  31 GLN:HA - 31 GLN:HN
assign (resid 31  and  name  HN)(resid 28  and  name  HA) 2.7 0.9 0.9 !  31 GLN:HN - 28 LEU:HA
assign (resid 31  and  name HB#)(resid 28  and  name  HA) 2.7 0.9 0.9 !  31 GLN:HB# - 28 LEU:HA
assign (resid 31  and  name HB#)(resid 31  and  name  HA) 2.7 0.9 0.9 !  31 GLN:HB# - 31 GLN:HA
assign (resid 31  and  name HB#)(resid 31  and  name  HN) 2.6 0.8 0.8 !  31 GLN:HB# - 31 GLN:HN
assign (resid 31  and  name HB#)(resid 31  and  name HG#) 2.3 0.5 0.5 !  31 GLN:HB# - 31 GLN:HG#
assign (resid 31  and  name HE21)(resid 31  and  name HB#) 2.7 0.9 0.9 !  31 GLN:HE21 - 31 GLN:HB#
assign (resid 31  and  name HE21)(resid 31  and  name HE22) 2.3 0.5 0.5 !  31 GLN:HE21 - 31 GLN:HE22
assign (resid 31  and  name HE21)(resid 31  and  name HG#) 2.7 0.9 0.9 !  31 GLN:HE21 - 31 GLN:HG#
assign (resid 31  and  name HE21)(resid 6   and  name HB#) 2.7 0.9 0.9 !  31 GLN:HE21 - 6 GLN:HB#
assign (resid 31  and  name HE21)(resid 7   and  name HD#) 3.2 1.4 1.4 !  31 GLN:HE21 - 7 LEU:HD#
assign (resid 31  and  name HE22)(resid 31  and  name HB#) 2.7 0.9 0.9 !  31 GLN:HE22 - 31 GLN:HB#
assign (resid 31  and  name HE22)(resid 31  and  name HG#) 2.7 0.9 0.9 !  31 GLN:HE22 - 31 GLN:HG#
assign (resid 31  and  name HE22)(resid 6   and  name HB#) 2.7 0.9 0.9 !  31 GLN:HE22 - 6 GLN:HB#
assign (resid 31  and  name HE22)(resid 7   and  name  HG) 2.7 0.9 0.9 !  31 GLN:HE22 - 7 LEU:HG
assign (resid 31  and  name HE22)(resid 7   and  name HD#) 3.2 1.4 1.4 !  31 GLN:HE22 - 7 LEU:HD#
assign (resid 31  and  name HG#)(resid 31  and  name  HA) 2.7 0.9 0.9 !  31 GLN:HG# - 31 GLN:HA
assign (resid 31  and  name HG#)(resid 31  and  name  HN) 2.7 0.9 0.9 !  31 GLN:HG# - 31 GLN:HN
assign (resid 31  and  name HG#)(resid 31  and  name HB#) 2.3 0.5 0.5 !  31 GLN:HG# - 31 GLN:HB#
assign (resid 32  and  name  HA)(resid 32  and  name  HN) 2.7 0.9 0.9 !  32 GLN:HA - 32 GLN:HN
assign (resid 32  and  name  HA)(resid 33  and  name  HN) 3.1 1.3 1.3 !  32 GLN:HA - 33 GLY:HN
assign (resid 32  and  name  HN)(resid 28  and  name HD#) 3.2 1.4 1.4 !  32 GLN:HN - 28 LEU:HD#
assign (resid 32  and  name  HN)(resid 29  and  name  HA) 2.7 0.9 0.9 !  32 GLN:HN - 29 ARG:HA
assign (resid 32  and  name  HN)(resid 31  and  name  HA) 2.7 0.9 0.9 !  32 GLN:HN - 31 GLN:HA
assign (resid 32  and  name  HN)(resid 31  and  name  HN) 2.3 0.5 0.5 !  32 GLN:HN - 31 GLN:HN
assign (resid 32  and  name  HN)(resid 31  and  name HB#) 3.1 1.3 1.3 !  32 GLN:HN - 31 GLN:HB#
assign (resid 32  and  name  HN)(resid 31  and  name HG#) 2.7 0.9 0.9 !  32 GLN:HN - 31 GLN:HG#
assign (resid 32  and  name  HN)(resid 33  and  name  HN) 2.3 0.5 0.5 !  32 GLN:HN - 33 GLY:HN
assign (resid 32  and  name HB#)(resid 29  and  name  HA) 2.7 0.9 0.9 !  32 GLN:HB# - 29 ARG:HA
assign (resid 32  and  name HB#)(resid 32  and  name  HA) 2.3 0.5 0.5 !  32 GLN:HB# - 32 GLN:HA
assign (resid 32  and  name HB#)(resid 32  and  name  HN) 2.3 0.5 0.5 !  32 GLN:HB# - 32 GLN:HN
assign (resid 32  and  name HB#)(resid 33  and  name  HN) 2.7 0.9 0.9 !  32 GLN:HB# - 33 GLY:HN
assign (resid 32  and  name HE21)(resid 28  and  name HD#) 3.2 1.4 1.4 !  32 GLN:HE21 - 28 LEU:HD#
assign (resid 32  and  name HE21)(resid 29  and  name  HA) 2.7 0.9 0.9 !  32 GLN:HE21 - 29 ARG:HA
assign (resid 32  and  name HE21)(resid 29  and  name HB#) 3.2 1.4 1.4 !  32 GLN:HE21 - 29 ARG:HB#
assign (resid 32  and  name HE21)(resid 29  and  name HG#) 2.7 0.9 0.9 !  32 GLN:HE21 - 29 ARG:HG#
assign (resid 32  and  name HE21)(resid 32  and  name HB#) 2.3 0.5 0.5 !  32 GLN:HE21 - 32 GLN:HB#
assign (resid 32  and  name HE21)(resid 32  and  name HG#) 3.2 1.4 1.4 !  32 GLN:HE21 - 32 GLN:HG#
assign (resid 32  and  name HE22)(resid 28  and  name HD#) 2.8 1.0 1.0 !  32 GLN:HE22 - 28 LEU:HD#
assign (resid 32  and  name HE22)(resid 29  and  name  HA) 2.7 0.9 0.9 !  32 GLN:HE22 - 29 ARG:HA
assign (resid 32  and  name HE22)(resid 29  and  name HG#) 2.7 0.9 0.9 !  32 GLN:HE22 - 29 ARG:HG#
assign (resid 32  and  name HE22)(resid 32  and  name HB#) 2.7 0.9 0.9 !  32 GLN:HE22 - 32 GLN:HB#
assign (resid 32  and  name HE22)(resid 32  and  name HG#) 3.2 1.4 1.4 !  32 GLN:HE22 - 32 GLN:HG#
assign (resid 32  and  name HG#)(resid 29  and  name  HA) 3.2 1.4 1.4 !  32 GLN:HG# - 29 ARG:HA
assign (resid 32  and  name HG#)(resid 32  and  name  HA) 2.8 1.0 1.0 !  32 GLN:HG# - 32 GLN:HA
assign (resid 32  and  name HG#)(resid 32  and  name  HN) 2.8 1.0 1.0 !  32 GLN:HG# - 32 GLN:HN
assign (resid 32  and  name HG#)(resid 32  and  name HB#) 2.8 1.0 1.0 !  32 GLN:HG# - 32 GLN:HB#
assign (resid 32  and  name HG#)(resid 33  and  name  HN) 3.2 1.4 1.4 !  32 GLN:HG# - 33 GLY:HN
assign (resid 33  and  name  HN)(resid 31  and  name  HA) 2.7 0.9 0.9 !  33 GLY:HN - 31 GLN:HA
assign (resid 33  and  name  HN)(resid 34  and  name  HN) 2.3 0.5 0.5 !  33 GLY:HN - 34 CYS:HN
assign (resid 33  and  name HA#)(resid 33  and  name  HN) 2.3 0.5 0.5 !  33 GLY:HA# - 33 GLY:HN
assign (resid 33  and  name HA#)(resid 34  and  name  HN) 2.7 0.9 0.9 !  33 GLY:HA# - 34 CYS:HN
assign (resid 34  and  name  HA)(resid 34  and  name  HN) 2.2 0.5 0.5 !  34 CYS:HA - 34 CYS:HN
assign (resid 34  and  name  HA)(resid 37  and  name  HN) 2.7 0.9 0.9 !  34 CYS:HA - 37 GLN:HN
assign (resid 34  and  name HB1)(resid 34  and  name  HA) 2.3 0.5 0.5 !  34 CYS:HB1 - 34 CYS:HA
assign (resid 34  and  name HB1)(resid 34  and  name  HN) 2.6 0.8 0.8 !  34 CYS:HB1 - 34 CYS:HN
assign (resid 34  and  name HB1)(resid 34  and  name HB2) 2.3 0.5 0.5 !  34 CYS:HB1 - 34 CYS:HB2
assign (resid 34  and  name HB2)(resid 34  and  name  HA) 2.7 0.9 0.9 !  34 CYS:HB2 - 34 CYS:HA
assign (resid 34  and  name HB2)(resid 34  and  name  HN) 2.3 0.5 0.5 !  34 CYS:HB2 - 34 CYS:HN
assign (resid 35  and  name  HA)(resid 35  and  name  HN) 2.7 0.9 0.9 !  35 PHE:HA - 35 PHE:HN
assign (resid 35  and  name  HA)(resid 36  and  name  HN) 2.6 0.8 0.8 !  35 PHE:HA - 36 CYS:HN
assign (resid 35  and  name  HA)(resid 38  and  name  HN) 2.7 0.9 0.9 !  35 PHE:HA - 38 TYR:HN
assign (resid 35  and  name  HN)(resid 33  and  name  HN) 2.7 0.9 0.9 !  35 PHE:HN - 33 GLY:HN
assign (resid 35  and  name  HN)(resid 34  and  name  HA) 2.6 0.8 0.8 !  35 PHE:HN - 34 CYS:HA
assign (resid 35  and  name  HN)(resid 34  and  name  HN) 2.3 0.5 0.5 !  35 PHE:HN - 34 CYS:HN
assign (resid 35  and  name  HN)(resid 34  and  name HB2) 2.7 0.9 0.9 !  35 PHE:HN - 34 CYS:HB2
assign (resid 35  and  name  HN)(resid 36  and  name  HN) 2.3 0.5 0.5 !  35 PHE:HN - 36 CYS:HN
assign (resid 35  and  name HB#)(resid 28  and  name HB#) 3.2 1.4 1.4 !  35 PHE:HB# - 28 LEU:HB#
assign (resid 35  and  name HB#)(resid 35  and  name  HA) 2.7 0.9 0.9 !  35 PHE:HB# - 35 PHE:HA
assign (resid 35  and  name HB#)(resid 35  and  name  HN) 2.6 0.8 0.8 !  35 PHE:HB# - 35 PHE:HN
assign (resid 35  and  name HB#)(resid 36  and  name  HN) 2.3 0.5 0.5 !  35 PHE:HB# - 36 CYS:HN
assign (resid 35  and  name HD#)(resid 28  and  name  HA) 3.5 1.7 1.7 !  35 PHE:HD# - 28 LEU:HA
assign (resid 35  and  name HD#)(resid 28  and  name HB#) 3.5 1.7 1.7 !  35 PHE:HD# - 28 LEU:HB#
assign (resid 35  and  name HD#)(resid 28  and  name HD#) 4.0 2.2 2.2 !  35 PHE:HD# - 28 LEU:HD#
assign (resid 35  and  name HD#)(resid 32  and  name HB#) 3.5 1.7 1.7 !  35 PHE:HD# - 32 GLN:HB#
assign (resid 35  and  name HD#)(resid 32  and  name HG#) 4.4 2.6 2.6 !  35 PHE:HD# - 32 GLN:HG#
assign (resid 35  and  name HD#)(resid 35  and  name  HA) 3.5 1.7 1.7 !  35 PHE:HD# - 35 PHE:HA
assign (resid 35  and  name HD#)(resid 35  and  name  HN) 3.5 1.7 1.7 !  35 PHE:HD# - 35 PHE:HN
assign (resid 35  and  name HD#)(resid 35  and  name HB#) 3.5 1.7 1.7 !  35 PHE:HD# - 35 PHE:HB#
assign (resid 35  and  name HD#)(resid 35  and  name HE#) 4.7 2.9 2.9 !  35 PHE:HD# - 35 PHE:HE#
assign (resid 35  and  name HD#)(resid 38  and  name HD#) 4.7 2.9 2.9 !  35 PHE:HD# - 38 TYR:HD#
assign (resid 35  and  name HD#)(resid 38  and  name HE#) 5.1 3.3 3.3 !  35 PHE:HD# - 38 TYR:HE#
assign (resid 35  and  name HD#)(resid 64  and  name HG#) 4.4 2.6 2.6 !  35 PHE:HD# - 64 VAL:HG#
assign (resid 35  and  name HD#)(resid 65  and  name HB#) 4.4 2.6 2.6 !  35 PHE:HD# - 65 PRO:HB#
assign (resid 35  and  name HD#)(resid 65  and  name HD#) 4.3 2.5 2.5 !  35 PHE:HD# - 65 PRO:HD#
assign (resid 35  and  name HD#)(resid 7   and  name HD#) 4.0 2.2 2.2 !  35 PHE:HD# - 7 LEU:HD#
assign (resid 35  and  name HE#)(resid 28  and  name  HA) 3.5 1.7 1.7 !  35 PHE:HE# - 28 LEU:HA
assign (resid 35  and  name HE#)(resid 28  and  name HB#) 3.9 2.1 2.1 !  35 PHE:HE# - 28 LEU:HB#
assign (resid 35  and  name HE#)(resid 28  and  name HD#) 4.0 2.2 2.2 !  35 PHE:HE# - 28 LEU:HD#
assign (resid 35  and  name HE#)(resid 32  and  name HB#) 3.5 1.7 1.7 !  35 PHE:HE# - 32 GLN:HB#
assign (resid 35  and  name HE#)(resid 32  and  name HG#) 4.0 2.2 2.2 !  35 PHE:HE# - 32 GLN:HG#
assign (resid 35  and  name HE#)(resid 35  and  name  HA) 3.9 2.1 2.1 !  35 PHE:HE# - 35 PHE:HA
assign (resid 35  and  name HE#)(resid 35  and  name HB#) 3.9 2.1 2.1 !  35 PHE:HE# - 35 PHE:HB#
assign (resid 35  and  name HE#)(resid 36  and  name HB#) 3.9 2.1 2.1 !  35 PHE:HE# - 36 CYS:HB#
assign (resid 35  and  name HE#)(resid 38  and  name HD#) 4.7 2.9 2.9 !  35 PHE:HE# - 38 TYR:HD#
assign (resid 35  and  name HE#)(resid 38  and  name HE#) 5.1 3.3 3.3 !  35 PHE:HE# - 38 TYR:HE#
assign (resid 35  and  name HE#)(resid 62  and  name  HG) 3.9 2.1 2.1 !  35 PHE:HE# - 62 LEU:HG
assign (resid 35  and  name HE#)(resid 65  and  name HB#) 4.4 2.6 2.6 !  35 PHE:HE# - 65 PRO:HB#
assign (resid 35  and  name HE#)(resid 7   and  name HD#) 4.0 2.2 2.2 !  35 PHE:HE# - 7 LEU:HD#
assign (resid 36  and  name  HA)(resid 36  and  name  HN) 3.1 1.3 1.3 !  36 CYS:HA - 36 CYS:HN
assign (resid 36  and  name  HA)(resid 37  and  name  HN) 3.1 1.3 1.3 !  36 CYS:HA - 37 GLN:HN
assign (resid 36  and  name  HN)(resid 37  and  name  HN) 2.3 0.5 0.5 !  36 CYS:HN - 37 GLN:HN
assign (resid 36  and  name HB#)(resid 36  and  name  HA) 2.7 0.9 0.9 !  36 CYS:HB# - 36 CYS:HA
assign (resid 36  and  name HB#)(resid 36  and  name  HN) 2.3 0.5 0.5 !  36 CYS:HB# - 36 CYS:HN
assign (resid 36  and  name HB#)(resid 37  and  name  HN) 2.7 0.9 0.9 !  36 CYS:HB# - 37 GLN:HN
assign (resid 37  and  name  HA)(resid 37  and  name  HN) 2.2 0.5 0.5 !  37 GLN:HA - 37 GLN:HN
assign (resid 37  and  name HB#)(resid 37  and  name  HA) 2.3 0.5 0.5 !  37 GLN:HB# - 37 GLN:HA
assign (resid 37  and  name HB#)(resid 37  and  name  HN) 2.3 0.5 0.5 !  37 GLN:HB# - 37 GLN:HN
assign (resid 37  and  name HE2#)(resid 34  and  name HB1) 2.7 0.9 0.9 !  37 GLN:HE2# - 34 CYS:HB1
assign (resid 37  and  name HG#)(resid 37  and  name  HA) 2.7 0.9 0.9 !  37 GLN:HG# - 37 GLN:HA
assign (resid 37  and  name HG#)(resid 37  and  name  HN) 2.7 0.9 0.9 !  37 GLN:HG# - 37 GLN:HN
assign (resid 38  and  name  HN)(resid 37  and  name  HA) 2.6 0.8 0.8 !  38 TYR:HN - 37 GLN:HA
assign (resid 38  and  name  HN)(resid 37  and  name  HN) 2.3 0.5 0.5 !  38 TYR:HN - 37 GLN:HN
assign (resid 38  and  name  HN)(resid 37  and  name HB#) 2.7 0.9 0.9 !  38 TYR:HN - 37 GLN:HB#
assign (resid 38  and  name  HN)(resid 39  and  name  HN) 2.3 0.5 0.5 !  38 TYR:HN - 39 ALA:HN
assign (resid 38  and  name HB#)(resid 38  and  name  HN) 2.6 0.8 0.8 !  38 TYR:HB# - 38 TYR:HN
assign (resid 38  and  name HB#)(resid 39  and  name  HN) 2.7 0.9 0.9 !  38 TYR:HB# - 39 ALA:HN
assign (resid 38  and  name HD#)(resid 35  and  name  HA) 3.5 1.7 1.7 !  38 TYR:HD# - 35 PHE:HA
assign (resid 38  and  name HD#)(resid 38  and  name  HN) 3.9 2.1 2.1 !  38 TYR:HD# - 38 TYR:HN
assign (resid 38  and  name HD#)(resid 38  and  name HB#) 3.9 2.1 2.1 !  38 TYR:HD# - 38 TYR:HB#
assign (resid 38  and  name HD#)(resid 4   and  name HB#) 4.4 2.6 2.6 !  38 TYR:HD# - 4 ALA:HB#
assign (resid 38  and  name HD#)(resid 48  and  name HD1#) 4.0 2.2 2.2 !  38 TYR:HD# - 48 ILE:HD1#
assign (resid 38  and  name HD#)(resid 7   and  name HD#) 4.4 2.6 2.6 !  38 TYR:HD# - 7 LEU:HD#
assign (resid 38  and  name HE#)(resid 2   and  name HB#) 3.5 1.7 1.7 !  38 TYR:HE# - 2 CYS:HB#
assign (resid 38  and  name HE#)(resid 31  and  name HB#) 3.9 2.1 2.1 !  38 TYR:HE# - 31 GLN:HB#
assign (resid 38  and  name HE#)(resid 34  and  name HB1) 3.9 2.1 2.1 !  38 TYR:HE# - 34 CYS:HB1
assign (resid 38  and  name HE#)(resid 34  and  name HB2) 3.5 1.7 1.7 !  38 TYR:HE# - 34 CYS:HB2
assign (resid 38  and  name HE#)(resid 35  and  name  HA) 3.9 2.1 2.1 !  38 TYR:HE# - 35 PHE:HA
assign (resid 38  and  name HE#)(resid 38  and  name HB#) 3.9 2.1 2.1 !  38 TYR:HE# - 38 TYR:HB#
assign (resid 38  and  name HE#)(resid 38  and  name HD#) 4.7 2.9 2.9 !  38 TYR:HE# - 38 TYR:HD#
assign (resid 38  and  name HE#)(resid 4   and  name  HA) 3.9 2.1 2.1 !  38 TYR:HE# - 4 ALA:HA
assign (resid 38  and  name HE#)(resid 4   and  name  HN) 3.9 2.1 2.1 !  38 TYR:HE# - 4 ALA:HN
assign (resid 38  and  name HE#)(resid 4   and  name HB#) 4.0 2.2 2.2 !  38 TYR:HE# - 4 ALA:HB#
assign (resid 38  and  name HE#)(resid 7   and  name  HG) 3.9 2.1 2.1 !  38 TYR:HE# - 7 LEU:HG
assign (resid 38  and  name HE#)(resid 7   and  name HD#) 4.4 2.6 2.6 !  38 TYR:HE# - 7 LEU:HD#
assign (resid 39  and  name  HA)(resid 39  and  name  HN) 2.2 0.5 0.5 !  39 ALA:HA - 39 ALA:HN
assign (resid 39  and  name  HA)(resid 40  and  name  HN) 2.6 0.8 0.8 !  39 ALA:HA - 40 LYS:HN
assign (resid 39  and  name  HN)(resid 37  and  name  HN) 3.0 1.2 1.2 !  39 ALA:HN - 37 GLN:HN
assign (resid 39  and  name  HN)(resid 40  and  name  HN) 2.3 0.5 0.5 !  39 ALA:HN - 40 LYS:HN
assign (resid 39  and  name HB#)(resid 39  and  name  HA) 2.8 1.0 1.0 !  39 ALA:HB# - 39 ALA:HA
assign (resid 39  and  name HB#)(resid 39  and  name  HN) 2.8 1.0 1.0 !  39 ALA:HB# - 39 ALA:HN
assign (resid 39  and  name HB#)(resid 40  and  name HB#) 2.8 1.0 1.0 !  39 ALA:HB# - 40 LYS:HB#
assign (resid 4   and  name  HA)(resid 4   and  name  HN) 2.3 0.5 0.5 !  4 ALA:HA - 4 ALA:HN
assign (resid 4   and  name HB#)(resid 4   and  name  HN) 2.8 1.0 1.0 !  4 ALA:HB# - 4 ALA:HN
assign (resid 40  and  name  HA)(resid 40  and  name  HN) 2.7 0.9 0.9 !  40 LYS:HA - 40 LYS:HN
assign (resid 40  and  name  HA)(resid 41  and  name  HN) 2.6 0.8 0.8 !  40 LYS:HA - 41 ASP:HN
assign (resid 40  and  name  HN)(resid 41  and  name  HN) 2.3 0.5 0.5 !  40 LYS:HN - 41 ASP:HN
assign (resid 40  and  name  HN)(resid 41  and  name HB1) 3.1 1.3 1.3 !  40 LYS:HN - 41 ASP:HB1
assign (resid 40  and  name HB#)(resid 40  and  name  HA) 2.3 0.5 0.5 !  40 LYS:HB# - 40 LYS:HA
assign (resid 40  and  name HB#)(resid 40  and  name  HN) 2.3 0.5 0.5 !  40 LYS:HB# - 40 LYS:HN
assign (resid 40  and  name HB#)(resid 40  and  name HE#) 3.6 1.8 1.8 !  40 LYS:HB# - 40 LYS:HE#
assign (resid 40  and  name HB#)(resid 41  and  name  HN) 2.7 0.9 0.9 !  40 LYS:HB# - 41 ASP:HN
assign (resid 40  and  name HE#)(resid 40  and  name  HA) 3.2 1.4 1.4 !  40 LYS:HE# - 40 LYS:HA
assign (resid 40  and  name HE#)(resid 40  and  name  HN) 3.2 1.4 1.4 !  40 LYS:HE# - 40 LYS:HN
assign (resid 40  and  name HG#)(resid 40  and  name  HA) 2.3 0.5 0.5 !  40 LYS:HG# - 40 LYS:HA
assign (resid 40  and  name HG#)(resid 40  and  name HE#) 3.2 1.4 1.4 !  40 LYS:HG# - 40 LYS:HE#
assign (resid 41  and  name  HA)(resid 41  and  name  HN) 2.7 0.9 0.9 !  41 ASP:HA - 41 ASP:HN
assign (resid 41  and  name HB1)(resid 41  and  name  HA) 2.7 0.9 0.9 !  41 ASP:HB1 - 41 ASP:HA
assign (resid 41  and  name HB1)(resid 41  and  name  HN) 2.3 0.5 0.5 !  41 ASP:HB1 - 41 ASP:HN
assign (resid 41  and  name HB2)(resid 41  and  name  HA) 2.7 0.9 0.9 !  41 ASP:HB2 - 41 ASP:HA
assign (resid 41  and  name HB2)(resid 41  and  name  HN) 2.3 0.5 0.5 !  41 ASP:HB2 - 41 ASP:HN
assign (resid 41  and  name HB2)(resid 41  and  name HB1) 2.3 0.5 0.5 !  41 ASP:HB2 - 41 ASP:HB1
assign (resid 42  and  name  HA)(resid 43  and  name  HN) 2.7 0.9 0.9 !  42 PRO:HA - 43 THR:HN
assign (resid 42  and  name  HA)(resid 45  and  name  HN) 3.2 1.4 1.4 !  42 PRO:HA - 45 GLY:HN
assign (resid 42  and  name HB#)(resid 42  and  name  HA) 2.8 1.0 1.0 !  42 PRO:HB# - 42 PRO:HA
assign (resid 42  and  name HB#)(resid 42  and  name HD#) 3.2 1.4 1.4 !  42 PRO:HB# - 42 PRO:HD#
assign (resid 42  and  name HD#)(resid 41  and  name  HA) 2.3 0.5 0.5 !  42 PRO:HD# - 41 ASP:HA
assign (resid 42  and  name HD#)(resid 42  and  name  HA) 2.7 0.9 0.9 !  42 PRO:HD# - 42 PRO:HA
assign (resid 42  and  name HG#)(resid 41  and  name  HA) 3.2 1.4 1.4 !  42 PRO:HG# - 41 ASP:HA
assign (resid 42  and  name HG#)(resid 42  and  name  HA) 2.8 1.0 1.0 !  42 PRO:HG# - 42 PRO:HA
assign (resid 42  and  name HG#)(resid 42  and  name HB#) 3.3 1.5 1.5 !  42 PRO:HG# - 42 PRO:HB#
assign (resid 42  and  name HG#)(resid 42  and  name HD#) 2.8 1.0 1.0 !  42 PRO:HG# - 42 PRO:HD#
assign (resid 42  and  name HG#)(resid 43  and  name  HN) 3.2 1.4 1.4 !  42 PRO:HG# - 43 THR:HN
assign (resid 43  and  name  HA)(resid 43  and  name  HN) 2.3 0.5 0.5 !  43 THR:HA - 43 THR:HN
assign (resid 43  and  name  HB)(resid 43  and  name  HA) 2.3 0.5 0.5 !  43 THR:HB - 43 THR:HA
assign (resid 43  and  name  HB)(resid 43  and  name  HN) 2.7 0.9 0.9 !  43 THR:HB - 43 THR:HN
assign (resid 43  and  name HG1)(resid 43  and  name  HA) 2.8 1.0 1.0 !  43 THR:HG1 - 43 THR:HA
assign (resid 43  and  name HG1)(resid 43  and  name  HB) 2.8 1.0 1.0 !  43 THR:HG1 - 43 THR:HB
assign (resid 43  and  name HG1)(resid 43  and  name  HN) 3.2 1.4 1.4 !  43 THR:HG1 - 43 THR:HN
assign (resid 44  and  name  HA)(resid 44  and  name  HN) 3.1 1.3 1.3 !  44 TYR:HA - 44 TYR:HN
assign (resid 44  and  name  HN)(resid 43  and  name  HA) 2.7 0.9 0.9 !  44 TYR:HN - 43 THR:HA
assign (resid 44  and  name  HN)(resid 43  and  name  HB) 2.7 0.9 0.9 !  44 TYR:HN - 43 THR:HB
assign (resid 44  and  name  HN)(resid 43  and  name  HN) 2.7 0.9 0.9 !  44 TYR:HN - 43 THR:HN
assign (resid 44  and  name  HN)(resid 43  and  name HG1) 3.6 1.8 1.8 !  44 TYR:HN - 43 THR:HG1
assign (resid 44  and  name HB#)(resid 44  and  name  HA) 2.7 0.9 0.9 !  44 TYR:HB# - 44 TYR:HA
assign (resid 44  and  name HB#)(resid 44  and  name  HN) 2.7 0.9 0.9 !  44 TYR:HB# - 44 TYR:HN
assign (resid 44  and  name HD#)(resid 41  and  name HB1) 3.5 1.7 1.7 !  44 TYR:HD# - 41 ASP:HB1
assign (resid 44  and  name HD#)(resid 43  and  name  HB) 3.9 2.1 2.1 !  44 TYR:HD# - 43 THR:HB
assign (resid 44  and  name HD#)(resid 43  and  name HG1) 4.4 2.6 2.6 !  44 TYR:HD# - 43 THR:HG1
assign (resid 44  and  name HD#)(resid 44  and  name  HA) 3.9 2.1 2.1 !  44 TYR:HD# - 44 TYR:HA
assign (resid 44  and  name HD#)(resid 44  and  name  HN) 3.9 2.1 2.1 !  44 TYR:HD# - 44 TYR:HN
assign (resid 44  and  name HD#)(resid 44  and  name HB#) 3.5 1.7 1.7 !  44 TYR:HD# - 44 TYR:HB#
assign (resid 44  and  name HD#)(resid 47  and  name HD#) 4.7 2.9 2.9 !  44 TYR:HD# - 47 TYR:HD#
assign (resid 44  and  name HE#)(resid 4   and  name HB#) 4.0 2.2 2.2 !  44 TYR:HE# - 4 ALA:HB#
assign (resid 44  and  name HE#)(resid 41  and  name HB1) 3.9 2.1 2.1 !  44 TYR:HE# - 41 ASP:HB1
assign (resid 44  and  name HE#)(resid 41  and  name HB2) 3.9 2.1 2.1 !  44 TYR:HE# - 41 ASP:HB2
assign (resid 44  and  name HE#)(resid 43  and  name  HB) 3.9 2.1 2.1 !  44 TYR:HE# - 43 THR:HB
assign (resid 44  and  name HE#)(resid 43  and  name HG1) 4.4 2.6 2.6 !  44 TYR:HE# - 43 THR:HG1
assign (resid 44  and  name HE#)(resid 44  and  name HD#) 4.7 2.9 2.9 !  44 TYR:HE# - 44 TYR:HD#
assign (resid 45  and  name  HN)(resid 44  and  name  HN) 2.3 0.5 0.5 !  45 GLY:HN - 44 TYR:HN
assign (resid 45  and  name  HN)(resid 44  and  name HB#) 2.7 0.9 0.9 !  45 GLY:HN - 44 TYR:HB#
assign (resid 45  and  name  HN)(resid 46  and  name  HN) 2.7 0.9 0.9 !  45 GLY:HN - 46 GLN:HN
assign (resid 45  and  name HA#)(resid 45  and  name  HN) 2.3 0.5 0.5 !  45 GLY:HA# - 45 GLY:HN
assign (resid 45  and  name HA#)(resid 46  and  name  HN) 2.7 0.9 0.9 !  45 GLY:HA# - 46 GLN:HN
assign (resid 46  and  name  HA)(resid 46  and  name  HN) 2.3 0.5 0.5 !  46 GLN:HA - 46 GLN:HN
assign (resid 46  and  name  HA)(resid 47  and  name  HN) 2.7 0.9 0.9 !  46 GLN:HA - 47 TYR:HN
assign (resid 46  and  name  HN)(resid 47  and  name  HN) 2.3 0.5 0.5 !  46 GLN:HN - 47 TYR:HN
assign (resid 46  and  name HB#)(resid 46  and  name  HA) 2.3 0.5 0.5 !  46 GLN:HB# - 46 GLN:HA
assign (resid 46  and  name HB#)(resid 46  and  name  HN) 2.3 0.5 0.5 !  46 GLN:HB# - 46 GLN:HN
assign (resid 46  and  name HB#)(resid 46  and  name HG#) 2.8 1.0 1.0 !  46 GLN:HB# - 46 GLN:HG#
assign (resid 46  and  name HB#)(resid 47  and  name  HN) 2.7 0.9 0.9 !  46 GLN:HB# - 47 TYR:HN
assign (resid 46  and  name HE21)(resid 46  and  name HE22) 2.3 0.5 0.5 !  46 GLN:HE21 - 46 GLN:HE22
assign (resid 46  and  name HE21)(resid 46  and  name HG#) 3.2 1.4 1.4 !  46 GLN:HE21 - 46 GLN:HG#
assign (resid 46  and  name HE22)(resid 46  and  name HG#) 3.2 1.4 1.4 !  46 GLN:HE22 - 46 GLN:HG#
assign (resid 46  and  name HG#)(resid 46  and  name  HA) 3.2 1.4 1.4 !  46 GLN:HG# - 46 GLN:HA
assign (resid 46  and  name HG#)(resid 46  and  name  HN) 3.2 1.4 1.4 !  46 GLN:HG# - 46 GLN:HN
assign (resid 46  and  name HG#)(resid 47  and  name  HN) 3.2 1.4 1.4 !  46 GLN:HG# - 47 TYR:HN
assign (resid 47  and  name  HA)(resid 47  and  name  HN) 2.7 0.9 0.9 !  47 TYR:HA - 47 TYR:HN
assign (resid 47  and  name HB1)(resid 47  and  name  HA) 2.3 0.5 0.5 !  47 TYR:HB1 - 47 TYR:HA
assign (resid 47  and  name HB1)(resid 47  and  name  HN) 2.7 0.9 0.9 !  47 TYR:HB1 - 47 TYR:HN
assign (resid 47  and  name HB1)(resid 47  and  name HB2) 2.3 0.5 0.5 !  47 TYR:HB1 - 47 TYR:HB2
assign (resid 47  and  name HB2)(resid 47  and  name  HA) 2.7 0.9 0.9 !  47 TYR:HB2 - 47 TYR:HA
assign (resid 47  and  name HB2)(resid 47  and  name  HN) 2.3 0.5 0.5 !  47 TYR:HB2 - 47 TYR:HN
assign (resid 47  and  name HD#)(resid 11  and  name  HA) 3.9 2.1 2.1 !  47 TYR:HD# - 11 ALA:HA
assign (resid 47  and  name HD#)(resid 11  and  name HB#) 4.4 2.6 2.6 !  47 TYR:HD# - 11 ALA:HB#
assign (resid 47  and  name HD#)(resid 14  and  name HD1#) 4.0 2.2 2.2 !  47 TYR:HD# - 14 ILE:HD1#
assign (resid 47  and  name HD#)(resid 14  and  name HG1#) 4.0 2.2 2.2 !  47 TYR:HD# - 14 ILE:HG1#
assign (resid 47  and  name HD#)(resid 15  and  name  HG) 3.5 1.7 1.7 !  47 TYR:HD# - 15 LEU:HG
assign (resid 47  and  name HD#)(resid 15  and  name HD#) 4.0 2.2 2.2 !  47 TYR:HD# - 15 LEU:HD#
assign (resid 47  and  name HD#)(resid 44  and  name  HA) 3.9 2.1 2.1 !  47 TYR:HD# - 44 TYR:HA
assign (resid 47  and  name HD#)(resid 44  and  name HB#) 3.9 2.1 2.1 !  47 TYR:HD# - 44 TYR:HB#
assign (resid 47  and  name HD#)(resid 46  and  name  HN) 3.9 2.1 2.1 !  47 TYR:HD# - 46 GLN:HN
assign (resid 47  and  name HD#)(resid 46  and  name HG#) 4.4 2.6 2.6 !  47 TYR:HD# - 46 GLN:HG#
assign (resid 47  and  name HD#)(resid 47  and  name  HA) 3.5 1.7 1.7 !  47 TYR:HD# - 47 TYR:HA
assign (resid 47  and  name HD#)(resid 47  and  name  HN) 3.5 1.7 1.7 !  47 TYR:HD# - 47 TYR:HN
assign (resid 47  and  name HD#)(resid 47  and  name HB1) 3.5 1.7 1.7 !  47 TYR:HD# - 47 TYR:HB1
assign (resid 47  and  name HD#)(resid 47  and  name HB2) 3.5 1.7 1.7 !  47 TYR:HD# - 47 TYR:HB2
assign (resid 47  and  name HE#)(resid 11  and  name  HA) 3.5 1.7 1.7 !  47 TYR:HE# - 11 ALA:HA
assign (resid 47  and  name HE#)(resid 11  and  name HB#) 4.0 2.2 2.2 !  47 TYR:HE# - 11 ALA:HB#
assign (resid 47  and  name HE#)(resid 14  and  name HG1#) 4.4 2.6 2.6 !  47 TYR:HE# - 14 ILE:HG1#
assign (resid 47  and  name HE#)(resid 15  and  name  HG) 3.5 1.7 1.7 !  47 TYR:HE# - 15 LEU:HG
assign (resid 47  and  name HE#)(resid 15  and  name HD#) 4.4 2.6 2.6 !  47 TYR:HE# - 15 LEU:HD#
assign (resid 47  and  name HE#)(resid 47  and  name HD#) 4.7 2.9 2.9 !  47 TYR:HE# - 47 TYR:HD#
assign (resid 48  and  name  HA)(resid 48  and  name  HN) 2.3 0.5 0.5 !  48 ILE:HA - 48 ILE:HN
assign (resid 48  and  name  HA)(resid 49  and  name  HN) 2.7 0.9 0.9 !  48 ILE:HA - 49 ARG:HN
assign (resid 48  and  name  HA)(resid 50  and  name  HN) 2.7 0.9 0.9 !  48 ILE:HA - 50 SER:HN
assign (resid 48  and  name  HB)(resid 48  and  name  HA) 2.7 0.9 0.9 !  48 ILE:HB - 48 ILE:HA
assign (resid 48  and  name  HB)(resid 48  and  name  HN) 2.7 0.9 0.9 !  48 ILE:HB - 48 ILE:HN
assign (resid 48  and  name  HN)(resid 47  and  name  HA) 2.7 0.9 0.9 !  48 ILE:HN - 47 TYR:HA
assign (resid 48  and  name  HN)(resid 47  and  name  HN) 2.3 0.5 0.5 !  48 ILE:HN - 47 TYR:HN
assign (resid 48  and  name  HN)(resid 47  and  name HB1) 2.7 0.9 0.9 !  48 ILE:HN - 47 TYR:HB1
assign (resid 48  and  name  HN)(resid 47  and  name HB2) 2.7 0.9 0.9 !  48 ILE:HN - 47 TYR:HB2
assign (resid 48  and  name  HN)(resid 49  and  name  HN) 2.7 0.9 0.9 !  48 ILE:HN - 49 ARG:HN
assign (resid 48  and  name HD1#)(resid 39  and  name  HN) 3.9 2.1 2.1 !  48 ILE:HD1# - 39 ALA:HN
assign (resid 48  and  name HD1#)(resid 39  and  name HB#) 3.4 1.6 1.6 !  48 ILE:HD1# - 39 ALA:HB#
assign (resid 48  and  name HD1#)(resid 47  and  name HB1) 3.2 1.4 1.4 !  48 ILE:HD1# - 47 TYR:HB1
assign (resid 48  and  name HD1#)(resid 48  and  name  HA) 2.8 1.0 1.0 !  48 ILE:HD1# - 48 ILE:HA
assign (resid 48  and  name HD1#)(resid 48  and  name  HB) 2.8 1.0 1.0 !  48 ILE:HD1# - 48 ILE:HB
assign (resid 48  and  name HD1#)(resid 48  and  name  HN) 3.2 1.4 1.4 !  48 ILE:HD1# - 48 ILE:HN
assign (resid 48  and  name HD1#)(resid 48  and  name HG2#) 3.3 1.5 1.5 !  48 ILE:HD1# - 48 ILE:HG2#
assign (resid 48  and  name HD1#)(resid 48  and  name HG2#) 3.3 1.5 1.5 !  48 ILE:HD1# - 48 ILE:HG2#
assign (resid 48  and  name HG2#)(resid 39  and  name  HN) 3.4 1.6 1.6 !  48 ILE:HG2# - 39 ALA:HN
assign (resid 48  and  name HG2#)(resid 39  and  name HB#) 3.4 1.6 1.6 !  48 ILE:HG2# - 39 ALA:HB#
assign (resid 48  and  name HG2#)(resid 48  and  name  HA) 2.8 1.0 1.0 !  48 ILE:HG2# - 48 ILE:HA
assign (resid 48  and  name HG2#)(resid 48  and  name  HA) 3.2 1.4 1.4 !  48 ILE:HG2# - 48 ILE:HA
assign (resid 48  and  name HG2#)(resid 48  and  name  HB) 2.8 1.0 1.0 !  48 ILE:HG2# - 48 ILE:HB
assign (resid 48  and  name HG2#)(resid 48  and  name  HB) 2.8 1.0 1.0 !  48 ILE:HG2# - 48 ILE:HB
assign (resid 48  and  name HG2#)(resid 48  and  name  HN) 2.8 1.0 1.0 !  48 ILE:HG2# - 48 ILE:HN
assign (resid 48  and  name HG2#)(resid 48  and  name  HN) 3.2 1.4 1.4 !  48 ILE:HG2# - 48 ILE:HN
assign (resid 49  and  name  HA)(resid 49  and  name  HN) 2.7 0.9 0.9 !  49 ARG:HA - 49 ARG:HN
assign (resid 49  and  name  HE)(resid 49  and  name HD#) 2.3 0.5 0.5 !  49 ARG:HE - 49 ARG:HD#
assign (resid 49  and  name  HE)(resid 49  and  name HG#) 2.7 0.9 0.9 !  49 ARG:HE - 49 ARG:HG#
assign (resid 49  and  name HB#)(resid 49  and  name  HA) 2.8 1.0 1.0 !  49 ARG:HB# - 49 ARG:HA
assign (resid 49  and  name HB#)(resid 49  and  name  HN) 3.2 1.4 1.4 !  49 ARG:HB# - 49 ARG:HN
assign (resid 49  and  name HB#)(resid 49  and  name HD#) 3.2 1.4 1.4 !  49 ARG:HB# - 49 ARG:HD#
assign (resid 49  and  name HD#)(resid 49  and  name  HA) 3.1 1.3 1.3 !  49 ARG:HD# - 49 ARG:HA
assign (resid 49  and  name HD#)(resid 49  and  name  HN) 3.1 1.3 1.3 !  49 ARG:HD# - 49 ARG:HN
assign (resid 49  and  name HG#)(resid 49  and  name  HA) 2.3 0.5 0.5 !  49 ARG:HG# - 49 ARG:HA
assign (resid 49  and  name HG#)(resid 49  and  name  HN) 2.3 0.5 0.5 !  49 ARG:HG# - 49 ARG:HN
assign (resid 49  and  name HG#)(resid 49  and  name HB#) 2.8 1.0 1.0 !  49 ARG:HG# - 49 ARG:HB#
assign (resid 49  and  name HG#)(resid 49  and  name HD#) 2.7 0.9 0.9 !  49 ARG:HG# - 49 ARG:HD#
assign (resid 5   and  name  HN)(resid 4   and  name  HA) 2.7 0.9 0.9 !  5 SER:HN - 4 ALA:HA
assign (resid 5   and  name  HN)(resid 4   and  name  HN) 2.3 0.5 0.5 !  5 SER:HN - 4 ALA:HN
assign (resid 5   and  name  HN)(resid 4   and  name HB#) 2.8 1.0 1.0 !  5 SER:HN - 4 ALA:HB#
assign (resid 5   and  name  HN)(resid 6   and  name  HN) 2.3 0.5 0.5 !  5 SER:HN - 6 GLN:HN
assign (resid 5   and  name HB#)(resid 5   and  name  HN) 2.7 0.9 0.9 !  5 SER:HB# - 5 SER:HN
assign (resid 5   and  name HB#)(resid 6   and  name  HN) 2.7 0.9 0.9 !  5 SER:HB# - 6 GLN:HN
assign (resid 50  and  name  HA)(resid 50  and  name  HN) 3.1 1.3 1.3 !  50 SER:HA - 50 SER:HN
assign (resid 50  and  name  HN)(resid 49  and  name  HA) 2.3 0.5 0.5 !  50 SER:HN - 49 ARG:HA
assign (resid 50  and  name  HN)(resid 49  and  name  HN) 2.7 0.9 0.9 !  50 SER:HN - 49 ARG:HN
assign (resid 50  and  name HB1)(resid 50  and  name  HA) 2.3 0.5 0.5 !  50 SER:HB1 - 50 SER:HA
assign (resid 50  and  name HB1)(resid 50  and  name  HN) 2.3 0.5 0.5 !  50 SER:HB1 - 50 SER:HN
assign (resid 50  and  name HB2)(resid 50  and  name  HA) 2.7 0.9 0.9 !  50 SER:HB2 - 50 SER:HA
assign (resid 50  and  name HB2)(resid 50  and  name  HN) 2.3 0.5 0.5 !  50 SER:HB2 - 50 SER:HN
assign (resid 50  and  name HB2)(resid 50  and  name HB1) 2.3 0.5 0.5 !  50 SER:HB2 - 50 SER:HB1
assign (resid 51  and  name  HA)(resid 52  and  name  HN) 2.7 0.9 0.9 !  51 PRO:HA - 52 HIS:HN
assign (resid 51  and  name HB#)(resid 51  and  name  HA) 2.8 1.0 1.0 !  51 PRO:HB# - 51 PRO:HA
assign (resid 51  and  name HB#)(resid 51  and  name HD#) 3.2 1.4 1.4 !  51 PRO:HB# - 51 PRO:HD#
assign (resid 51  and  name HB#)(resid 52  and  name  HN) 3.2 1.4 1.4 !  51 PRO:HB# - 52 HIS:HN
assign (resid 51  and  name HD#)(resid 50  and  name  HA) 2.7 0.9 0.9 !  51 PRO:HD# - 50 SER:HA
assign (resid 51  and  name HD#)(resid 51  and  name  HA) 3.1 1.3 1.3 !  51 PRO:HD# - 51 PRO:HA
assign (resid 51  and  name HD#)(resid 52  and  name  HN) 2.7 0.9 0.9 !  51 PRO:HD# - 52 HIS:HN
assign (resid 51  and  name HG#)(resid 51  and  name  HA) 2.7 0.9 0.9 !  51 PRO:HG# - 51 PRO:HA
assign (resid 51  and  name HG#)(resid 51  and  name HB#) 2.8 1.0 1.0 !  51 PRO:HG# - 51 PRO:HB#
assign (resid 51  and  name HG#)(resid 51  and  name HD#) 2.7 0.9 0.9 !  51 PRO:HG# - 51 PRO:HD#
assign (resid 51  and  name HG#)(resid 52  and  name  HN) 2.7 0.9 0.9 !  51 PRO:HG# - 52 HIS:HN
assign (resid 52  and  name  HA)(resid 52  and  name  HN) 2.7 0.9 0.9 !  52 HIS:HA - 52 HIS:HN
assign (resid 52  and  name  HA)(resid 55  and  name  HN) 2.7 0.9 0.9 !  52 HIS:HA - 55 ASP:HN
assign (resid 52  and  name  HA)(resid 55  and  name HB1) 2.7 0.9 0.9 !  52 HIS:HA - 55 ASP:HB1
assign (resid 52  and  name  HA)(resid 55  and  name HB2) 2.7 0.9 0.9 !  52 HIS:HA - 55 ASP:HB2
assign (resid 52  and  name HB#)(resid 14  and  name  HA) 2.7 0.9 0.9 !  52 HIS:HB# - 14 ILE:HA
assign (resid 52  and  name HB#)(resid 52  and  name  HA) 2.7 0.9 0.9 !  52 HIS:HB# - 52 HIS:HA
assign (resid 52  and  name HB#)(resid 52  and  name  HN) 2.6 0.8 0.8 !  52 HIS:HB# - 52 HIS:HN
assign (resid 52  and  name HD2)(resid 51  and  name HD#) 2.7 0.9 0.9 !  52 HIS:HD2 - 51 PRO:HD#
assign (resid 52  and  name HD2)(resid 51  and  name HG#) 2.7 0.9 0.9 !  52 HIS:HD2 - 51 PRO:HG#
assign (resid 52  and  name HD2)(resid 52  and  name  HN) 2.7 0.9 0.9 !  52 HIS:HD2 - 52 HIS:HN
assign (resid 52  and  name HD2)(resid 52  and  name HB#) 2.7 0.9 0.9 !  52 HIS:HD2 - 52 HIS:HB#
assign (resid 52  and  name HD2)(resid 52  and  name HE1) 3.1 1.3 1.3 !  52 HIS:HD2 - 52 HIS:HE1
assign (resid 52  and  name HE1)(resid 51  and  name HG#) 2.7 0.9 0.9 !  52 HIS:HE1 - 51 PRO:HG#
assign (resid 53  and  name  HA)(resid 14  and  name HG1#) 2.3 0.5 0.5 !  53 ALA:HA - 14 ILE:HG1#
assign (resid 53  and  name  HA)(resid 53  and  name  HN) 2.2 0.5 0.5 !  53 ALA:HA - 53 ALA:HN
assign (resid 53  and  name  HA)(resid 54  and  name  HN) 2.6 0.8 0.8 !  53 ALA:HA - 54 ARG:HN
assign (resid 53  and  name  HA)(resid 56  and  name  HN) 2.7 0.9 0.9 !  53 ALA:HA - 56 THR:HN
assign (resid 53  and  name  HA)(resid 56  and  name HG1) 2.8 1.0 1.0 !  53 ALA:HA - 56 THR:HG1
assign (resid 53  and  name  HN)(resid 52  and  name  HA) 2.6 0.8 0.8 !  53 ALA:HN - 52 HIS:HA
assign (resid 53  and  name  HN)(resid 54  and  name  HN) 2.3 0.5 0.5 !  53 ALA:HN - 54 ARG:HN
assign (resid 53  and  name HB#)(resid 14  and  name HG1#) 2.8 1.0 1.0 !  53 ALA:HB# - 14 ILE:HG1#
assign (resid 53  and  name HB#)(resid 47  and  name  HA) 3.5 1.5 1.5 !  53 ALA:HB# - 47 TYR:HA
assign (resid 53  and  name HB#)(resid 48  and  name  HA) 3.2 1.4 1.4 !  53 ALA:HB# - 48 ILE:HA
assign (resid 53  and  name HB#)(resid 53  and  name  HA) 2.8 1.0 1.0 !  53 ALA:HB# - 53 ALA:HA
assign (resid 53  and  name HB#)(resid 53  and  name  HN) 2.8 1.0 1.0 !  53 ALA:HB# - 53 ALA:HN
assign (resid 53  and  name HB#)(resid 54  and  name  HN) 2.8 1.0 1.0 !  53 ALA:HB# - 54 ARG:HN
assign (resid 54  and  name  HA)(resid 54  and  name  HN) 2.2 0.5 0.5 !  54 ARG:HA - 54 ARG:HN
assign (resid 54  and  name  HA)(resid 55  and  name  HN) 2.6 0.8 0.8 !  54 ARG:HA - 55 ASP:HN
assign (resid 54  and  name  HA)(resid 64  and  name HG#) 3.2 1.4 1.4 !  54 ARG:HA - 64 VAL:HG#
assign (resid 54  and  name  HE)(resid 54  and  name  HN) 3.1 1.3 1.3 !  54 ARG:HE - 54 ARG:HN
assign (resid 54  and  name  HN)(resid 55  and  name  HN) 2.7 0.9 0.9 !  54 ARG:HN - 55 ASP:HN
assign (resid 54  and  name HB#)(resid 54  and  name  HA) 2.8 1.0 1.0 !  54 ARG:HB# - 54 ARG:HA
assign (resid 54  and  name HB#)(resid 54  and  name  HE) 2.8 1.0 1.0 !  54 ARG:HB# - 54 ARG:HE
assign (resid 54  and  name HB#)(resid 54  and  name  HN) 2.8 1.0 1.0 !  54 ARG:HB# - 54 ARG:HN
assign (resid 54  and  name HB#)(resid 54  and  name HD#) 3.3 1.5 1.5 !  54 ARG:HB# - 54 ARG:HD#
assign (resid 54  and  name HB#)(resid 55  and  name  HN) 2.8 1.0 1.0 !  54 ARG:HB# - 55 ASP:HN
assign (resid 54  and  name HD#)(resid 54  and  name  HA) 3.2 1.4 1.4 !  54 ARG:HD# - 54 ARG:HA
assign (resid 54  and  name HD#)(resid 54  and  name  HE) 2.8 1.0 1.0 !  54 ARG:HD# - 54 ARG:HE
assign (resid 54  and  name HD#)(resid 54  and  name  HN) 3.2 1.4 1.4 !  54 ARG:HD# - 54 ARG:HN
assign (resid 54  and  name HG#)(resid 54  and  name  HA) 2.3 0.5 0.5 !  54 ARG:HG# - 54 ARG:HA
assign (resid 54  and  name HG#)(resid 54  and  name  HE) 2.7 0.9 0.9 !  54 ARG:HG# - 54 ARG:HE
assign (resid 54  and  name HG#)(resid 54  and  name  HN) 2.7 0.9 0.9 !  54 ARG:HG# - 54 ARG:HN
assign (resid 54  and  name HG#)(resid 54  and  name HB#) 2.8 1.0 1.0 !  54 ARG:HG# - 54 ARG:HB#
assign (resid 54  and  name HG#)(resid 54  and  name HD#) 2.8 1.0 1.0 !  54 ARG:HG# - 54 ARG:HD#
assign (resid 55  and  name  HA)(resid 55  and  name  HN) 2.3 0.5 0.5 !  55 ASP:HA - 55 ASP:HN
assign (resid 55  and  name  HA)(resid 56  and  name  HN) 2.6 0.8 0.8 !  55 ASP:HA - 56 THR:HN
assign (resid 55  and  name  HA)(resid 58  and  name  HB) 2.6 0.8 0.8 !  55 ASP:HA - 58 THR:HB
assign (resid 55  and  name  HA)(resid 58  and  name  HN) 2.7 0.9 0.9 !  55 ASP:HA - 58 THR:HN
assign (resid 55  and  name  HA)(resid 58  and  name HG1) 3.2 1.4 1.4 !  55 ASP:HA - 58 THR:HG1
assign (resid 55  and  name  HN)(resid 56  and  name  HN) 2.3 0.5 0.5 !  55 ASP:HN - 56 THR:HN
assign (resid 55  and  name HB1)(resid 55  and  name  HA) 2.3 0.5 0.5 !  55 ASP:HB1 - 55 ASP:HA
assign (resid 55  and  name HB1)(resid 55  and  name  HN) 2.6 0.8 0.8 !  55 ASP:HB1 - 55 ASP:HN
assign (resid 55  and  name HB2)(resid 55  and  name  HA) 2.7 0.9 0.9 !  55 ASP:HB2 - 55 ASP:HA
assign (resid 55  and  name HB2)(resid 55  and  name  HN) 2.3 0.5 0.5 !  55 ASP:HB2 - 55 ASP:HN
assign (resid 55  and  name HB2)(resid 55  and  name HB1) 2.3 0.5 0.5 !  55 ASP:HB2 - 55 ASP:HB1
assign (resid 55  and  name HB2)(resid 56  and  name  HN) 2.7 0.9 0.9 !  55 ASP:HB2 - 56 THR:HN
assign (resid 56  and  name  HA)(resid 56  and  name  HB) 2.3 0.5 0.5 !  56 THR:HA - 56 THR:HB
assign (resid 56  and  name  HA)(resid 56  and  name  HN) 2.2 0.5 0.5 !  56 THR:HA - 56 THR:HN
assign (resid 56  and  name  HB)(resid 56  and  name  HN) 2.3 0.5 0.5 !  56 THR:HB - 56 THR:HN
assign (resid 56  and  name HG1)(resid 56  and  name  HA) 2.8 1.0 1.0 !  56 THR:HG1 - 56 THR:HA
assign (resid 56  and  name HG1)(resid 56  and  name  HB) 2.8 1.0 1.0 !  56 THR:HG1 - 56 THR:HB
assign (resid 56  and  name HG1)(resid 56  and  name  HN) 3.2 1.4 1.4 !  56 THR:HG1 - 56 THR:HN
assign (resid 57  and  name  HA)(resid 57  and  name  HN) 2.2 0.5 0.5 !  57 LEU:HA - 57 LEU:HN
assign (resid 57  and  name  HA)(resid 58  and  name  HN) 2.6 0.8 0.8 !  57 LEU:HA - 58 THR:HN
assign (resid 57  and  name  HA)(resid 60  and  name  HN) 2.7 0.9 0.9 !  57 LEU:HA - 60 CYS:HN
assign (resid 57  and  name  HA)(resid 60  and  name HB1) 2.7 0.9 0.9 !  57 LEU:HA - 60 CYS:HB1
assign (resid 57  and  name  HA)(resid 60  and  name HB2) 2.7 0.9 0.9 !  57 LEU:HA - 60 CYS:HB2
assign (resid 57  and  name  HA)(resid 62  and  name HD#) 3.2 1.4 1.4 !  57 LEU:HA - 62 LEU:HD#
assign (resid 57  and  name  HG)(resid 57  and  name  HA) 2.3 0.5 0.5 !  57 LEU:HG - 57 LEU:HA
assign (resid 57  and  name  HG)(resid 57  and  name  HN) 2.7 0.9 0.9 !  57 LEU:HG - 57 LEU:HN
assign (resid 57  and  name  HG)(resid 57  and  name HB2) 2.3 0.5 0.5 !  57 LEU:HG - 57 LEU:HB2
assign (resid 57  and  name  HG)(resid 62  and  name HD#) 2.8 1.0 1.0 !  57 LEU:HG - 62 LEU:HD#
assign (resid 57  and  name  HN)(resid 54  and  name  HA) 2.7 0.9 0.9 !  57 LEU:HN - 54 ARG:HA
assign (resid 57  and  name  HN)(resid 56  and  name  HB) 2.3 0.5 0.5 !  57 LEU:HN - 56 THR:HB
assign (resid 57  and  name  HN)(resid 56  and  name  HN) 2.3 0.5 0.5 !  57 LEU:HN - 56 THR:HN
assign (resid 57  and  name  HN)(resid 56  and  name HG1) 3.2 1.4 1.4 !  57 LEU:HN - 56 THR:HG1
assign (resid 57  and  name  HN)(resid 58  and  name  HN) 2.3 0.5 0.5 !  57 LEU:HN - 58 THR:HN
assign (resid 57  and  name HB1)(resid 57  and  name  HA) 2.3 0.5 0.5 !  57 LEU:HB1 - 57 LEU:HA
assign (resid 57  and  name HB1)(resid 57  and  name  HG) 2.3 0.5 0.5 !  57 LEU:HB1 - 57 LEU:HG
assign (resid 57  and  name HB1)(resid 57  and  name  HN) 2.6 0.8 0.8 !  57 LEU:HB1 - 57 LEU:HN
assign (resid 57  and  name HB1)(resid 57  and  name HB2) 2.3 0.5 0.5 !  57 LEU:HB1 - 57 LEU:HB2
assign (resid 57  and  name HB1)(resid 58  and  name  HN) 2.7 0.9 0.9 !  57 LEU:HB1 - 58 THR:HN
assign (resid 57  and  name HB2)(resid 57  and  name  HA) 2.3 0.5 0.5 !  57 LEU:HB2 - 57 LEU:HA
assign (resid 57  and  name HB2)(resid 57  and  name  HN) 2.7 0.9 0.9 !  57 LEU:HB2 - 57 LEU:HN
assign (resid 57  and  name HB2)(resid 58  and  name  HN) 2.3 0.5 0.5 !  57 LEU:HB2 - 58 THR:HN
assign (resid 57  and  name HD#)(resid 54  and  name  HA) 2.8 1.0 1.0 !  57 LEU:HD# - 54 ARG:HA
assign (resid 57  and  name HD#)(resid 57  and  name  HA) 2.8 1.0 1.0 !  57 LEU:HD# - 57 LEU:HA
assign (resid 57  and  name HD#)(resid 57  and  name  HG) 2.8 1.0 1.0 !  57 LEU:HD# - 57 LEU:HG
assign (resid 57  and  name HD#)(resid 57  and  name  HN) 3.2 1.4 1.4 !  57 LEU:HD# - 57 LEU:HN
assign (resid 57  and  name HD#)(resid 57  and  name HB1) 2.8 1.0 1.0 !  57 LEU:HD# - 57 LEU:HB1
assign (resid 57  and  name HD#)(resid 57  and  name HB2) 3.2 1.4 1.4 !  57 LEU:HD# - 57 LEU:HB2
assign (resid 57  and  name HD#)(resid 62  and  name HB#) 3.7 1.9 1.9 !  57 LEU:HD# - 62 LEU:HB#
assign (resid 57  and  name HD#)(resid 64  and  name  HA) 3.2 1.4 1.4 !  57 LEU:HD# - 64 VAL:HA
assign (resid 57  and  name HD#)(resid 64  and  name HG#) 3.7 1.9 1.9 !  57 LEU:HD# - 64 VAL:HG#
assign (resid 58  and  name  HA)(resid 58  and  name  HB) 2.7 0.9 0.9 !  58 THR:HA - 58 THR:HB
assign (resid 58  and  name  HA)(resid 58  and  name  HN) 2.2 0.5 0.5 !  58 THR:HA - 58 THR:HN
assign (resid 58  and  name  HB)(resid 58  and  name  HN) 2.6 0.8 0.8 !  58 THR:HB - 58 THR:HN
assign (resid 58  and  name HG1)(resid 58  and  name  HA) 3.2 1.4 1.4 !  58 THR:HG1 - 58 THR:HA
assign (resid 58  and  name HG1)(resid 58  and  name  HB) 2.8 1.0 1.0 !  58 THR:HG1 - 58 THR:HB
assign (resid 58  and  name HG1)(resid 58  and  name  HN) 2.8 1.0 1.0 !  58 THR:HG1 - 58 THR:HN
assign (resid 58  and  name HG1)(resid 64  and  name HG#) 3.3 1.5 1.5 !  58 THR:HG1 - 64 VAL:HG#
assign (resid 59  and  name  HA)(resid 59  and  name  HN) 2.2 0.5 0.5 !  59 SER:HA - 59 SER:HN
assign (resid 59  and  name  HA)(resid 60  and  name  HN) 2.6 0.8 0.8 !  59 SER:HA - 60 CYS:HN
assign (resid 59  and  name  HN)(resid 56  and  name  HA) 2.7 0.9 0.9 !  59 SER:HN - 56 THR:HA
assign (resid 59  and  name  HN)(resid 58  and  name HG1) 3.2 1.4 1.4 !  59 SER:HN - 58 THR:HG1
assign (resid 59  and  name  HN)(resid 60  and  name  HN) 2.7 0.9 0.9 !  59 SER:HN - 60 CYS:HN
assign (resid 59  and  name HB1)(resid 59  and  name  HA) 2.3 0.5 0.5 !  59 SER:HB1 - 59 SER:HA
assign (resid 59  and  name HB1)(resid 59  and  name  HN) 2.3 0.5 0.5 !  59 SER:HB1 - 59 SER:HN
assign (resid 59  and  name HB1)(resid 59  and  name HB2) 2.3 0.5 0.5 !  59 SER:HB1 - 59 SER:HB2
assign (resid 59  and  name HB1)(resid 60  and  name  HN) 2.7 0.9 0.9 !  59 SER:HB1 - 60 CYS:HN
assign (resid 59  and  name HB2)(resid 56  and  name  HA) 2.7 0.9 0.9 !  59 SER:HB2 - 56 THR:HA
assign (resid 59  and  name HB2)(resid 59  and  name  HA) 2.7 0.9 0.9 !  59 SER:HB2 - 59 SER:HA
assign (resid 59  and  name HB2)(resid 59  and  name  HN) 2.3 0.5 0.5 !  59 SER:HB2 - 59 SER:HN
assign (resid 59  and  name HB2)(resid 60  and  name  HN) 2.7 0.9 0.9 !  59 SER:HB2 - 60 CYS:HN
assign (resid 6   and  name  HA)(resid 6   and  name  HN) 2.2 0.5 0.5 !  6 GLN:HA - 6 GLN:HN
assign (resid 6   and  name  HA)(resid 7   and  name  HN) 2.7 0.9 0.9 !  6 GLN:HA - 7 LEU:HN
assign (resid 6   and  name  HN)(resid 3   and  name HB#) 2.7 0.9 0.9 !  6 GLN:HN - 3 GLN:HB#
assign (resid 6   and  name  HN)(resid 3   and  name HG#) 3.2 1.4 1.4 !  6 GLN:HN - 3 GLN:HG#
assign (resid 6   and  name  HN)(resid 7   and  name  HG) 2.6 0.8 0.8 !  6 GLN:HN - 7 LEU:HG
assign (resid 6   and  name  HN)(resid 7   and  name  HN) 2.7 0.9 0.9 !  6 GLN:HN - 7 LEU:HN
assign (resid 6   and  name  HN)(resid 7   and  name HD#) 3.2 1.4 1.4 !  6 GLN:HN - 7 LEU:HD#
assign (resid 6   and  name HB#)(resid 6   and  name  HA) 2.7 0.9 0.9 !  6 GLN:HB# - 6 GLN:HA
assign (resid 6   and  name HB#)(resid 6   and  name  HN) 2.3 0.5 0.5 !  6 GLN:HB# - 6 GLN:HN
assign (resid 6   and  name HB#)(resid 6   and  name HG#) 2.3 0.5 0.5 !  6 GLN:HB# - 6 GLN:HG#
assign (resid 6   and  name HG#)(resid 6   and  name  HA) 2.3 0.5 0.5 !  6 GLN:HG# - 6 GLN:HA
assign (resid 6   and  name HG#)(resid 6   and  name  HN) 2.3 0.5 0.5 !  6 GLN:HG# - 6 GLN:HN
assign (resid 60  and  name  HA)(resid 60  and  name  HN) 2.7 0.9 0.9 !  60 CYS:HA - 60 CYS:HN
assign (resid 60  and  name HB1)(resid 60  and  name  HA) 2.7 0.9 0.9 !  60 CYS:HB1 - 60 CYS:HA
assign (resid 60  and  name HB1)(resid 60  and  name  HN) 2.3 0.5 0.5 !  60 CYS:HB1 - 60 CYS:HN
assign (resid 60  and  name HB1)(resid 62  and  name  HG) 2.7 0.9 0.9 !  60 CYS:HB1 - 62 LEU:HG
assign (resid 60  and  name HB1)(resid 62  and  name HD#) 3.2 1.4 1.4 !  60 CYS:HB1 - 62 LEU:HD#
assign (resid 60  and  name HB2)(resid 60  and  name  HA) 2.3 0.5 0.5 !  60 CYS:HB2 - 60 CYS:HA
assign (resid 60  and  name HB2)(resid 60  and  name  HN) 2.3 0.5 0.5 !  60 CYS:HB2 - 60 CYS:HN
assign (resid 60  and  name HB2)(resid 60  and  name HB1) 2.3 0.5 0.5 !  60 CYS:HB2 - 60 CYS:HB1
assign (resid 60  and  name HB2)(resid 62  and  name  HG) 2.7 0.9 0.9 !  60 CYS:HB2 - 62 LEU:HG
assign (resid 60  and  name HB2)(resid 62  and  name HD#) 3.2 1.4 1.4 !  60 CYS:HB2 - 62 LEU:HD#
assign (resid 61  and  name  HN)(resid 58  and  name  HA) 2.3 0.5 0.5 !  61 GLY:HN - 58 THR:HA
assign (resid 61  and  name  HN)(resid 60  and  name  HA) 2.7 0.9 0.9 !  61 GLY:HN - 60 CYS:HA
assign (resid 61  and  name  HN)(resid 60  and  name  HN) 2.3 0.5 0.5 !  61 GLY:HN - 60 CYS:HN
assign (resid 61  and  name  HN)(resid 60  and  name HB1) 2.7 0.9 0.9 !  61 GLY:HN - 60 CYS:HB1
assign (resid 61  and  name  HN)(resid 60  and  name HB2) 2.7 0.9 0.9 !  61 GLY:HN - 60 CYS:HB2
assign (resid 61  and  name  HN)(resid 62  and  name  HN) 2.3 0.5 0.5 !  61 GLY:HN - 62 LEU:HN
assign (resid 61  and  name HA#)(resid 61  and  name  HN) 2.3 0.5 0.5 !  61 GLY:HA# - 61 GLY:HN
assign (resid 61  and  name HA#)(resid 62  and  name  HN) 2.7 0.9 0.9 !  61 GLY:HA# - 62 LEU:HN
assign (resid 62  and  name  HA)(resid 62  and  name  HN) 2.7 0.9 0.9 !  62 LEU:HA - 62 LEU:HN
assign (resid 62  and  name  HG)(resid 62  and  name  HA) 2.7 0.9 0.9 !  62 LEU:HG - 62 LEU:HA
assign (resid 62  and  name  HG)(resid 62  and  name  HN) 2.3 0.5 0.5 !  62 LEU:HG - 62 LEU:HN
assign (resid 62  and  name HB#)(resid 62  and  name  HA) 3.2 1.4 1.4 !  62 LEU:HB# - 62 LEU:HA
assign (resid 62  and  name HB#)(resid 62  and  name  HN) 2.8 1.0 1.0 !  62 LEU:HB# - 62 LEU:HN
assign (resid 62  and  name HD#)(resid 62  and  name  HA) 3.2 1.4 1.4 !  62 LEU:HD# - 62 LEU:HA
assign (resid 62  and  name HD#)(resid 62  and  name  HG) 2.8 1.0 1.0 !  62 LEU:HD# - 62 LEU:HG
assign (resid 62  and  name HD#)(resid 62  and  name  HN) 3.2 1.4 1.4 !  62 LEU:HD# - 62 LEU:HN
assign (resid 62  and  name HD#)(resid 62  and  name HB#) 3.3 1.5 1.5 !  62 LEU:HD# - 62 LEU:HB#
assign (resid 63  and  name  HA)(resid 63  and  name  HN) 2.3 0.5 0.5 !  63 ALA:HA - 63 ALA:HN
assign (resid 63  and  name  HA)(resid 64  and  name  HN) 2.3 0.5 0.5 !  63 ALA:HA - 64 VAL:HN
assign (resid 63  and  name  HN)(resid 62  and  name  HA) 2.7 0.9 0.9 !  63 ALA:HN - 62 LEU:HA
assign (resid 63  and  name  HN)(resid 62  and  name  HG) 2.3 0.5 0.5 !  63 ALA:HN - 62 LEU:HG
assign (resid 63  and  name  HN)(resid 62  and  name  HN) 2.7 0.9 0.9 !  63 ALA:HN - 62 LEU:HN
assign (resid 63  and  name  HN)(resid 62  and  name HB#) 3.2 1.4 1.4 !  63 ALA:HN - 62 LEU:HB#
assign (resid 63  and  name  HN)(resid 62  and  name HD#) 3.2 1.4 1.4 !  63 ALA:HN - 62 LEU:HD#
assign (resid 63  and  name HB#)(resid 63  and  name  HA) 2.8 1.0 1.0 !  63 ALA:HB# - 63 ALA:HA
assign (resid 63  and  name HB#)(resid 63  and  name  HN) 2.8 1.0 1.0 !  63 ALA:HB# - 63 ALA:HN
assign (resid 63  and  name HB#)(resid 64  and  name  HN) 2.8 1.0 1.0 !  63 ALA:HB# - 64 VAL:HN
assign (resid 64  and  name  HA)(resid 64  and  name  HN) 2.3 0.5 0.5 !  64 VAL:HA - 64 VAL:HN
assign (resid 64  and  name  HB)(resid 64  and  name  HA) 2.3 0.5 0.5 !  64 VAL:HB - 64 VAL:HA
assign (resid 64  and  name  HB)(resid 64  and  name  HN) 2.3 0.5 0.5 !  64 VAL:HB - 64 VAL:HN
assign (resid 64  and  name HG#)(resid 64  and  name  HA) 2.8 1.0 1.0 !  64 VAL:HG# - 64 VAL:HA
assign (resid 64  and  name HG#)(resid 64  and  name  HB) 2.8 1.0 1.0 !  64 VAL:HG# - 64 VAL:HB
assign (resid 64  and  name HG#)(resid 64  and  name  HN) 2.8 1.0 1.0 !  64 VAL:HG# - 64 VAL:HN
assign (resid 65  and  name  HA)(resid 66  and  name  HN) 2.3 0.5 0.5 !  65 PRO:HA - 66 HIS:HN
assign (resid 65  and  name HB#)(resid 65  and  name  HA) 2.8 1.0 1.0 !  65 PRO:HB# - 65 PRO:HA
assign (resid 65  and  name HB#)(resid 65  and  name HD#) 3.6 1.8 1.8 !  65 PRO:HB# - 65 PRO:HD#
assign (resid 65  and  name HB#)(resid 66  and  name  HN) 3.2 1.4 1.4 !  65 PRO:HB# - 66 HIS:HN
assign (resid 65  and  name HD#)(resid 35  and  name HD#) 3.9 2.1 2.1 !  65 PRO:HD# - 35 PHE:HD#
assign (resid 65  and  name HD#)(resid 48  and  name HD1#) 3.4 1.6 1.6 !  65 PRO:HD# - 48 ILE:HD1#
assign (resid 65  and  name HD#)(resid 48  and  name HG2#) 3.4 1.6 1.6 !  65 PRO:HD# - 48 ILE:HG2#
assign (resid 65  and  name HD#)(resid 64  and  name  HA) 2.3 0.5 0.5 !  65 PRO:HD# - 64 VAL:HA
assign (resid 65  and  name HD#)(resid 65  and  name  HA) 3.1 1.3 1.3 !  65 PRO:HD# - 65 PRO:HA
assign (resid 65  and  name HD#)(resid 65  and  name HG#) 2.7 0.9 0.9 !  65 PRO:HD# - 65 PRO:HG#
assign (resid 65  and  name HG#)(resid 65  and  name  HA) 2.7 0.9 0.9 !  65 PRO:HG# - 65 PRO:HA
assign (resid 65  and  name HG#)(resid 65  and  name HB#) 2.8 1.0 1.0 !  65 PRO:HG# - 65 PRO:HB#
assign (resid 65  and  name HG#)(resid 65  and  name HD#) 2.7 0.9 0.9 !  65 PRO:HG# - 65 PRO:HD#
assign (resid 65  and  name HG#)(resid 66  and  name  HN) 2.7 0.9 0.9 !  65 PRO:HG# - 66 HIS:HN
assign (resid 66  and  name  HN)(resid 67  and  name  HN) 2.7 0.9 0.9 !  66 HIS:HN - 67 CYS:HN
assign (resid 66  and  name HB#)(resid 66  and  name  HN) 2.7 0.9 0.9 !  66 HIS:HB# - 66 HIS:HN
assign (resid 66  and  name HD2)(resid 66  and  name HB#) 2.7 0.9 0.9 !  66 HIS:HD2 - 66 HIS:HB#
assign (resid 66  and  name HD2)(resid 66  and  name HE1) 3.0 1.2 1.2 !  66 HIS:HD2 - 66 HIS:HE1
assign (resid 66  and  name HE1)(resid 65  and  name HG#) 2.7 0.9 0.9 !  66 HIS:HE1 - 65 PRO:HG#
assign (resid 66  and  name HE1)(resid 66  and  name HB#) 3.1 1.3 1.3 !  66 HIS:HE1 - 66 HIS:HB#
assign (resid 67  and  name  HA)(resid 67  and  name  HN) 2.7 0.9 0.9 !  67 CYS:HA - 67 CYS:HN
assign (resid 67  and  name HB#)(resid 67  and  name  HA) 2.7 0.9 0.9 !  67 CYS:HB# - 67 CYS:HA
assign (resid 67  and  name HB#)(resid 67  and  name  HN) 2.7 0.9 0.9 !  67 CYS:HB# - 67 CYS:HN
assign (resid 7   and  name  HA)(resid 7   and  name  HN) 2.7 0.9 0.9 !  7 LEU:HA - 7 LEU:HN
assign (resid 7   and  name  HG)(resid 7   and  name  HA) 2.7 0.9 0.9 !  7 LEU:HG - 7 LEU:HA
assign (resid 7   and  name  HG)(resid 7   and  name  HN) 2.7 0.9 0.9 !  7 LEU:HG - 7 LEU:HN
assign (resid 7   and  name  HG)(resid 7   and  name HB#) 2.3 0.5 0.5 !  7 LEU:HG - 7 LEU:HB#
assign (resid 7   and  name HB#)(resid 7   and  name  HA) 2.3 0.5 0.5 !  7 LEU:HB# - 7 LEU:HA
assign (resid 7   and  name HB#)(resid 7   and  name  HG) 2.3 0.5 0.5 !  7 LEU:HB# - 7 LEU:HG
assign (resid 7   and  name HB#)(resid 7   and  name  HN) 2.6 0.8 0.8 !  7 LEU:HB# - 7 LEU:HN
assign (resid 7   and  name HD#)(resid 7   and  name  HA) 3.2 1.4 1.4 !  7 LEU:HD# - 7 LEU:HA
assign (resid 7   and  name HD#)(resid 7   and  name  HG) 2.8 1.0 1.0 !  7 LEU:HD# - 7 LEU:HG
assign (resid 7   and  name HD#)(resid 7   and  name  HN) 3.6 1.8 1.8 !  7 LEU:HD# - 7 LEU:HN
assign (resid 7   and  name HD#)(resid 7   and  name HB#) 3.2 1.4 1.4 !  7 LEU:HD# - 7 LEU:HB#
assign (resid 8   and  name  HA)(resid 8   and  name  HN) 2.2 0.5 0.5 !  8 ALA:HA - 8 ALA:HN
assign (resid 8   and  name  HN)(resid 7   and  name  HN) 2.7 0.9 0.9 !  8 ALA:HN - 7 LEU:HN
assign (resid 8   and  name HB#)(resid 8   and  name  HA) 2.8 1.0 1.0 !  8 ALA:HB# - 8 ALA:HA
assign (resid 8   and  name HB#)(resid 8   and  name  HN) 3.1 1.3 1.3 !  8 ALA:HB# - 8 ALA:HN
assign (resid 8   and  name HB#)(resid 9   and  name  HA) 3.2 1.4 1.4 !  8 ALA:HB# - 9 VAL:HA
assign (resid 9   and  name  HB)(resid 9   and  name  HA) 2.3 0.5 0.5 !  9 VAL:HB - 9 VAL:HA
assign (resid 9   and  name  HN)(resid 10  and  name  HN) 2.7 0.9 0.9 !  9 VAL:HN - 10 CYS:HN
assign (resid 9   and  name  HN)(resid 8   and  name  HA) 2.6 0.8 0.8 !  9 VAL:HN - 8 ALA:HA
assign (resid 9   and  name  HN)(resid 8   and  name HB#) 2.8 1.0 1.0 !  9 VAL:HN - 8 ALA:HB#
assign (resid 9   and  name  HN)(resid 9   and  name  HA) 2.2 0.5 0.5 !  9 VAL:HN - 9 VAL:HA
assign (resid 9   and  name  HN)(resid 9   and  name  HB) 2.3 0.5 0.5 !  9 VAL:HN - 9 VAL:HB
assign (resid 9   and  name  HN)(resid 9   and  name HG#) 2.8 1.0 1.0 !  9 VAL:HN - 9 VAL:HG#
assign (resid 9   and  name HG#)(resid 24  and  name  HA) 2.8 1.0 1.0 !  9 VAL:HG# - 24 CYS:HA
assign (resid 9   and  name HG#)(resid 24  and  name  HN) 3.2 1.4 1.4 !  9 VAL:HG# - 24 CYS:HN
assign (resid 9   and  name HG#)(resid 24  and  name HB#) 3.2 1.4 1.4 !  9 VAL:HG# - 24 CYS:HB#
assign (resid 9   and  name HG#)(resid 6   and  name  HN) 3.7 1.9 1.9 !  9 VAL:HG# - 6 GLN:HN
assign (resid 9   and  name HG#)(resid 9   and  name  HA) 2.8 1.0 1.0 !  9 VAL:HG# - 9 VAL:HA
assign (resid 9   and  name HG#)(resid 9   and  name  HB) 2.8 1.0 1.0 !  9 VAL:HG# - 9 VAL:HB

! INTERMOLECULAR NOE CONSTRAINTS
assign (resid 44  and  name HD#)(resid 68 and  name  CN)  3.5 0.5 0.5 ! 44 TYR:QD 104 BUTL:QB
assign (resid 44  and  name HE#)(resid 68 and  name  CN)  3.5 0.5 0.5 ! 44 TYR:QE 104 BUTL:QB 
assign (resid 47  and  name HD#)(resid 68 and  name  CN)  3.5 0.5 0.5 ! 47 TYR:QD 104 BUTL:QB 
assign (resid 47  and  name HE#)(resid 68 and  name  CN)  3.5 0.5 0.5 ! 47 TYR:QE 104 BUTL:QB
assign (resid 35  and  name HB#)(resid 68 and  name  CI)  3.5 1.5 1.5 ! 35 PHE:QB 103 BUTL:QB

! DIHEDRAL ANGLES RESTRAINTS
assign (resid  13  and name c ) (resid  14  and name n ) 
       (resid  14  and name ca) (resid  14  and name c )   1.0  -60.0 20.0 2
assign (resid  14  and name c ) (resid  15  and name n )
       (resid  15  and name ca) (resid  15  and name c )   1.0  -60.0 20.0 2
assign (resid  15  and name c ) (resid  16  and name n )
       (resid  16  and name ca) (resid  16  and name c )   1.0  -60.0 20.0 2
assign (resid  18  and name c ) (resid  19  and name n )
       (resid  19  and name ca) (resid  19  and name c )   1.0  -180.0 20.0 2
assign (resid  22  and name c ) (resid  23  and name n )
       (resid  23  and name ca) (resid  23  and name c )   1.0  -60.0 20.0 2
assign (resid  23  and name c ) (resid  24  and name n )
       (resid  24  and name ca) (resid  24  and name c )   1.0  -60.0 20.0 2
assign (resid  25  and name c ) (resid  26  and name n )
       (resid  26  and name ca) (resid  26  and name c )   1.0  -60.0 20.0 2
assign (resid  26  and name c ) (resid  27  and name n )
       (resid  27  and name ca) (resid  27  and name c )   1.0  -60.0 20.0 2
assign (resid  27  and name c ) (resid  28  and name n )
       (resid  28  and name ca) (resid  28  and name c )   1.0  -60.0 20.0 2
assign (resid  28  and name c ) (resid  29  and name n )
       (resid  29  and name ca) (resid  29  and name c )   1.0  -60.0 20.0 2
assign (resid  29  and name c ) (resid  30  and name n )
       (resid  30  and name ca) (resid  30  and name c )   1.0  -60.0 20.0 2
assign (resid  30  and name c ) (resid  31  and name n )
       (resid  31  and name ca) (resid  31  and name c )   1.0  -60.0 20.0 2
assign (resid  36  and name c ) (resid  37  and name n )
       (resid  37  and name ca) (resid  37  and name c )   1.0  -60.0 20.0 2
assign (resid  37  and name c ) (resid  38  and name n )
       (resid  38  and name ca) (resid  38  and name c )   1.0  -60.0 20.0 2
assign (resid  38  and name c ) (resid  39  and name n )
       (resid  39  and name ca) (resid  39  and name c )   1.0  -60.0 20.0 2
assign (resid  40  and name c ) (resid  41  and name n )
       (resid  41  and name ca) (resid  41  and name c )   1.0  -60.0 20.0 2
assign (resid  46  and name c ) (resid  47  and name n )
       (resid  47  and name ca) (resid  47  and name c )   1.0  -60.0 20.0 2
assign (resid  47  and name c ) (resid  48  and name n )
       (resid  48  and name ca) (resid  48  and name c )   1.0  -60.0 20.0 2
assign (resid  48  and name c ) (resid  49  and name n )
       (resid  49  and name ca) (resid  49  and name c )   1.0  -60.0 20.0 2
assign (resid  49  and name c ) (resid  50  and name n )
       (resid  50  and name ca) (resid  50  and name c )   1.0  -60.0 20.0 2
assign (resid  50  and name c ) (resid  51  and name n )
       (resid  51  and name ca) (resid  51  and name c )   1.0  -60.0 20.0 2
assign (resid  51  and name c ) (resid  52  and name n )
       (resid  52  and name ca) (resid  52  and name c )   1.0  -60.0 20.0 2
assign (resid  55  and name c ) (resid  56  and name n )
       (resid  56  and name ca) (resid  56  and name c )   1.0  -60.0 20.0 2
assign (resid  56  and name c ) (resid  57  and name n )
       (resid  57  and name ca) (resid  57  and name c )   1.0  -60.0 20.0 2
assign (resid  57  and name c ) (resid  58  and name n )
       (resid  58  and name ca) (resid  58  and name c )   1.0  -60.0 20.0 2
assign (resid  59  and name c ) (resid  60  and name n )
       (resid  60  and name ca) (resid  60  and name c )   1.0  -60.0 20.0 2
assign (resid  61  and name c ) (resid  62  and name n )
       (resid  62  and name ca) (resid  62  and name c )   1.0  -130.0 20.0 2
assign (resid  62  and name c ) (resid  63  and name n )
       (resid  63  and name ca) (resid  63  and name c )   1.0  -130.0 20.0 2
assign (resid  63  and name c ) (resid  64  and name n )
       (resid  64  and name ca) (resid  64  and name c )   1.0  -130.0 20.0 2
assign (resid  10  and name n ) (resid  10  and name ca )
       (resid  10  and name cb) (resid  10  and name sg )   1.0  180.0 25.0 2
assign (resid  23  and name n ) (resid  23  and name ca )
       (resid  23  and name cb) (resid  23  and name cg )   1.0  180.0 25.0 2
assign (resid  24  and name n ) (resid  24  and name ca )
       (resid  24  and name cb) (resid  24  and name sg )   1.0  180.0 25.0 2
assign (resid  34  and name n ) (resid  34  and name ca )
       (resid  34  and name cb) (resid  34  and name sg )   1.0  180.0 25.0 2
assign (resid  41  and name n ) (resid  41  and name ca )
       (resid  41  and name cb) (resid  41  and name cg )   1.0  180.0 25.0 2
assign (resid  47  and name n ) (resid  47  and name ca )
       (resid  47  and name cb) (resid  47  and name cg )   1.0  180.0 25.0 2
assign (resid  55  and name n ) (resid  55  and name ca )
       (resid  55  and name cb) (resid  55  and name cg )   1.0  180.0 25.0 2
assign (resid  59  and name n ) (resid  59  and name ca )
       (resid  59  and name cb) (resid  59  and name og )   1.0  180.0 25.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          HT1       ALA   1  13.388   2.806   0.459
    2   2H    ALA   1          HT2       ALA   1  14.969   2.666  -0.194
    3   3H    ALA   1          HT3       ALA   1  13.631   2.943  -1.232
    4    HA   ALA   1           HA       ALA   1  14.350   4.807   0.906
    5   1HB   ALA   1          HB1       ALA   1  16.157   4.184  -0.977
    6   2HB   ALA   1          HB2       ALA   1  15.979   5.803  -0.301
    7   3HB   ALA   1          HB3       ALA   1  15.229   5.406  -1.847
    8    H    CYS   2           HN       CYS   2  11.794   3.892  -0.062
    9    HA   CYS   2           HA       CYS   2   9.786   4.722  -0.736
   10   1HB   CYS   2          HB2       CYS   2  10.953   7.491  -0.728
   11   2HB   CYS   2          HB1       CYS   2   9.326   6.977  -0.300
   12    H    GLN   3           HN       GLN   3   9.713   3.878  -2.794
   13    HA   GLN   3           HA       GLN   3  11.018   5.189  -5.000
   14   1HB   GLN   3          HB2       GLN   3   9.441   2.726  -4.590
   15   2HB   GLN   3          HB1       GLN   3   9.298   3.456  -6.183
   16   1HG   GLN   3          HG2       GLN   3  12.010   3.068  -5.029
   17   2HG   GLN   3          HG1       GLN   3  11.142   1.668  -5.658
   18   1HE2  GLN   3          HE21      GLN   3  12.963   4.439  -6.410
   19   2HE2  GLN   3          HE22      GLN   3  12.884   4.315  -8.132
   20    H    ALA   4           HN       ALA   4   7.698   4.868  -3.811
   21    HA   ALA   4           HA       ALA   4   5.797   6.042  -4.252
   22   1HB   ALA   4          HB1       ALA   4   6.001   8.302  -4.298
   23   2HB   ALA   4          HB2       ALA   4   7.249   8.276  -5.544
   24   3HB   ALA   4          HB3       ALA   4   7.666   7.908  -3.870
   25    H    SER   5           HN       SER   5   6.848   4.220  -6.241
   26    HA   SER   5           HA       SER   5   5.290   5.158  -8.510
   27   1HB   SER   5          HB2       SER   5   8.236   4.783  -8.556
   28   2HB   SER   5          HB1       SER   5   7.335   4.154  -9.936
   29    HG   SER   5           HG       SER   5   7.565   6.177 -10.552
   30    H    GLN   6           HN       GLN   6   7.085   2.562  -6.944
   31    HA   GLN   6           HA       GLN   6   6.213   0.477  -8.601
   32   1HB   GLN   6          HB2       GLN   6   7.438   0.666  -5.891
   33   2HB   GLN   6          HB1       GLN   6   6.728  -0.866  -6.380
   34   1HG   GLN   6          HG2       GLN   6   8.168  -0.626  -8.491
   35   2HG   GLN   6          HG1       GLN   6   9.050   0.593  -7.573
   36   1HE2  GLN   6          HE21      GLN   6   9.273  -2.439  -8.511
   37   2HE2  GLN   6          HE22      GLN   6  10.087  -3.153  -7.165
   38    H    LEU   7           HN       LEU   7   4.582   2.333  -6.290
   39    HA   LEU   7           HA       LEU   7   2.520   0.273  -5.920
   40   1HB   LEU   7          HB2       LEU   7   2.435   2.781  -4.347
   41   2HB   LEU   7          HB1       LEU   7   2.048   1.140  -3.867
   42    HG   LEU   7           HG       LEU   7   4.900   1.975  -4.333
   43   1HD1  LEU   7          HD11      LEU   7   5.148   2.720  -2.136
   44   2HD1  LEU   7          HD12      LEU   7   3.589   2.065  -1.636
   45   3HD1  LEU   7          HD13      LEU   7   3.655   3.486  -2.678
   46   1HD2  LEU   7          HD21      LEU   7   5.300  -0.133  -3.763
   47   2HD2  LEU   7          HD22      LEU   7   3.570  -0.427  -3.591
   48   3HD2  LEU   7          HD23      LEU   7   4.511   0.128  -2.208
   49    H    ALA   8           HN       ALA   8   3.191   3.301  -7.405
   50    HA   ALA   8           HA       ALA   8   0.793   4.592  -7.525
   51   1HB   ALA   8          HB1       ALA   8   2.953   5.346  -8.535
   52   2HB   ALA   8          HB2       ALA   8   1.530   5.631  -9.536
   53   3HB   ALA   8          HB3       ALA   8   2.609   4.284  -9.900
   54    H    VAL   9           HN       VAL   9   1.835   1.898  -9.513
   55    HA   VAL   9           HA       VAL   9  -0.302   1.761 -11.264
   56    HB   VAL   9           HB       VAL   9   1.744   0.436 -11.545
   57   1HG1  VAL   9          HG11      VAL   9   0.683  -1.413  -9.422
   58   2HG1  VAL   9          HG12      VAL   9   1.899  -0.176  -9.103
   59   3HG1  VAL   9          HG13      VAL   9   2.243  -1.478 -10.242
   60   1HG2  VAL   9          HG21      VAL   9   0.491  -0.750 -12.943
   61   2HG2  VAL   9          HG22      VAL   9  -0.938  -0.482 -11.945
   62   3HG2  VAL   9          HG23      VAL   9   0.114  -1.861 -11.627
   63    H    CYS  10           HN       CYS  10  -0.100   0.900  -7.939
   64    HA   CYS  10           HA       CYS  10  -2.536  -0.685  -7.967
   65   1HB   CYS  10          HB2       CYS  10  -0.408  -0.981  -6.464
   66   2HB   CYS  10          HB1       CYS  10  -1.177   0.249  -5.468
   67    H    ALA  11           HN       ALA  11  -1.435   2.501  -7.157
   68    HA   ALA  11           HA       ALA  11  -3.306   3.543  -5.500
   69   1HB   ALA  11          HB1       ALA  11  -1.384   4.774  -6.491
   70   2HB   ALA  11          HB2       ALA  11  -2.885   5.699  -6.455
   71   3HB   ALA  11          HB3       ALA  11  -2.333   4.972  -7.964
   72    H    SER  12           HN       SER  12  -3.753   2.643  -8.812
   73    HA   SER  12           HA       SER  12  -6.091   3.977  -9.444
   74   1HB   SER  12          HB2       SER  12  -5.335   1.169 -10.281
   75   2HB   SER  12          HB1       SER  12  -6.479   2.228 -11.104
   76    HG   SER  12           HG       SER  12  -4.629   3.710 -11.313
   77    H    ALA  13           HN       ALA  13  -5.593   1.072  -7.548
   78    HA   ALA  13           HA       ALA  13  -8.408   0.533  -7.302
   79   1HB   ALA  13          HB1       ALA  13  -6.458  -0.815  -5.530
   80   2HB   ALA  13          HB2       ALA  13  -6.318  -1.110  -7.263
   81   3HB   ALA  13          HB3       ALA  13  -7.825  -1.479  -6.425
   82    H    ILE  14           HN       ILE  14  -5.792   1.728  -5.233
   83    HA   ILE  14           HA       ILE  14  -7.257   1.926  -2.850
   84    HB   ILE  14           HB       ILE  14  -4.880   3.523  -3.812
   85   1HG1  ILE  14          HG12      ILE  14  -3.833   2.066  -1.907
   86   2HG1  ILE  14          HG11      ILE  14  -5.246   1.042  -2.159
   87   1HG2  ILE  14          HG21      ILE  14  -4.883   3.640  -1.053
   88   2HG2  ILE  14          HG22      ILE  14  -6.570   3.917  -1.485
   89   3HG2  ILE  14          HG23      ILE  14  -5.307   4.950  -2.155
   90   1HD1  ILE  14          HD11      ILE  14  -4.558   0.378  -4.240
   91   2HD1  ILE  14          HD12      ILE  14  -3.009   0.578  -3.421
   92   3HD1  ILE  14          HD13      ILE  14  -3.600   1.834  -4.510
   93    H    LEU  15           HN       LEU  15  -6.530   4.439  -5.276
   94    HA   LEU  15           HA       LEU  15  -8.237   6.365  -4.037
   95   1HB   LEU  15          HB2       LEU  15  -6.739   6.232  -6.628
   96   2HB   LEU  15          HB1       LEU  15  -7.902   7.514  -6.350
   97    HG   LEU  15           HG       LEU  15  -5.493   6.956  -4.618
   98   1HD1  LEU  15          HD11      LEU  15  -5.946   8.706  -6.966
   99   2HD1  LEU  15          HD12      LEU  15  -4.484   7.876  -6.434
  100   3HD1  LEU  15          HD13      LEU  15  -4.999   9.358  -5.629
  101   1HD2  LEU  15          HD21      LEU  15  -6.225   9.441  -3.986
  102   2HD2  LEU  15          HD22      LEU  15  -6.840   8.022  -3.138
  103   3HD2  LEU  15          HD23      LEU  15  -7.809   8.785  -4.398
  104    H    SER  16           HN       SER  16  -8.511   5.398  -7.436
  105    HA   SER  16           HA       SER  16 -11.261   5.900  -7.579
  106   1HB   SER  16          HB2       SER  16 -10.031   5.884  -9.615
  107   2HB   SER  16          HB1       SER  16  -9.422   4.256  -9.320
  108    HG   SER  16           HG       SER  16 -11.207   4.426 -10.847
  109    H    GLY  17           HN       GLY  17  -9.877   2.661  -8.082
  110   1HA   GLY  17          HA2       GLY  17 -10.516   0.886  -6.459
  111   2HA   GLY  17          HA1       GLY  17 -12.128   1.583  -6.496
  112    H    ALA  18           HN       ALA  18 -10.002   1.074  -9.266
  113    HA   ALA  18           HA       ALA  18 -11.976  -0.056 -10.876
  114   1HB   ALA  18          HB1       ALA  18  -9.794  -1.011 -12.067
  115   2HB   ALA  18          HB2       ALA  18  -9.035   0.183 -11.015
  116   3HB   ALA  18          HB3       ALA  18 -10.269   0.685 -12.170
  117    H    LYS  19           HN       LYS  19  -9.115  -1.858  -9.936
  118    HA   LYS  19           HA       LYS  19 -10.540  -3.979  -8.700
  119   1HB   LYS  19          HB2       LYS  19  -9.770  -5.687 -10.475
  120   2HB   LYS  19          HB1       LYS  19 -11.213  -4.737 -10.802
  121   1HG   LYS  19          HG2       LYS  19  -8.827  -3.417 -11.768
  122   2HG   LYS  19          HG1       LYS  19  -9.005  -5.036 -12.448
  123   1HD   LYS  19          HD2       LYS  19 -11.011  -4.523 -13.479
  124   2HD   LYS  19          HD1       LYS  19 -11.357  -3.194 -12.371
  125   1HE   LYS  19          HE2       LYS  19 -10.696  -1.896 -14.081
  126   2HE   LYS  19          HE1       LYS  19  -9.072  -2.318 -13.541
  127   1HZ   LYS  19          HZ1       LYS  19 -10.327  -4.189 -15.375
  128   2HZ   LYS  19          HZ2       LYS  19  -8.729  -3.636 -15.316
  129   3HZ   LYS  19          HZ3       LYS  19  -9.928  -2.679 -16.027
  130    HA   PRO  20           HA       PRO  20  -6.571  -4.434  -6.794
  131   1HB   PRO  20          HB2       PRO  20  -7.325  -7.310  -6.618
  132   2HB   PRO  20          HB1       PRO  20  -6.787  -6.208  -5.346
  133   1HG   PRO  20          HG2       PRO  20  -9.348  -6.907  -5.539
  134   2HG   PRO  20          HG1       PRO  20  -8.887  -5.251  -5.105
  135   1HD   PRO  20          HD2       PRO  20  -9.903  -6.319  -7.702
  136   2HD   PRO  20          HD1       PRO  20 -10.220  -4.757  -6.920
  137    H    SER  21           HN       SER  21  -4.806  -6.374  -6.833
  138    HA   SER  21           HA       SER  21  -4.459  -7.798  -9.234
  139   1HB   SER  21          HB2       SER  21  -3.454  -5.007  -9.180
  140   2HB   SER  21          HB1       SER  21  -2.351  -6.223  -9.823
  141    HG   SER  21           HG       SER  21  -4.119  -6.868 -11.216
  142    H    GLY  22           HN       GLY  22  -2.759  -9.211  -9.092
  143   1HA   GLY  22          HA2       GLY  22  -1.621  -9.643  -6.540
  144   2HA   GLY  22          HA1       GLY  22  -1.162 -10.469  -8.022
  145    H    GLU  23           HN       GLU  23  -0.233  -8.330  -9.538
  146    HA   GLU  23           HA       GLU  23   2.400  -8.134  -8.858
  147   1HB   GLU  23          HB2       GLU  23   1.067  -7.425 -10.997
  148   2HB   GLU  23          HB1       GLU  23   1.048  -5.839 -10.226
  149   1HG   GLU  23          HG2       GLU  23   3.652  -6.514  -9.984
  150   2HG   GLU  23          HG1       GLU  23   3.229  -7.298 -11.503
  151    H    CYS  24           HN       CYS  24  -0.258  -6.067  -7.856
  152    HA   CYS  24           HA       CYS  24   1.108  -3.934  -6.780
  153   1HB   CYS  24          HB2       CYS  24  -1.296  -3.896  -6.970
  154   2HB   CYS  24          HB1       CYS  24  -1.443  -5.231  -5.832
  155    H    CYS  25           HN       CYS  25  -0.126  -6.668  -4.929
  156    HA   CYS  25           HA       CYS  25   1.134  -6.113  -2.531
  157   1HB   CYS  25          HB2       CYS  25   0.589  -8.302  -1.849
  158   2HB   CYS  25          HB1       CYS  25  -0.648  -7.872  -3.021
  159    H    GLY  26           HN       GLY  26   2.471  -7.426  -5.440
  160   1HA   GLY  26          HA2       GLY  26   4.832  -8.506  -4.180
  161   2HA   GLY  26          HA1       GLY  26   4.546  -8.354  -5.906
  162    H    ASN  27           HN       ASN  27   3.997  -5.557  -5.927
  163    HA   ASN  27           HA       ASN  27   6.523  -4.519  -6.309
  164   1HB   ASN  27          HB2       ASN  27   3.896  -3.127  -5.836
  165   2HB   ASN  27          HB1       ASN  27   5.366  -2.278  -6.301
  166   1HD2  ASN  27          HD21      ASN  27   6.433  -3.107  -8.298
  167   2HD2  ASN  27          HD22      ASN  27   5.408  -3.577  -9.606
  168    H    LEU  28           HN       LEU  28   4.338  -3.991  -3.607
  169    HA   LEU  28           HA       LEU  28   5.832  -2.248  -2.110
  170   1HB   LEU  28          HB2       LEU  28   4.581  -2.935  -0.193
  171   2HB   LEU  28          HB1       LEU  28   3.521  -2.944  -1.591
  172    HG   LEU  28           HG       LEU  28   4.263  -5.493  -1.660
  173   1HD1  LEU  28          HD11      LEU  28   4.029  -5.404   1.248
  174   2HD1  LEU  28          HD12      LEU  28   5.534  -4.720   0.632
  175   3HD1  LEU  28          HD13      LEU  28   5.084  -6.375   0.221
  176   1HD2  LEU  28          HD21      LEU  28   1.968  -4.339  -1.340
  177   2HD2  LEU  28          HD22      LEU  28   2.203  -4.718   0.366
  178   3HD2  LEU  28          HD23      LEU  28   2.163  -6.015  -0.827
  179    H    ARG  29           HN       ARG  29   6.128  -5.722  -2.318
  180    HA   ARG  29           HA       ARG  29   7.825  -6.201  -0.220
  181   1HB   ARG  29          HB2       ARG  29   7.813  -7.561  -2.904
  182   2HB   ARG  29          HB1       ARG  29   8.551  -8.206  -1.441
  183   1HG   ARG  29          HG2       ARG  29   5.686  -7.456  -1.351
  184   2HG   ARG  29          HG1       ARG  29   6.141  -8.934  -2.205
  185   1HD   ARG  29          HD2       ARG  29   6.791  -8.230   0.646
  186   2HD   ARG  29          HD1       ARG  29   5.580  -9.392   0.117
  187    HE   ARG  29           HE       ARG  29   8.464  -9.751   0.118
  188   1HH1  ARG  29          HH11      ARG  29   5.348 -10.979  -0.876
  189   2HH1  ARG  29          HH12      ARG  29   5.925 -12.592  -1.118
  190   1HH2  ARG  29          HH21      ARG  29   9.220 -11.871  -0.205
  191   2HH2  ARG  29          HH22      ARG  29   8.121 -13.099  -0.738
  192    H    ALA  30           HN       ALA  30   8.654  -5.303  -3.505
  193    HA   ALA  30           HA       ALA  30  11.402  -5.395  -3.320
  194   1HB   ALA  30          HB1       ALA  30   9.693  -3.424  -4.830
  195   2HB   ALA  30          HB2       ALA  30  10.326  -4.956  -5.432
  196   3HB   ALA  30          HB3       ALA  30  11.428  -3.629  -5.066
  197    H    GLN  31           HN       GLN  31   9.129  -3.186  -1.970
  198    HA   GLN  31           HA       GLN  31  11.097  -1.211  -1.203
  199   1HB   GLN  31          HB2       GLN  31   8.297  -1.357  -0.120
  200   2HB   GLN  31          HB1       GLN  31   9.313   0.057  -0.355
  201   1HG   GLN  31          HG2       GLN  31   9.115  -0.726  -2.890
  202   2HG   GLN  31          HG1       GLN  31   7.605  -1.397  -2.277
  203   1HE2  GLN  31          HE21      GLN  31   9.368   1.461  -3.048
  204   2HE2  GLN  31          HE22      GLN  31   8.067   2.586  -2.810
  205    H    GLN  32           HN       GLN  32   8.700  -2.892   0.794
  206    HA   GLN  32           HA       GLN  32   8.768  -3.614   2.947
  207   1HB   GLN  32          HB2       GLN  32  10.505  -5.086   1.401
  208   2HB   GLN  32          HB1       GLN  32  11.477  -4.677   2.808
  209   1HG   GLN  32          HG2       GLN  32  10.340  -6.064   4.141
  210   2HG   GLN  32          HG1       GLN  32   8.783  -5.597   3.458
  211   1HE2  GLN  32          HE21      GLN  32   8.085  -6.625   1.513
  212   2HE2  GLN  32          HE22      GLN  32   8.679  -8.189   1.090
  213    H    GLY  33           HN       GLY  33  10.092  -0.957   2.276
  214   1HA   GLY  33          HA2       GLY  33  11.509  -0.675   4.848
  215   2HA   GLY  33          HA1       GLY  33  12.117   0.091   3.385
  216    H    CYS  34           HN       CYS  34  10.815   1.751   2.388
  217    HA   CYS  34           HA       CYS  34   9.771   3.589   4.197
  218   1HB   CYS  34          HB2       CYS  34  10.685   3.900   1.778
  219   2HB   CYS  34          HB1       CYS  34   9.004   3.649   1.346
  220    H    PHE  35           HN       PHE  35   8.329   1.152   2.233
  221    HA   PHE  35           HA       PHE  35   5.641   1.842   2.374
  222   1HB   PHE  35          HB2       PHE  35   5.950   0.120   0.903
  223   2HB   PHE  35          HB1       PHE  35   7.212  -0.613   1.881
  224    HD1  PHE  35           HD1      PHE  35   3.664   0.126   2.769
  225    HD2  PHE  35           HD2      PHE  35   6.637  -2.829   2.031
  226    HE1  PHE  35           HE1      PHE  35   2.095  -1.631   3.485
  227    HE2  PHE  35           HE2      PHE  35   5.075  -4.590   2.742
  228    HZ   PHE  35           HZ       PHE  35   2.802  -3.991   3.476
  229    H    CYS  36           HN       CYS  36   7.683   0.166   4.641
  230    HA   CYS  36           HA       CYS  36   5.597  -0.588   6.436
  231   1HB   CYS  36          HB2       CYS  36   8.187  -1.342   6.157
  232   2HB   CYS  36          HB1       CYS  36   8.321  -0.253   7.534
  233    H    GLN  37           HN       GLN  37   8.064   1.982   6.549
  234    HA   GLN  37           HA       GLN  37   7.052   3.144   8.904
  235   1HB   GLN  37          HB2       GLN  37   8.540   5.070   8.296
  236   2HB   GLN  37          HB1       GLN  37   9.349   3.514   8.401
  237   1HG   GLN  37          HG2       GLN  37   9.724   3.398   6.149
  238   2HG   GLN  37          HG1       GLN  37   8.350   4.429   5.755
  239   1HE2  GLN  37          HE21      GLN  37  10.646   4.936   4.482
  240   2HE2  GLN  37          HE22      GLN  37  11.389   6.373   5.086
  241    H    TYR  38           HN       TYR  38   6.223   3.406   5.586
  242    HA   TYR  38           HA       TYR  38   5.131   5.951   5.422
  243   1HB   TYR  38          HB2       TYR  38   4.982   3.492   3.916
  244   2HB   TYR  38          HB1       TYR  38   3.404   4.270   3.966
  245    HD1  TYR  38           HD1      TYR  38   3.778   7.031   3.727
  246    HD2  TYR  38           HD2      TYR  38   6.129   3.947   1.978
  247    HE1  TYR  38           HE1      TYR  38   4.482   8.582   1.953
  248    HE2  TYR  38           HE2      TYR  38   6.840   5.489   0.200
  249    HH   TYR  38           HH       TYR  38   5.639   7.780  -0.840
  250    H    ALA  39           HN       ALA  39   4.036   3.198   7.178
  251    HA   ALA  39           HA       ALA  39   1.317   3.643   7.368
  252   1HB   ALA  39          HB1       ALA  39   1.328   2.263   9.285
  253   2HB   ALA  39          HB2       ALA  39   3.008   2.662   9.646
  254   3HB   ALA  39          HB3       ALA  39   2.619   1.673   8.238
  255    H    LYS  40           HN       LYS  40   3.884   5.524   8.637
  256    HA   LYS  40           HA       LYS  40   2.173   6.828  10.607
  257   1HB   LYS  40          HB2       LYS  40   4.678   6.170  10.932
  258   2HB   LYS  40          HB1       LYS  40   4.997   7.645  10.030
  259   1HG   LYS  40          HG2       LYS  40   4.733   8.852  11.862
  260   2HG   LYS  40          HG1       LYS  40   3.095   8.229  12.064
  261   1HD   LYS  40          HD2       LYS  40   5.592   6.822  13.007
  262   2HD   LYS  40          HD1       LYS  40   4.562   7.828  14.029
  263   1HE   LYS  40          HE2       LYS  40   2.653   6.290  13.308
  264   2HE   LYS  40          HE1       LYS  40   3.911   5.208  12.711
  265   1HZ   LYS  40          HZ1       LYS  40   4.801   4.995  14.891
  266   2HZ   LYS  40          HZ2       LYS  40   3.136   4.721  15.004
  267   3HZ   LYS  40          HZ3       LYS  40   3.784   6.201  15.504
  268    H    ASP  41           HN       ASP  41   3.413   7.275   7.437
  269    HA   ASP  41           HA       ASP  41   3.391  10.045   7.181
  270   1HB   ASP  41          HB2       ASP  41   4.302   8.549   5.474
  271   2HB   ASP  41          HB1       ASP  41   2.682   7.942   5.124
  272    HA   PRO  42           HA       PRO  42  -1.037  10.640   7.747
  273   1HB   PRO  42          HB2       PRO  42  -1.000  13.329   7.847
  274   2HB   PRO  42          HB1       PRO  42  -0.443  12.333   9.197
  275   1HG   PRO  42          HG2       PRO  42   1.157  13.732   7.089
  276   2HG   PRO  42          HG1       PRO  42   1.455  13.628   8.834
  277   1HD   PRO  42          HD2       PRO  42   2.730  12.063   6.999
  278   2HD   PRO  42          HD1       PRO  42   2.420  11.551   8.670
  279    H    THR  43           HN       THR  43   0.814  12.648   5.454
  280    HA   THR  43           HA       THR  43  -1.244  13.566   3.870
  281    HB   THR  43           HB       THR  43   0.482  13.556   1.999
  282    HG1  THR  43           HG1      THR  43   2.204  12.663   4.059
  283   1HG2  THR  43          HG21      THR  43   1.043  14.826   4.649
  284   2HG2  THR  43          HG22      THR  43   0.394  15.558   3.182
  285   3HG2  THR  43          HG23      THR  43   2.090  15.081   3.254
  286    H    TYR  44           HN       TYR  44   0.436  10.459   3.674
  287    HA   TYR  44           HA       TYR  44  -1.328   9.615   1.501
  288   1HB   TYR  44          HB2       TYR  44   1.125   8.365   2.739
  289   2HB   TYR  44          HB1       TYR  44   0.144   7.557   1.521
  290    HD1  TYR  44           HD1      TYR  44   0.575   7.912  -0.745
  291    HD2  TYR  44           HD2      TYR  44   2.105  10.667   2.112
  292    HE1  TYR  44           HE1      TYR  44   1.850   9.036  -2.522
  293    HE2  TYR  44           HE2      TYR  44   3.384  11.800   0.344
  294    HH   TYR  44           HH       TYR  44   4.282  11.347  -1.858
  295    H    GLY  45           HN       GLY  45  -1.937   9.906   4.540
  296   1HA   GLY  45          HA2       GLY  45  -2.432   7.383   5.632
  297   2HA   GLY  45          HA1       GLY  45  -3.303   8.851   6.050
  298    H    GLN  46           HN       GLN  46  -4.211   9.180   3.232
  299    HA   GLN  46           HA       GLN  46  -6.636   7.720   3.475
  300   1HB   GLN  46          HB2       GLN  46  -5.891  10.012   2.179
  301   2HB   GLN  46          HB1       GLN  46  -6.044   8.881   0.841
  302   1HG   GLN  46          HG2       GLN  46  -8.311   8.488   1.288
  303   2HG   GLN  46          HG1       GLN  46  -8.204   9.212   2.893
  304   1HE2  GLN  46          HE21      GLN  46  -9.259  11.047   2.977
  305   2HE2  GLN  46          HE22      GLN  46  -9.320  12.255   1.731
  306    H    TYR  47           HN       TYR  47  -3.627   7.189   1.859
  307    HA   TYR  47           HA       TYR  47  -4.579   5.264  -0.019
  308   1HB   TYR  47          HB2       TYR  47  -2.394   6.695  -0.034
  309   2HB   TYR  47          HB1       TYR  47  -1.770   5.347   0.908
  310    HD1  TYR  47           HD1      TYR  47  -3.035   6.370  -2.371
  311    HD2  TYR  47           HD2      TYR  47  -1.366   3.197  -0.082
  312    HE1  TYR  47           HE1      TYR  47  -2.581   5.122  -4.442
  313    HE2  TYR  47           HE2      TYR  47  -0.907   1.940  -2.145
  314    HH   TYR  47           HH       TYR  47  -1.597   1.818  -4.418
  315    H    ILE  48           HN       ILE  48  -2.721   5.032   2.994
  316    HA   ILE  48           HA       ILE  48  -2.731   2.203   3.060
  317    HB   ILE  48           HB       ILE  48  -2.328   4.074   5.389
  318   1HG1  ILE  48          HG12      ILE  48  -0.335   3.007   3.377
  319   2HG1  ILE  48          HG11      ILE  48  -0.836   4.685   3.555
  320   1HG2  ILE  48          HG21      ILE  48  -0.695   1.919   5.758
  321   2HG2  ILE  48          HG22      ILE  48  -2.111   1.181   5.010
  322   3HG2  ILE  48          HG23      ILE  48  -2.285   2.123   6.491
  323   1HD1  ILE  48          HD11      ILE  48   0.772   3.037   5.481
  324   2HD1  ILE  48          HD12      ILE  48   0.109   4.625   5.867
  325   3HD1  ILE  48          HD13      ILE  48   1.291   4.455   4.569
  326    H    ARG  49           HN       ARG  49  -4.729   4.668   4.654
  327    HA   ARG  49           HA       ARG  49  -6.275   2.684   6.048
  328   1HB   ARG  49          HB2       ARG  49  -6.609   5.668   5.773
  329   2HB   ARG  49          HB1       ARG  49  -7.680   4.656   6.732
  330   1HG   ARG  49          HG2       ARG  49  -6.098   4.269   8.346
  331   2HG   ARG  49          HG1       ARG  49  -4.748   4.545   7.243
  332   1HD   ARG  49          HD2       ARG  49  -4.975   6.867   7.360
  333   2HD   ARG  49          HD1       ARG  49  -6.615   6.766   7.998
  334    HE   ARG  49           HE       ARG  49  -5.142   5.597   9.934
  335   1HH1  ARG  49          HH11      ARG  49  -4.867   8.646   8.258
  336   2HH1  ARG  49          HH12      ARG  49  -4.137   9.461   9.599
  337   1HH2  ARG  49          HH21      ARG  49  -4.185   6.669  11.702
  338   2HH2  ARG  49          HH22      ARG  49  -3.749   8.339  11.555
  339    H    SER  50           HN       SER  50  -6.244   2.569   3.130
  340    HA   SER  50           HA       SER  50  -8.876   3.337   2.265
  341   1HB   SER  50          HB2       SER  50  -6.611   3.063   0.904
  342   2HB   SER  50          HB1       SER  50  -7.248   1.434   0.711
  343    HG   SER  50           HG       SER  50  -8.219   2.410  -0.918
  344    HA   PRO  51           HA       PRO  51 -10.861  -0.501   3.172
  345   1HB   PRO  51          HB2       PRO  51 -12.572  -0.640   0.954
  346   2HB   PRO  51          HB1       PRO  51 -12.896   0.189   2.474
  347   1HG   PRO  51          HG2       PRO  51 -12.474   1.355  -0.089
  348   2HG   PRO  51          HG1       PRO  51 -12.707   2.188   1.456
  349   1HD   PRO  51          HD2       PRO  51 -10.238   1.685  -0.055
  350   2HD   PRO  51          HD1       PRO  51 -10.567   2.898   1.198
  351    H    HIS  52           HN       HIS  52 -10.131  -0.229  -0.275
  352    HA   HIS  52           HA       HIS  52  -9.920  -3.074  -0.628
  353   1HB   HIS  52          HB2       HIS  52  -8.872  -1.316  -2.754
  354   2HB   HIS  52          HB1       HIS  52 -10.023  -2.644  -2.854
  355    HD1  HIS  52           HD1      HIS  52 -10.168   0.452  -4.005
  356    HD2  HIS  52           HD2      HIS  52 -12.357  -1.279  -0.929
  357    HE1  HIS  52           HE1      HIS  52 -12.245   1.855  -3.774
  358    HE2  HIS  52           HE2      HIS  52 -13.612   0.706  -2.005
  359    H    ALA  53           HN       ALA  53  -7.779  -0.573   0.286
  360    HA   ALA  53           HA       ALA  53  -5.377  -1.485  -0.771
  361   1HB   ALA  53          HB1       ALA  53  -5.992   0.121   1.681
  362   2HB   ALA  53          HB2       ALA  53  -5.406   0.692   0.119
  363   3HB   ALA  53          HB3       ALA  53  -4.343  -0.242   1.171
  364    H    ARG  54           HN       ARG  54  -6.623  -1.935   2.490
  365    HA   ARG  54           HA       ARG  54  -4.686  -3.714   3.370
  366   1HB   ARG  54          HB2       ARG  54  -7.547  -3.781   4.299
  367   2HB   ARG  54          HB1       ARG  54  -6.107  -4.195   5.216
  368   1HG   ARG  54          HG2       ARG  54  -5.786  -2.097   5.860
  369   2HG   ARG  54          HG1       ARG  54  -6.062  -1.462   4.238
  370   1HD   ARG  54          HD2       ARG  54  -8.412  -1.437   4.554
  371   2HD   ARG  54          HD1       ARG  54  -8.290  -2.390   6.033
  372    HE   ARG  54           HE       ARG  54  -6.834  -0.123   6.509
  373   1HH1  ARG  54          HH11      ARG  54 -10.135  -0.828   5.630
  374   2HH1  ARG  54          HH12      ARG  54 -10.779   0.568   6.427
  375   1HH2  ARG  54          HH21      ARG  54  -7.677   1.717   7.559
  376   2HH2  ARG  54          HH22      ARG  54  -9.383   2.014   7.522
  377    H    ASP  55           HN       ASP  55  -7.573  -4.246   1.523
  378    HA   ASP  55           HA       ASP  55  -7.717  -7.039   1.815
  379   1HB   ASP  55          HB2       ASP  55  -9.460  -5.355   0.864
  380   2HB   ASP  55          HB1       ASP  55  -8.635  -5.689  -0.655
  381    H    THR  56           HN       THR  56  -6.218  -4.998  -0.604
  382    HA   THR  56           HA       THR  56  -5.322  -6.999  -2.308
  383    HB   THR  56           HB       THR  56  -3.737  -4.537  -1.882
  384    HG1  THR  56           HG1      THR  56  -5.270  -3.340  -2.969
  385   1HG2  THR  56          HG21      THR  56  -2.866  -5.608  -3.703
  386   2HG2  THR  56          HG22      THR  56  -4.055  -4.549  -4.462
  387   3HG2  THR  56          HG23      THR  56  -4.430  -6.253  -4.200
  388    H    LEU  57           HN       LEU  57  -3.608  -5.344   0.321
  389    HA   LEU  57           HA       LEU  57  -1.263  -6.840   0.129
  390   1HB   LEU  57          HB2       LEU  57  -2.437  -4.950   1.996
  391   2HB   LEU  57          HB1       LEU  57  -1.330  -6.087   2.744
  392    HG   LEU  57           HG       LEU  57  -0.052  -5.133   0.428
  393   1HD1  LEU  57          HD11      LEU  57  -0.586  -2.702   1.981
  394   2HD1  LEU  57          HD12      LEU  57  -1.930  -3.272   0.991
  395   3HD1  LEU  57          HD13      LEU  57  -0.371  -2.919   0.244
  396   1HD2  LEU  57          HD21      LEU  57   0.321  -5.118   3.333
  397   2HD2  LEU  57          HD22      LEU  57   1.153  -3.820   2.477
  398   3HD2  LEU  57          HD23      LEU  57   1.461  -5.501   2.043
  399    H    THR  58           HN       THR  58  -4.111  -7.207   2.132
  400    HA   THR  58           HA       THR  58  -3.212  -9.407   3.606
  401    HB   THR  58           HB       THR  58  -6.037  -8.575   2.927
  402    HG1  THR  58           HG1      THR  58  -4.803  -7.041   4.118
  403   1HG2  THR  58          HG21      THR  58  -6.723  -9.799   4.919
  404   2HG2  THR  58          HG22      THR  58  -5.081 -10.413   5.108
  405   3HG2  THR  58          HG23      THR  58  -6.038 -10.873   3.700
  406    H    SER  59           HN       SER  59  -5.015  -9.178   0.566
  407    HA   SER  59           HA       SER  59  -5.648 -11.821   0.177
  408   1HB   SER  59          HB2       SER  59  -6.127  -9.740  -1.290
  409   2HB   SER  59          HB1       SER  59  -4.611 -10.179  -2.066
  410    HG   SER  59           HG       SER  59  -6.633 -11.092  -2.967
  411    H    CYS  60           HN       CYS  60  -2.658 -10.129  -0.310
  412    HA   CYS  60           HA       CYS  60  -1.264 -12.402  -1.379
  413   1HB   CYS  60          HB2       CYS  60  -0.898  -9.721  -1.570
  414   2HB   CYS  60          HB1       CYS  60   0.257 -10.111  -0.306
  415    H    GLY  61           HN       GLY  61  -1.468 -10.655   1.702
  416   1HA   GLY  61          HA2       GLY  61  -0.850 -11.264   3.822
  417   2HA   GLY  61          HA1       GLY  61  -0.882 -12.926   3.253
  418    H    LEU  62           HN       LEU  62   1.164 -10.076   2.584
  419    HA   LEU  62           HA       LEU  62   3.489 -11.823   3.032
  420   1HB   LEU  62          HB2       LEU  62   4.639  -9.774   1.783
  421   2HB   LEU  62          HB1       LEU  62   3.955 -11.143   0.937
  422    HG   LEU  62           HG       LEU  62   1.792  -9.542   0.932
  423   1HD1  LEU  62          HD11      LEU  62   3.273  -7.315   0.197
  424   2HD1  LEU  62          HD12      LEU  62   3.988  -7.831   1.723
  425   3HD1  LEU  62          HD13      LEU  62   2.262  -7.483   1.630
  426   1HD2  LEU  62          HD21      LEU  62   2.292  -9.081  -1.320
  427   2HD2  LEU  62          HD22      LEU  62   3.086 -10.615  -0.967
  428   3HD2  LEU  62          HD23      LEU  62   4.030  -9.126  -1.029
  429    H    ALA  63           HN       ALA  63   2.663  -8.358   3.331
  430    HA   ALA  63           HA       ALA  63   3.744  -8.351   6.003
  431   1HB   ALA  63          HB1       ALA  63   5.390  -7.622   3.878
  432   2HB   ALA  63          HB2       ALA  63   5.677  -7.339   5.595
  433   3HB   ALA  63          HB3       ALA  63   4.887  -6.102   4.618
  434    H    VAL  64           HN       VAL  64   2.680  -6.981   7.299
  435    HA   VAL  64           HA       VAL  64   0.847  -5.084   6.053
  436    HB   VAL  64           HB       VAL  64  -0.139  -6.952   7.433
  437   1HG1  VAL  64          HG11      VAL  64   0.276  -7.220   9.635
  438   2HG1  VAL  64          HG12      VAL  64   0.480  -5.491   9.919
  439   3HG1  VAL  64          HG13      VAL  64   1.798  -6.431   9.219
  440   1HG2  VAL  64          HG21      VAL  64  -1.709  -5.439   8.656
  441   2HG2  VAL  64          HG22      VAL  64  -1.474  -5.029   6.957
  442   3HG2  VAL  64          HG23      VAL  64  -0.665  -4.090   8.212
  443    HA   PRO  65           HA       PRO  65   3.251  -1.738   7.692
  444   1HB   PRO  65          HB2       PRO  65   1.183   0.059   8.102
  445   2HB   PRO  65          HB1       PRO  65   2.005  -0.201   6.561
  446   1HG   PRO  65          HG2       PRO  65  -0.574  -1.340   7.553
  447   2HG   PRO  65          HG1       PRO  65  -0.173  -0.714   5.942
  448   1HD   PRO  65          HD2       PRO  65  -0.259  -3.339   6.399
  449   2HD   PRO  65          HD1       PRO  65   0.996  -2.644   5.352
  450    H    HIS  66           HN       HIS  66   2.375   0.136   9.533
  451    HA   HIS  66           HA       HIS  66   2.220   0.519  11.768
  452   1HB   HIS  66          HB2       HIS  66   0.516  -1.972  11.613
  453   2HB   HIS  66          HB1       HIS  66   0.712  -1.022  13.082
  454    HD1  HIS  66           HD1      HIS  66  -1.240  -1.219  10.004
  455    HD2  HIS  66           HD2      HIS  66  -0.337   1.683  12.833
  456    HE1  HIS  66           HE1      HIS  66  -2.928   0.610   9.660
  457    HE2  HIS  66           HE2      HIS  66  -2.424   2.308  11.447
  458    H    CYS  67           HN       CYS  67   4.435  -1.007  10.694
  459    HA   CYS  67           HA       CYS  67   5.073  -3.039  12.643
  460   1HB   CYS  67          HB2       CYS  67   7.266  -3.114  11.440
  461   2HB   CYS  67          HB1       CYS  67   5.872  -3.379  10.399
  Start of MODEL    2
    1   1H    ALA   1          HT1       ALA   1  15.171   2.267   0.987
    2   2H    ALA   1          HT2       ALA   1  15.194   3.849   0.323
    3   3H    ALA   1          HT3       ALA   1  16.379   2.701  -0.148
    4    HA   ALA   1           HA       ALA   1  14.971   2.679  -1.893
    5   1HB   ALA   1          HB1       ALA   1  14.288   0.512  -1.957
    6   2HB   ALA   1          HB2       ALA   1  13.511   0.593  -0.376
    7   3HB   ALA   1          HB3       ALA   1  15.265   0.443  -0.490
    8    H    CYS   2           HN       CYS   2  13.663   4.424  -2.205
    9    HA   CYS   2           HA       CYS   2  10.887   4.106  -1.398
   10   1HB   CYS   2          HB2       CYS   2  12.308   5.611   0.252
   11   2HB   CYS   2          HB1       CYS   2  12.051   6.827  -0.995
   12    H    GLN   3           HN       GLN   3  11.003   3.614  -3.757
   13    HA   GLN   3           HA       GLN   3  11.564   5.663  -5.637
   14   1HB   GLN   3          HB2       GLN   3  11.193   2.994  -5.831
   15   2HB   GLN   3          HB1       GLN   3   9.622   3.557  -6.384
   16   1HG   GLN   3          HG2       GLN   3  10.606   4.800  -8.160
   17   2HG   GLN   3          HG1       GLN   3  12.228   4.521  -7.528
   18   1HE2  GLN   3          HE21      GLN   3  13.309   2.748  -8.140
   19   2HE2  GLN   3          HE22      GLN   3  12.664   1.493  -9.137
   20    H    ALA   4           HN       ALA   4   8.677   4.668  -3.915
   21    HA   ALA   4           HA       ALA   4   6.619   5.610  -3.687
   22   1HB   ALA   4          HB1       ALA   4   6.541   7.878  -3.450
   23   2HB   ALA   4          HB2       ALA   4   7.512   8.175  -4.892
   24   3HB   ALA   4          HB3       ALA   4   8.288   7.638  -3.403
   25    H    SER   5           HN       SER   5   7.615   4.496  -6.364
   26    HA   SER   5           HA       SER   5   5.388   5.557  -7.967
   27   1HB   SER   5          HB2       SER   5   7.961   6.036  -8.625
   28   2HB   SER   5          HB1       SER   5   7.729   4.487  -9.436
   29    HG   SER   5           HG       SER   5   6.208   6.857  -9.777
   30    H    GLN   6           HN       GLN   6   7.192   2.804  -6.870
   31    HA   GLN   6           HA       GLN   6   6.138   0.909  -8.663
   32   1HB   GLN   6          HB2       GLN   6   7.609   0.799  -6.073
   33   2HB   GLN   6          HB1       GLN   6   6.817  -0.661  -6.650
   34   1HG   GLN   6          HG2       GLN   6   8.075  -0.166  -8.860
   35   2HG   GLN   6          HG1       GLN   6   9.095   0.852  -7.845
   36   1HE2  GLN   6          HE21      GLN   6   8.753  -2.160  -9.112
   37   2HE2  GLN   6          HE22      GLN   6   9.738  -3.053  -8.010
   38    H    LEU   7           HN       LEU   7   4.813   2.540  -5.994
   39    HA   LEU   7           HA       LEU   7   2.782   0.482  -5.544
   40   1HB   LEU   7          HB2       LEU   7   2.822   3.023  -4.000
   41   2HB   LEU   7          HB1       LEU   7   2.394   1.405  -3.479
   42    HG   LEU   7           HG       LEU   7   5.245   2.134  -4.108
   43   1HD1  LEU   7          HD11      LEU   7   5.589   3.125  -2.116
   44   2HD1  LEU   7          HD12      LEU   7   4.400   2.120  -1.287
   45   3HD1  LEU   7          HD13      LEU   7   3.872   3.509  -2.236
   46   1HD2  LEU   7          HD21      LEU   7   4.113  -0.270  -3.653
   47   2HD2  LEU   7          HD22      LEU   7   4.502   0.208  -2.000
   48   3HD2  LEU   7          HD23      LEU   7   5.775   0.128  -3.218
   49    H    ALA   8           HN       ALA   8   3.240   3.607  -6.970
   50    HA   ALA   8           HA       ALA   8   0.746   4.722  -6.939
   51   1HB   ALA   8          HB1       ALA   8   2.672   5.834  -7.916
   52   2HB   ALA   8          HB2       ALA   8   1.325   5.814  -9.054
   53   3HB   ALA   8          HB3       ALA   8   2.667   4.688  -9.256
   54    H    VAL   9           HN       VAL   9   1.901   2.120  -8.958
   55    HA   VAL   9           HA       VAL   9  -0.245   1.948 -10.721
   56    HB   VAL   9           HB       VAL   9   1.871   0.773 -11.104
   57   1HG1  VAL   9          HG11      VAL   9   1.020  -1.274  -9.081
   58   2HG1  VAL   9          HG12      VAL   9   2.063   0.082  -8.652
   59   3HG1  VAL   9          HG13      VAL   9   2.586  -1.083  -9.869
   60   1HG2  VAL   9          HG21      VAL   9  -0.602  -0.063 -11.813
   61   2HG2  VAL   9          HG22      VAL   9   0.015  -1.508 -11.011
   62   3HG2  VAL   9          HG23      VAL   9   0.894  -0.812 -12.372
   63    H    CYS  10           HN       CYS  10   0.097   0.955  -7.441
   64    HA   CYS  10           HA       CYS  10  -2.186  -0.824  -7.462
   65   1HB   CYS  10          HB2       CYS  10  -0.049  -0.873  -5.933
   66   2HB   CYS  10          HB1       CYS  10  -0.960   0.276  -4.960
   67    H    ALA  11           HN       ALA  11  -1.420   2.464  -6.623
   68    HA   ALA  11           HA       ALA  11  -3.445   3.293  -5.024
   69   1HB   ALA  11          HB1       ALA  11  -3.142   5.239  -7.109
   70   2HB   ALA  11          HB2       ALA  11  -1.577   4.538  -6.696
   71   3HB   ALA  11          HB3       ALA  11  -2.566   5.287  -5.442
   72    H    SER  12           HN       SER  12  -3.681   2.372  -8.349
   73    HA   SER  12           HA       SER  12  -6.067   3.515  -9.119
   74   1HB   SER  12          HB2       SER  12  -4.989   0.774  -9.814
   75   2HB   SER  12          HB1       SER  12  -6.305   1.580 -10.667
   76    HG   SER  12           HG       SER  12  -4.135   1.824 -11.587
   77    H    ALA  13           HN       ALA  13  -5.524   0.526  -7.309
   78    HA   ALA  13           HA       ALA  13  -8.331  -0.025  -7.072
   79   1HB   ALA  13          HB1       ALA  13  -7.737  -2.034  -6.089
   80   2HB   ALA  13          HB2       ALA  13  -6.233  -1.384  -5.437
   81   3HB   ALA  13          HB3       ALA  13  -6.375  -1.716  -7.163
   82    H    ILE  14           HN       ILE  14  -5.899   1.622  -5.235
   83    HA   ILE  14           HA       ILE  14  -7.170   1.521  -2.700
   84    HB   ILE  14           HB       ILE  14  -5.046   3.286  -3.886
   85   1HG1  ILE  14          HG12      ILE  14  -3.880   2.254  -1.770
   86   2HG1  ILE  14          HG11      ILE  14  -5.187   1.077  -1.868
   87   1HG2  ILE  14          HG21      ILE  14  -6.290   4.775  -2.456
   88   2HG2  ILE  14          HG22      ILE  14  -4.772   4.345  -1.670
   89   3HG2  ILE  14          HG23      ILE  14  -6.277   3.587  -1.151
   90   1HD1  ILE  14          HD11      ILE  14  -3.277   0.206  -3.006
   91   2HD1  ILE  14          HD12      ILE  14  -3.119   1.672  -3.971
   92   3HD1  ILE  14          HD13      ILE  14  -4.504   0.605  -4.207
   93    H    LEU  15           HN       LEU  15  -6.856   4.255  -4.976
   94    HA   LEU  15           HA       LEU  15  -8.913   5.749  -3.673
   95   1HB   LEU  15          HB2       LEU  15  -7.443   6.132  -6.273
   96   2HB   LEU  15          HB1       LEU  15  -8.671   7.246  -5.705
   97    HG   LEU  15           HG       LEU  15  -6.362   6.602  -3.922
   98   1HD1  LEU  15          HD11      LEU  15  -5.125   8.495  -4.925
   99   2HD1  LEU  15          HD12      LEU  15  -6.301   8.528  -6.238
  100   3HD1  LEU  15          HD13      LEU  15  -5.277   7.111  -6.008
  101   1HD2  LEU  15          HD21      LEU  15  -6.759   8.875  -3.146
  102   2HD2  LEU  15          HD22      LEU  15  -8.241   7.922  -3.074
  103   3HD2  LEU  15          HD23      LEU  15  -8.007   9.090  -4.374
  104    H    SER  16           HN       SER  16  -8.857   5.037  -7.147
  105    HA   SER  16           HA       SER  16 -11.611   5.165  -7.492
  106   1HB   SER  16          HB2       SER  16 -10.809   3.444  -9.491
  107   2HB   SER  16          HB1       SER  16 -10.739   5.204  -9.572
  108    HG   SER  16           HG       SER  16  -8.720   3.420  -9.504
  109    H    GLY  17           HN       GLY  17  -9.655   2.173  -7.516
  110   1HA   GLY  17          HA2       GLY  17 -10.201   0.236  -6.241
  111   2HA   GLY  17          HA1       GLY  17 -11.855   0.815  -6.124
  112    H    ALA  18           HN       ALA  18  -9.931   0.639  -9.070
  113    HA   ALA  18           HA       ALA  18 -11.933  -0.553 -10.594
  114   1HB   ALA  18          HB1       ALA  18 -10.518   0.040 -12.193
  115   2HB   ALA  18          HB2       ALA  18  -9.447  -1.279 -11.722
  116   3HB   ALA  18          HB3       ALA  18  -9.256   0.316 -10.993
  117    H    LYS  19           HN       LYS  19  -8.885  -2.198 -10.059
  118    HA   LYS  19           HA       LYS  19 -10.091  -4.522  -8.901
  119   1HB   LYS  19          HB2       LYS  19  -8.847  -4.744 -11.648
  120   2HB   LYS  19          HB1       LYS  19  -9.453  -6.077 -10.676
  121   1HG   LYS  19          HG2       LYS  19 -11.224  -5.796 -12.054
  122   2HG   LYS  19          HG1       LYS  19 -11.681  -4.663 -10.786
  123   1HD   LYS  19          HD2       LYS  19 -11.963  -3.312 -12.604
  124   2HD   LYS  19          HD1       LYS  19 -10.257  -2.997 -12.278
  125   1HE   LYS  19          HE2       LYS  19  -9.908  -5.055 -13.873
  126   2HE   LYS  19          HE1       LYS  19 -11.515  -4.610 -14.446
  127   1HZ   LYS  19          HZ1       LYS  19 -10.746  -2.755 -15.423
  128   2HZ   LYS  19          HZ2       LYS  19  -9.261  -3.565 -15.401
  129   3HZ   LYS  19          HZ3       LYS  19  -9.621  -2.426 -14.203
  130    HA   PRO  20           HA       PRO  20  -6.003  -4.791  -7.234
  131   1HB   PRO  20          HB2       PRO  20  -5.956  -7.403  -6.487
  132   2HB   PRO  20          HB1       PRO  20  -6.869  -6.169  -5.612
  133   1HG   PRO  20          HG2       PRO  20  -7.829  -8.160  -7.631
  134   2HG   PRO  20          HG1       PRO  20  -8.577  -7.669  -6.100
  135   1HD   PRO  20          HD2       PRO  20  -9.401  -6.709  -8.491
  136   2HD   PRO  20          HD1       PRO  20  -9.461  -5.741  -7.004
  137    H    SER  21           HN       SER  21  -4.115  -6.570  -7.287
  138    HA   SER  21           HA       SER  21  -3.795  -8.107  -9.625
  139   1HB   SER  21          HB2       SER  21  -1.899  -6.551 -10.544
  140   2HB   SER  21          HB1       SER  21  -3.578  -6.223 -10.973
  141    HG   SER  21           HG       SER  21  -1.895  -4.591  -9.809
  142    H    GLY  22           HN       GLY  22  -2.055  -9.441  -9.452
  143   1HA   GLY  22          HA2       GLY  22  -0.779  -9.736  -6.986
  144   2HA   GLY  22          HA1       GLY  22  -0.254 -10.485  -8.486
  145    H    GLU  23           HN       GLU  23   0.111  -7.810  -9.754
  146    HA   GLU  23           HA       GLU  23   2.814  -7.477  -9.390
  147   1HB   GLU  23          HB2       GLU  23   1.136  -6.549 -11.174
  148   2HB   GLU  23          HB1       GLU  23   1.075  -5.146 -10.106
  149   1HG   GLU  23          HG2       GLU  23   3.714  -5.445 -10.281
  150   2HG   GLU  23          HG1       GLU  23   3.241  -6.136 -11.830
  151    H    CYS  24           HN       CYS  24   0.139  -5.765  -7.821
  152    HA   CYS  24           HA       CYS  24   1.580  -3.848  -6.452
  153   1HB   CYS  24          HB2       CYS  24  -0.889  -3.900  -6.605
  154   2HB   CYS  24          HB1       CYS  24  -0.911  -5.259  -5.486
  155    H    CYS  25           HN       CYS  25   1.377  -7.234  -5.887
  156    HA   CYS  25           HA       CYS  25   2.229  -7.139  -3.143
  157   1HB   CYS  25          HB2       CYS  25   2.065  -9.409  -5.132
  158   2HB   CYS  25          HB1       CYS  25   2.557  -9.614  -3.456
  159    H    GLY  26           HN       GLY  26   3.765  -7.886  -6.255
  160   1HA   GLY  26          HA2       GLY  26   6.339  -8.374  -5.114
  161   2HA   GLY  26          HA1       GLY  26   5.984  -8.147  -6.820
  162    H    ASN  27           HN       ASN  27   4.767  -5.541  -6.502
  163    HA   ASN  27           HA       ASN  27   7.035  -3.944  -6.755
  164   1HB   ASN  27          HB2       ASN  27   4.145  -3.212  -6.335
  165   2HB   ASN  27          HB1       ASN  27   5.404  -2.031  -6.681
  166   1HD2  ASN  27          HD21      ASN  27   6.766  -2.638  -8.651
  167   2HD2  ASN  27          HD22      ASN  27   5.885  -3.166 -10.039
  168    H    LEU  28           HN       LEU  28   4.564  -3.845  -4.251
  169    HA   LEU  28           HA       LEU  28   5.822  -2.094  -2.533
  170   1HB   LEU  28          HB2       LEU  28   4.238  -2.642  -0.947
  171   2HB   LEU  28          HB1       LEU  28   3.442  -3.069  -2.450
  172    HG   LEU  28           HG       LEU  28   4.491  -5.438  -1.923
  173   1HD1  LEU  28          HD11      LEU  28   5.402  -4.159   0.259
  174   2HD1  LEU  28          HD12      LEU  28   5.049  -5.885   0.214
  175   3HD1  LEU  28          HD13      LEU  28   3.863  -4.761   0.873
  176   1HD2  LEU  28          HD21      LEU  28   2.132  -4.835  -0.243
  177   2HD2  LEU  28          HD22      LEU  28   2.370  -6.092  -1.457
  178   3HD2  LEU  28          HD23      LEU  28   2.012  -4.440  -1.958
  179    H    ARG  29           HN       ARG  29   6.329  -5.485  -3.014
  180    HA   ARG  29           HA       ARG  29   7.735  -6.102  -0.710
  181   1HB   ARG  29          HB2       ARG  29   7.280  -7.300  -3.317
  182   2HB   ARG  29          HB1       ARG  29   8.886  -7.658  -2.702
  183   1HG   ARG  29          HG2       ARG  29   7.016  -9.300  -2.187
  184   2HG   ARG  29          HG1       ARG  29   8.057  -8.804  -0.856
  185   1HD   ARG  29          HD2       ARG  29   5.789  -7.038  -1.127
  186   2HD   ARG  29          HD1       ARG  29   5.273  -8.714  -0.953
  187    HE   ARG  29           HE       ARG  29   6.322  -7.065   1.084
  188   1HH1  ARG  29          HH11      ARG  29   6.460 -10.346  -0.098
  189   2HH1  ARG  29          HH12      ARG  29   6.820 -11.022   1.454
  190   1HH2  ARG  29          HH21      ARG  29   6.795  -7.953   3.127
  191   2HH2  ARG  29          HH22      ARG  29   7.009  -9.665   3.285
  192    H    ALA  30           HN       ALA  30   8.895  -4.976  -3.824
  193    HA   ALA  30           HA       ALA  30  11.605  -5.040  -3.397
  194   1HB   ALA  30          HB1       ALA  30  11.792  -3.808  -5.284
  195   2HB   ALA  30          HB2       ALA  30  10.611  -2.614  -4.748
  196   3HB   ALA  30          HB3       ALA  30  10.067  -4.155  -5.411
  197    H    GLN  31           HN       GLN  31   9.230  -2.975  -1.995
  198    HA   GLN  31           HA       GLN  31  11.121  -1.018  -1.032
  199   1HB   GLN  31          HB2       GLN  31   8.344  -1.275   0.054
  200   2HB   GLN  31          HB1       GLN  31   9.305   0.171  -0.216
  201   1HG   GLN  31          HG2       GLN  31   8.965  -0.895  -2.747
  202   2HG   GLN  31          HG1       GLN  31   7.411  -1.145  -1.953
  203   1HE2  GLN  31          HE21      GLN  31   9.670   1.161  -3.175
  204   2HE2  GLN  31          HE22      GLN  31   8.652   2.558  -3.014
  205    H    GLN  32           HN       GLN  32   8.754  -2.950   0.785
  206    HA   GLN  32           HA       GLN  32   8.823  -3.789   2.902
  207   1HB   GLN  32          HB2       GLN  32  10.549  -5.148   1.304
  208   2HB   GLN  32          HB1       GLN  32  11.601  -4.702   2.639
  209   1HG   GLN  32          HG2       GLN  32  10.743  -6.293   3.914
  210   2HG   GLN  32          HG1       GLN  32   9.112  -5.676   3.654
  211   1HE2  GLN  32          HE21      GLN  32   8.562  -6.121   1.121
  212   2HE2  GLN  32          HE22      GLN  32   8.662  -7.799   0.723
  213    H    GLY  33           HN       GLY  33  10.030  -1.042   2.432
  214   1HA   GLY  33          HA2       GLY  33  11.224  -0.817   5.097
  215   2HA   GLY  33          HA1       GLY  33  12.142  -0.197   3.732
  216    H    CYS  34           HN       CYS  34  11.171   1.525   2.454
  217    HA   CYS  34           HA       CYS  34  10.180   3.596   4.006
  218   1HB   CYS  34          HB2       CYS  34  11.331   3.600   1.661
  219   2HB   CYS  34          HB1       CYS  34   9.670   3.527   1.100
  220    H    PHE  35           HN       PHE  35   8.608   1.236   2.028
  221    HA   PHE  35           HA       PHE  35   6.038   2.286   1.906
  222   1HB   PHE  35          HB2       PHE  35   6.060   0.503   0.531
  223   2HB   PHE  35          HB1       PHE  35   7.344  -0.273   1.443
  224    HD1  PHE  35           HD1      PHE  35   6.735  -2.455   1.690
  225    HD2  PHE  35           HD2      PHE  35   3.842   0.573   2.444
  226    HE1  PHE  35           HE1      PHE  35   5.152  -4.171   2.456
  227    HE2  PHE  35           HE2      PHE  35   2.252  -1.138   3.222
  228    HZ   PHE  35           HZ       PHE  35   2.906  -3.512   3.232
  229    H    CYS  36           HN       CYS  36   7.535   0.237   4.313
  230    HA   CYS  36           HA       CYS  36   5.252  -0.095   5.946
  231   1HB   CYS  36          HB2       CYS  36   7.145  -1.585   6.189
  232   2HB   CYS  36          HB1       CYS  36   8.197  -0.242   6.623
  233    H    GLN  37           HN       GLN  37   7.721   2.388   5.757
  234    HA   GLN  37           HA       GLN  37   7.265   3.691   8.161
  235   1HB   GLN  37          HB2       GLN  37   8.082   4.910   5.529
  236   2HB   GLN  37          HB1       GLN  37   8.269   5.665   7.104
  237   1HG   GLN  37          HG2       GLN  37   9.792   3.865   7.774
  238   2HG   GLN  37          HG1       GLN  37   9.627   3.147   6.171
  239   1HE2  GLN  37          HE21      GLN  37   9.722   5.318   4.547
  240   2HE2  GLN  37          HE22      GLN  37  11.267   6.083   4.666
  241    H    TYR  38           HN       TYR  38   5.579   3.878   5.120
  242    HA   TYR  38           HA       TYR  38   4.064   6.191   5.626
  243   1HB   TYR  38          HB2       TYR  38   3.553   3.807   3.851
  244   2HB   TYR  38          HB1       TYR  38   2.480   5.202   3.904
  245    HD1  TYR  38           HD1      TYR  38   3.996   7.525   3.814
  246    HD2  TYR  38           HD2      TYR  38   4.940   3.788   2.021
  247    HE1  TYR  38           HE1      TYR  38   5.419   8.678   2.174
  248    HE2  TYR  38           HE2      TYR  38   6.370   4.928   0.377
  249    HH   TYR  38           HH       TYR  38   7.530   7.908   0.703
  250    H    ALA  39           HN       ALA  39   3.887   3.101   7.034
  251    HA   ALA  39           HA       ALA  39   1.247   2.635   7.527
  252   1HB   ALA  39          HB1       ALA  39   2.047   1.689   9.751
  253   2HB   ALA  39          HB2       ALA  39   3.655   2.223   9.265
  254   3HB   ALA  39          HB3       ALA  39   2.787   1.038   8.289
  255    H    LYS  40           HN       LYS  40   3.243   5.131   8.859
  256    HA   LYS  40           HA       LYS  40   0.970   6.062  10.480
  257   1HB   LYS  40          HB2       LYS  40   3.800   5.753  11.130
  258   2HB   LYS  40          HB1       LYS  40   3.181   7.353  11.512
  259   1HG   LYS  40          HG2       LYS  40   1.635   6.527  13.042
  260   2HG   LYS  40          HG1       LYS  40   1.725   4.889  12.389
  261   1HD   LYS  40          HD2       LYS  40   4.050   6.254  13.730
  262   2HD   LYS  40          HD1       LYS  40   2.882   5.263  14.605
  263   1HE   LYS  40          HE2       LYS  40   3.435   3.475  12.809
  264   2HE   LYS  40          HE1       LYS  40   4.879   4.449  12.529
  265   1HZ   LYS  40          HZ1       LYS  40   4.987   2.538  14.215
  266   2HZ   LYS  40          HZ2       LYS  40   4.162   3.585  15.256
  267   3HZ   LYS  40          HZ3       LYS  40   5.676   4.023  14.643
  268    H    ASP  41           HN       ASP  41   3.385   6.876   8.140
  269    HA   ASP  41           HA       ASP  41   3.233   9.667   8.199
  270   1HB   ASP  41          HB2       ASP  41   4.846   8.117   6.896
  271   2HB   ASP  41          HB1       ASP  41   3.600   8.122   5.646
  272    HA   PRO  42           HA       PRO  42  -0.999   9.827   6.597
  273   1HB   PRO  42          HB2       PRO  42  -1.216  12.497   7.595
  274   2HB   PRO  42          HB1       PRO  42  -1.913  11.027   8.274
  275   1HG   PRO  42          HG2       PRO  42   0.082  12.537   9.458
  276   2HG   PRO  42          HG1       PRO  42  -0.279  10.846   9.839
  277   1HD   PRO  42          HD2       PRO  42   1.871  11.985   8.108
  278   2HD   PRO  42          HD1       PRO  42   1.915  10.578   9.193
  279    H    THR  43           HN       THR  43   1.304  10.427   4.912
  280    HA   THR  43           HA       THR  43   1.042  12.982   3.732
  281    HB   THR  43           HB       THR  43   2.281  11.851   1.795
  282    HG1  THR  43           HG1      THR  43   2.614   9.743   3.640
  283   1HG2  THR  43          HG21      THR  43   4.132  11.180   3.798
  284   2HG2  THR  43          HG22      THR  43   3.214  12.566   4.388
  285   3HG2  THR  43          HG23      THR  43   4.049  12.656   2.837
  286    H    TYR  44           HN       TYR  44  -0.380   9.835   3.052
  287    HA   TYR  44           HA       TYR  44  -1.887  10.966   0.810
  288   1HB   TYR  44          HB2       TYR  44  -1.920   8.089   1.714
  289   2HB   TYR  44          HB1       TYR  44  -2.364   8.739   0.140
  290    HD1  TYR  44           HD1      TYR  44  -0.556   9.634  -1.362
  291    HD2  TYR  44           HD2      TYR  44   0.308   7.458   2.191
  292    HE1  TYR  44           HE1      TYR  44   1.722   9.207  -2.184
  293    HE2  TYR  44           HE2      TYR  44   2.589   7.027   1.379
  294    HH   TYR  44           HH       TYR  44   3.906   8.636  -1.346
  295    H    GLY  45           HN       GLY  45  -2.498   8.976   3.710
  296   1HA   GLY  45          HA2       GLY  45  -4.217   9.207   5.260
  297   2HA   GLY  45          HA1       GLY  45  -4.887  10.506   4.285
  298    H    GLN  46           HN       GLN  46  -5.510   9.497   1.946
  299    HA   GLN  46           HA       GLN  46  -7.702   7.767   2.525
  300   1HB   GLN  46          HB2       GLN  46  -6.677   8.776  -0.131
  301   2HB   GLN  46          HB1       GLN  46  -8.224   7.983   0.132
  302   1HG   GLN  46          HG2       GLN  46  -9.071   9.799   1.353
  303   2HG   GLN  46          HG1       GLN  46  -7.472  10.513   1.555
  304   1HE2  GLN  46          HE21      GLN  46  -6.368  11.079  -0.544
  305   2HE2  GLN  46          HE22      GLN  46  -7.353  11.832  -1.760
  306    H    TYR  47           HN       TYR  47  -4.466   7.315   1.466
  307    HA   TYR  47           HA       TYR  47  -4.906   4.783   0.188
  308   1HB   TYR  47          HB2       TYR  47  -2.997   6.516  -0.198
  309   2HB   TYR  47          HB1       TYR  47  -2.253   5.675   1.156
  310    HD1  TYR  47           HD1      TYR  47  -2.664   5.711  -2.345
  311    HD2  TYR  47           HD2      TYR  47  -2.079   3.086   0.951
  312    HE1  TYR  47           HE1      TYR  47  -1.813   3.985  -3.878
  313    HE2  TYR  47           HE2      TYR  47  -1.228   1.352  -0.571
  314    HH   TYR  47           HH       TYR  47  -1.349   0.741  -2.918
  315    H    ILE  48           HN       ILE  48  -3.356   5.813   3.216
  316    HA   ILE  48           HA       ILE  48  -2.869   3.206   4.162
  317    HB   ILE  48           HB       ILE  48  -3.191   5.740   5.772
  318   1HG1  ILE  48          HG12      ILE  48  -1.463   5.883   3.998
  319   2HG1  ILE  48          HG11      ILE  48  -0.774   5.947   5.617
  320   1HG2  ILE  48          HG21      ILE  48  -2.959   3.102   6.653
  321   2HG2  ILE  48          HG22      ILE  48  -2.733   4.568   7.606
  322   3HG2  ILE  48          HG23      ILE  48  -1.348   3.794   6.836
  323   1HD1  ILE  48          HD11      ILE  48  -0.424   3.966   3.492
  324   2HD1  ILE  48          HD12      ILE  48  -0.653   3.290   5.105
  325   3HD1  ILE  48          HD13      ILE  48   0.656   4.433   4.805
  326    H    ARG  49           HN       ARG  49  -5.343   5.552   5.240
  327    HA   ARG  49           HA       ARG  49  -6.775   3.471   6.618
  328   1HB   ARG  49          HB2       ARG  49  -7.561   6.345   6.114
  329   2HB   ARG  49          HB1       ARG  49  -8.361   5.242   7.225
  330   1HG   ARG  49          HG2       ARG  49  -6.315   5.103   8.559
  331   2HG   ARG  49          HG1       ARG  49  -5.523   6.223   7.449
  332   1HD   ARG  49          HD2       ARG  49  -6.699   8.026   8.209
  333   2HD   ARG  49          HD1       ARG  49  -8.105   7.059   8.652
  334    HE   ARG  49           HE       ARG  49  -5.847   7.699  10.311
  335   1HH1  ARG  49          HH11      ARG  49  -8.459   5.447   9.779
  336   2HH1  ARG  49          HH12      ARG  49  -8.498   4.911  11.425
  337   1HH2  ARG  49          HH21      ARG  49  -5.896   6.994  12.476
  338   2HH2  ARG  49          HH22      ARG  49  -7.043   5.789  12.957
  339    H    SER  50           HN       SER  50  -6.483   3.150   3.761
  340    HA   SER  50           HA       SER  50  -9.054   3.655   2.582
  341   1HB   SER  50          HB2       SER  50  -6.655   3.443   1.477
  342   2HB   SER  50          HB1       SER  50  -7.153   1.758   1.370
  343    HG   SER  50           HG       SER  50  -8.632   3.964   0.386
  344    HA   PRO  51           HA       PRO  51 -10.902  -0.162   3.844
  345   1HB   PRO  51          HB2       PRO  51 -12.969  -0.286   2.146
  346   2HB   PRO  51          HB1       PRO  51 -12.875   0.962   3.395
  347   1HG   PRO  51          HG2       PRO  51 -12.246   1.151   0.476
  348   2HG   PRO  51          HG1       PRO  51 -13.104   2.304   1.513
  349   1HD   PRO  51          HD2       PRO  51 -10.454   2.532   0.806
  350   2HD   PRO  51          HD1       PRO  51 -11.163   3.249   2.266
  351    H    HIS  52           HN       HIS  52 -10.446   0.243   0.336
  352    HA   HIS  52           HA       HIS  52 -10.477  -2.591  -0.136
  353   1HB   HIS  52          HB2       HIS  52  -9.523  -0.542  -2.114
  354   2HB   HIS  52          HB1       HIS  52 -10.312  -2.085  -2.423
  355    HD1  HIS  52           HD1      HIS  52 -12.923  -2.112  -1.405
  356    HD2  HIS  52           HD2      HIS  52 -11.208   1.547  -2.376
  357    HE1  HIS  52           HE1      HIS  52 -14.848  -0.516  -1.671
  358    HE2  HIS  52           HE2      HIS  52 -13.781   1.711  -2.171
  359    H    ALA  53           HN       ALA  53  -8.047  -0.157   0.347
  360    HA   ALA  53           HA       ALA  53  -5.843  -1.446  -0.732
  361   1HB   ALA  53          HB1       ALA  53  -5.912   0.922   0.034
  362   2HB   ALA  53          HB2       ALA  53  -4.479   0.031   0.547
  363   3HB   ALA  53          HB3       ALA  53  -5.790   0.325   1.690
  364    H    ARG  54           HN       ARG  54  -6.925  -1.404   2.615
  365    HA   ARG  54           HA       ARG  54  -5.058  -3.132   3.680
  366   1HB   ARG  54          HB2       ARG  54  -7.784  -2.267   4.454
  367   2HB   ARG  54          HB1       ARG  54  -7.159  -3.707   5.246
  368   1HG   ARG  54          HG2       ARG  54  -5.702  -2.547   6.489
  369   2HG   ARG  54          HG1       ARG  54  -5.290  -1.452   5.168
  370   1HD   ARG  54          HD2       ARG  54  -6.424  -0.358   7.108
  371   2HD   ARG  54          HD1       ARG  54  -7.235  -0.128   5.559
  372    HE   ARG  54           HE       ARG  54  -8.472  -2.301   6.599
  373   1HH1  ARG  54          HH11      ARG  54  -7.825   0.902   7.824
  374   2HH1  ARG  54          HH12      ARG  54  -9.239   0.941   8.823
  375   1HH2  ARG  54          HH21      ARG  54 -10.332  -2.251   7.913
  376   2HH2  ARG  54          HH22      ARG  54 -10.662  -0.849   8.875
  377    H    ASP  55           HN       ASP  55  -8.015  -3.827   1.979
  378    HA   ASP  55           HA       ASP  55  -8.072  -6.597   2.522
  379   1HB   ASP  55          HB2       ASP  55  -9.942  -5.032   1.600
  380   2HB   ASP  55          HB1       ASP  55  -9.237  -5.463   0.046
  381    H    THR  56           HN       THR  56  -6.784  -4.675  -0.091
  382    HA   THR  56           HA       THR  56  -5.985  -6.741  -1.768
  383    HB   THR  56           HB       THR  56  -4.412  -4.244  -1.566
  384    HG1  THR  56           HG1      THR  56  -7.049  -4.434  -2.564
  385   1HG2  THR  56          HG21      THR  56  -3.688  -4.897  -3.544
  386   2HG2  THR  56          HG22      THR  56  -5.323  -4.676  -4.166
  387   3HG2  THR  56          HG23      THR  56  -4.818  -6.250  -3.551
  388    H    LEU  57           HN       LEU  57  -4.137  -4.952   0.678
  389    HA   LEU  57           HA       LEU  57  -1.774  -6.401   0.388
  390   1HB   LEU  57          HB2       LEU  57  -2.864  -4.462   2.242
  391   2HB   LEU  57          HB1       LEU  57  -1.757  -5.588   3.008
  392    HG   LEU  57           HG       LEU  57  -0.566  -4.687   0.595
  393   1HD1  LEU  57          HD11      LEU  57  -1.676  -2.488   2.321
  394   2HD1  LEU  57          HD12      LEU  57  -1.956  -2.750   0.600
  395   3HD1  LEU  57          HD13      LEU  57  -0.358  -2.268   1.169
  396   1HD2  LEU  57          HD21      LEU  57   1.069  -3.693   2.264
  397   2HD2  LEU  57          HD22      LEU  57   0.781  -5.429   2.372
  398   3HD2  LEU  57          HD23      LEU  57   0.009  -4.334   3.519
  399    H    THR  58           HN       THR  58  -4.455  -6.758   2.612
  400    HA   THR  58           HA       THR  58  -3.434  -8.911   4.064
  401    HB   THR  58           HB       THR  58  -6.325  -8.203   3.538
  402    HG1  THR  58           HG1      THR  58  -5.841  -6.555   4.722
  403   1HG2  THR  58          HG21      THR  58  -7.005  -9.591   5.180
  404   2HG2  THR  58          HG22      THR  58  -5.489  -9.463   6.072
  405   3HG2  THR  58          HG23      THR  58  -5.591 -10.502   4.651
  406    H    SER  59           HN       SER  59  -5.454  -8.799   1.155
  407    HA   SER  59           HA       SER  59  -6.050 -11.465   0.882
  408   1HB   SER  59          HB2       SER  59  -6.701  -9.440  -0.593
  409   2HB   SER  59          HB1       SER  59  -5.236  -9.854  -1.473
  410    HG   SER  59           HG       SER  59  -6.104 -11.943  -1.798
  411    H    CYS  60           HN       CYS  60  -3.151  -9.724   0.083
  412    HA   CYS  60           HA       CYS  60  -1.812 -12.014  -1.023
  413   1HB   CYS  60          HB2       CYS  60  -1.507  -9.355  -1.385
  414   2HB   CYS  60          HB1       CYS  60  -0.262  -9.640  -0.178
  415    H    GLY  61           HN       GLY  61  -1.919 -10.273   2.045
  416   1HA   GLY  61          HA2       GLY  61  -1.019 -10.757   4.101
  417   2HA   GLY  61          HA1       GLY  61  -1.079 -12.438   3.588
  418    H    LEU  62           HN       LEU  62   0.817  -9.696   2.363
  419    HA   LEU  62           HA       LEU  62   3.230 -11.307   2.820
  420   1HB   LEU  62          HB2       LEU  62   4.271  -9.843   1.069
  421   2HB   LEU  62          HB1       LEU  62   3.009 -10.920   0.507
  422    HG   LEU  62           HG       LEU  62   1.442  -8.882   0.746
  423   1HD1  LEU  62          HD11      LEU  62   3.909  -7.732   1.591
  424   2HD1  LEU  62          HD12      LEU  62   2.318  -6.981   1.473
  425   3HD1  LEU  62          HD13      LEU  62   3.405  -6.966   0.086
  426   1HD2  LEU  62          HD21      LEU  62   2.676  -9.982  -1.349
  427   2HD2  LEU  62          HD22      LEU  62   3.398  -8.374  -1.412
  428   3HD2  LEU  62          HD23      LEU  62   1.647  -8.556  -1.485
  429    H    ALA  63           HN       ALA  63   1.914  -8.036   3.104
  430    HA   ALA  63           HA       ALA  63   3.746  -7.530   5.276
  431   1HB   ALA  63          HB1       ALA  63   4.372  -5.291   4.262
  432   2HB   ALA  63          HB2       ALA  63   3.768  -5.935   2.735
  433   3HB   ALA  63          HB3       ALA  63   5.121  -6.720   3.550
  434    H    VAL  64           HN       VAL  64   3.222  -5.595   6.491
  435    HA   VAL  64           HA       VAL  64   0.683  -4.339   5.972
  436    HB   VAL  64           HB       VAL  64   0.840  -6.558   7.699
  437   1HG1  VAL  64          HG11      VAL  64   1.679  -5.160   9.480
  438   2HG1  VAL  64          HG12      VAL  64   0.019  -5.641   9.829
  439   3HG1  VAL  64          HG13      VAL  64   0.360  -4.014   9.242
  440   1HG2  VAL  64          HG21      VAL  64  -1.600  -5.438   8.207
  441   2HG2  VAL  64          HG22      VAL  64  -1.213  -6.463   6.826
  442   3HG2  VAL  64          HG23      VAL  64  -1.164  -4.708   6.662
  443    HA   PRO  65           HA       PRO  65   2.677  -0.925   7.959
  444   1HB   PRO  65          HB2       PRO  65   0.661   0.504   8.955
  445   2HB   PRO  65          HB1       PRO  65   0.783   0.224   7.210
  446   1HG   PRO  65          HG2       PRO  65  -0.812  -1.312   9.246
  447   2HG   PRO  65          HG1       PRO  65  -1.386  -0.575   7.733
  448   1HD   PRO  65          HD2       PRO  65  -0.756  -3.177   7.875
  449   2HD   PRO  65          HD1       PRO  65  -0.392  -2.220   6.422
  450    H    HIS  66           HN       HIS  66   2.402  -3.339   9.618
  451    HA   HIS  66           HA       HIS  66   2.675  -2.050  12.237
  452   1HB   HIS  66          HB2       HIS  66   1.073  -4.502  11.551
  453   2HB   HIS  66          HB1       HIS  66   1.720  -4.271  13.172
  454    HD1  HIS  66           HD1      HIS  66  -1.045  -3.290  10.975
  455    HD2  HIS  66           HD2      HIS  66   0.652  -1.943  14.516
  456    HE1  HIS  66           HE1      HIS  66  -2.741  -1.740  11.992
  457    HE2  HIS  66           HE2      HIS  66  -1.660  -0.875  14.092
  458    H    CYS  67           HN       CYS  67   4.788  -2.567  10.541
  459    HA   CYS  67           HA       CYS  67   6.050  -5.033  10.779
  460   1HB   CYS  67          HB2       CYS  67   7.475  -2.370  10.737
  461   2HB   CYS  67          HB1       CYS  67   8.083  -3.917  10.160
  Start of MODEL    3
    1   1H    ALA   1          HT1       ALA   1   8.248  10.041   0.838
    2   2H    ALA   1          HT2       ALA   1   8.547  11.724   0.992
    3   3H    ALA   1          HT3       ALA   1   9.736  10.590   1.488
    4    HA   ALA   1           HA       ALA   1   8.759  10.677  -1.265
    5   1HB   ALA   1          HB1       ALA   1  11.208  12.162  -0.398
    6   2HB   ALA   1          HB2       ALA   1   9.626  12.940  -0.367
    7   3HB   ALA   1          HB3       ALA   1  10.274  12.319  -1.885
    8    H    CYS   2           HN       CYS   2   9.118   8.432  -1.303
    9    HA   CYS   2           HA       CYS   2  11.925   7.605  -0.973
   10   1HB   CYS   2          HB2       CYS   2   9.358   6.305  -0.360
   11   2HB   CYS   2          HB1       CYS   2  10.522   5.264  -1.172
   12    H    GLN   3           HN       GLN   3   9.062   6.831  -2.961
   13    HA   GLN   3           HA       GLN   3  10.628   7.033  -5.376
   14   1HB   GLN   3          HB2       GLN   3  10.692   4.591  -4.202
   15   2HB   GLN   3          HB1       GLN   3   9.255   4.423  -5.200
   16   1HG   GLN   3          HG2       GLN   3  10.429   4.341  -7.101
   17   2HG   GLN   3          HG1       GLN   3  11.550   5.598  -6.581
   18   1HE2  GLN   3          HE21      GLN   3  11.365   2.475  -7.456
   19   2HE2  GLN   3          HE22      GLN   3  12.737   1.839  -6.620
   20    H    ALA   4           HN       ALA   4   7.593   5.619  -4.141
   21    HA   ALA   4           HA       ALA   4   5.421   5.900  -4.759
   22   1HB   ALA   4          HB1       ALA   4   6.081   8.428  -6.199
   23   2HB   ALA   4          HB2       ALA   4   6.254   8.357  -4.445
   24   3HB   ALA   4          HB3       ALA   4   4.688   8.038  -5.192
   25    H    SER   5           HN       SER   5   7.261   4.488  -6.507
   26    HA   SER   5           HA       SER   5   5.863   4.875  -9.072
   27   1HB   SER   5          HB2       SER   5   8.750   4.345  -8.487
   28   2HB   SER   5          HB1       SER   5   8.049   3.708  -9.975
   29    HG   SER   5           HG       SER   5   8.553   5.652 -10.654
   30    H    GLN   6           HN       GLN   6   7.325   2.551  -6.851
   31    HA   GLN   6           HA       GLN   6   6.442   0.280  -8.302
   32   1HB   GLN   6          HB2       GLN   6   7.589   0.620  -5.540
   33   2HB   GLN   6          HB1       GLN   6   7.135  -0.946  -6.197
   34   1HG   GLN   6          HG2       GLN   6   8.745   0.256  -8.144
   35   2HG   GLN   6          HG1       GLN   6   9.530   0.577  -6.598
   36   1HE2  GLN   6          HE21      GLN   6  11.141  -0.825  -6.461
   37   2HE2  GLN   6          HE22      GLN   6  11.015  -2.532  -6.692
   38    H    LEU   7           HN       LEU   7   4.792   2.484  -6.460
   39    HA   LEU   7           HA       LEU   7   2.800   0.490  -5.611
   40   1HB   LEU   7          HB2       LEU   7   2.907   3.276  -4.522
   41   2HB   LEU   7          HB1       LEU   7   2.220   1.833  -3.800
   42    HG   LEU   7           HG       LEU   7   5.184   2.053  -4.219
   43   1HD1  LEU   7          HD11      LEU   7   3.830   3.939  -2.770
   44   2HD1  LEU   7          HD12      LEU   7   5.509   3.464  -2.518
   45   3HD1  LEU   7          HD13      LEU   7   4.231   2.737  -1.544
   46   1HD2  LEU   7          HD21      LEU   7   3.340   0.199  -2.987
   47   2HD2  LEU   7          HD22      LEU   7   4.554   0.755  -1.836
   48   3HD2  LEU   7          HD23      LEU   7   5.055   0.008  -3.353
   49    H    ALA   8           HN       ALA   8   3.389   3.196  -7.642
   50    HA   ALA   8           HA       ALA   8   0.980   4.435  -7.925
   51   1HB   ALA   8          HB1       ALA   8   1.824   5.353  -9.805
   52   2HB   ALA   8          HB2       ALA   8   2.313   3.793 -10.468
   53   3HB   ALA   8          HB3       ALA   8   3.309   4.582  -9.246
   54    H    VAL   9           HN       VAL   9   2.007   1.555  -9.669
   55    HA   VAL   9           HA       VAL   9  -0.317   1.096 -11.101
   56    HB   VAL   9           HB       VAL   9   1.778  -0.076 -11.574
   57   1HG1  VAL   9          HG11      VAL   9   2.685  -0.539  -9.456
   58   2HG1  VAL   9          HG12      VAL   9   2.286  -2.114 -10.140
   59   3HG1  VAL   9          HG13      VAL   9   1.233  -1.387  -8.927
   60   1HG2  VAL   9          HG21      VAL   9   0.828  -2.076 -12.301
   61   2HG2  VAL   9          HG22      VAL   9  -0.555  -0.991 -12.162
   62   3HG2  VAL   9          HG23      VAL   9  -0.243  -2.186 -10.904
   63    H    CYS  10           HN       CYS  10   0.345   0.620  -7.766
   64    HA   CYS  10           HA       CYS  10  -1.872  -1.215  -7.350
   65   1HB   CYS  10          HB2       CYS  10   0.421  -1.100  -6.073
   66   2HB   CYS  10          HB1       CYS  10  -0.393   0.142  -5.127
   67    H    ALA  11           HN       ALA  11  -1.067   2.145  -6.950
   68    HA   ALA  11           HA       ALA  11  -2.913   3.130  -5.225
   69   1HB   ALA  11          HB1       ALA  11  -1.165   4.363  -6.657
   70   2HB   ALA  11          HB2       ALA  11  -2.643   5.217  -6.215
   71   3HB   ALA  11          HB3       ALA  11  -2.471   4.533  -7.831
   72    H    SER  12           HN       SER  12  -3.498   1.886  -8.402
   73    HA   SER  12           HA       SER  12  -5.985   2.920  -8.989
   74   1HB   SER  12          HB2       SER  12  -4.494   1.374 -10.405
   75   2HB   SER  12          HB1       SER  12  -5.283   0.046  -9.554
   76    HG   SER  12           HG       SER  12  -6.743   2.075 -10.877
   77    H    ALA  13           HN       ALA  13  -5.160   0.109  -7.009
   78    HA   ALA  13           HA       ALA  13  -7.891  -0.511  -6.418
   79   1HB   ALA  13          HB1       ALA  13  -5.693  -2.017  -6.422
   80   2HB   ALA  13          HB2       ALA  13  -7.108  -2.405  -5.443
   81   3HB   ALA  13          HB3       ALA  13  -5.727  -1.587  -4.711
   82    H    ILE  14           HN       ILE  14  -5.301   1.284  -4.898
   83    HA   ILE  14           HA       ILE  14  -6.528   1.532  -2.342
   84    HB   ILE  14           HB       ILE  14  -4.329   3.090  -3.696
   85   1HG1  ILE  14          HG12      ILE  14  -3.198   1.999  -1.529
   86   2HG1  ILE  14          HG11      ILE  14  -4.501   0.835  -1.761
   87   1HG2  ILE  14          HG21      ILE  14  -4.100   3.730  -1.057
   88   2HG2  ILE  14          HG22      ILE  14  -5.848   3.757  -1.285
   89   3HG2  ILE  14          HG23      ILE  14  -4.812   4.768  -2.292
   90   1HD1  ILE  14          HD11      ILE  14  -3.441  -0.130  -3.455
   91   2HD1  ILE  14          HD12      ILE  14  -2.031   0.828  -3.004
   92   3HD1  ILE  14          HD13      ILE  14  -3.138   1.417  -4.243
   93    H    LEU  15           HN       LEU  15  -6.016   3.995  -4.879
   94    HA   LEU  15           HA       LEU  15  -7.847   5.831  -3.739
   95   1HB   LEU  15          HB2       LEU  15  -6.562   5.640  -6.452
   96   2HB   LEU  15          HB1       LEU  15  -7.671   6.932  -6.034
   97    HG   LEU  15           HG       LEU  15  -5.196   6.382  -4.415
   98   1HD1  LEU  15          HD11      LEU  15  -3.871   7.576  -5.800
   99   2HD1  LEU  15          HD12      LEU  15  -5.191   8.604  -6.358
  100   3HD1  LEU  15          HD13      LEU  15  -4.997   6.980  -7.019
  101   1HD2  LEU  15          HD21      LEU  15  -6.406   9.064  -4.745
  102   2HD2  LEU  15          HD22      LEU  15  -5.648   8.325  -3.335
  103   3HD2  LEU  15          HD23      LEU  15  -7.298   7.890  -3.778
  104    H    SER  16           HN       SER  16  -8.164   4.534  -7.027
  105    HA   SER  16           HA       SER  16 -10.895   4.931  -7.246
  106   1HB   SER  16          HB2       SER  16  -8.946   4.042  -8.930
  107   2HB   SER  16          HB1       SER  16  -9.876   2.564  -8.681
  108    HG   SER  16           HG       SER  16 -11.094   5.026  -9.355
  109    H    GLY  17           HN       GLY  17  -9.446   1.683  -6.954
  110   1HA   GLY  17          HA2       GLY  17 -10.111   0.200  -5.140
  111   2HA   GLY  17          HA1       GLY  17 -11.695   0.958  -5.183
  112    H    ALA  18           HN       ALA  18 -10.016   0.143  -8.120
  113    HA   ALA  18           HA       ALA  18 -12.136  -1.313  -9.195
  114   1HB   ALA  18          HB1       ALA  18  -9.312  -0.858  -9.926
  115   2HB   ALA  18          HB2       ALA  18 -10.782  -0.608 -10.868
  116   3HB   ALA  18          HB3       ALA  18 -10.121  -2.232 -10.679
  117    H    LYS  19           HN       LYS  19  -8.991  -2.780  -8.677
  118    HA   LYS  19           HA       LYS  19  -9.864  -4.804  -6.915
  119   1HB   LYS  19          HB2       LYS  19  -9.521  -6.701  -8.625
  120   2HB   LYS  19          HB1       LYS  19 -11.054  -5.840  -8.639
  121   1HG   LYS  19          HG2       LYS  19 -10.581  -5.919 -10.872
  122   2HG   LYS  19          HG1       LYS  19  -9.864  -4.365 -10.445
  123   1HD   LYS  19          HD2       LYS  19  -7.776  -6.010  -9.971
  124   2HD   LYS  19          HD1       LYS  19  -8.580  -6.885 -11.276
  125   1HE   LYS  19          HE2       LYS  19  -7.297  -5.520 -12.552
  126   2HE   LYS  19          HE1       LYS  19  -8.661  -4.428 -12.313
  127   1HZ   LYS  19          HZ1       LYS  19  -7.062  -3.033 -11.628
  128   2HZ   LYS  19          HZ2       LYS  19  -5.959  -4.267 -11.281
  129   3HZ   LYS  19          HZ3       LYS  19  -7.171  -3.879 -10.166
  130    HA   PRO  20           HA       PRO  20  -5.465  -4.978  -6.483
  131   1HB   PRO  20          HB2       PRO  20  -5.224  -7.251  -5.035
  132   2HB   PRO  20          HB1       PRO  20  -5.861  -5.751  -4.351
  133   1HG   PRO  20          HG2       PRO  20  -7.341  -8.148  -5.367
  134   2HG   PRO  20          HG1       PRO  20  -7.631  -7.193  -3.901
  135   1HD   PRO  20          HD2       PRO  20  -9.085  -6.877  -6.169
  136   2HD   PRO  20          HD1       PRO  20  -8.754  -5.542  -5.048
  137    H    SER  21           HN       SER  21  -3.754  -6.990  -6.461
  138    HA   SER  21           HA       SER  21  -4.222  -9.011  -8.392
  139   1HB   SER  21          HB2       SER  21  -3.754  -6.617  -9.577
  140   2HB   SER  21          HB1       SER  21  -2.102  -7.207  -9.396
  141    HG   SER  21           HG       SER  21  -2.465  -8.645 -10.888
  142    H    GLY  22           HN       GLY  22  -1.574  -9.377  -9.241
  143   1HA   GLY  22          HA2       GLY  22  -0.340 -10.135  -6.684
  144   2HA   GLY  22          HA1       GLY  22  -0.024 -10.899  -8.234
  145    H    GLU  23           HN       GLU  23   0.200  -8.233  -9.556
  146    HA   GLU  23           HA       GLU  23   2.948  -7.933  -9.491
  147   1HB   GLU  23          HB2       GLU  23   1.110  -7.095 -11.159
  148   2HB   GLU  23          HB1       GLU  23   1.147  -5.637 -10.166
  149   1HG   GLU  23          HG2       GLU  23   3.798  -6.161 -10.637
  150   2HG   GLU  23          HG1       GLU  23   3.014  -6.595 -12.153
  151    H    CYS  24           HN       CYS  24   0.446  -5.943  -7.926
  152    HA   CYS  24           HA       CYS  24   2.058  -4.058  -6.741
  153   1HB   CYS  24          HB2       CYS  24  -0.351  -3.842  -6.706
  154   2HB   CYS  24          HB1       CYS  24  -0.501  -5.276  -5.697
  155    H    CYS  25           HN       CYS  25   1.584  -7.367  -5.863
  156    HA   CYS  25           HA       CYS  25   2.554  -7.215  -3.205
  157   1HB   CYS  25          HB2       CYS  25   2.602  -9.584  -5.085
  158   2HB   CYS  25          HB1       CYS  25   2.779  -9.643  -3.336
  159    H    GLY  26           HN       GLY  26   4.136  -8.507  -6.132
  160   1HA   GLY  26          HA2       GLY  26   6.679  -8.798  -5.043
  161   2HA   GLY  26          HA1       GLY  26   6.345  -8.562  -6.751
  162    H    ASN  27           HN       ASN  27   5.115  -5.911  -6.252
  163    HA   ASN  27           HA       ASN  27   7.460  -4.378  -6.501
  164   1HB   ASN  27          HB2       ASN  27   4.579  -3.548  -6.203
  165   2HB   ASN  27          HB1       ASN  27   5.893  -2.431  -6.558
  166   1HD2  ASN  27          HD21      ASN  27   7.293  -3.220  -8.465
  167   2HD2  ASN  27          HD22      ASN  27   6.412  -3.737  -9.858
  168    H    LEU  28           HN       LEU  28   4.835  -3.974  -4.196
  169    HA   LEU  28           HA       LEU  28   6.226  -2.372  -2.425
  170   1HB   LEU  28          HB2       LEU  28   4.525  -2.918  -0.767
  171   2HB   LEU  28          HB1       LEU  28   3.816  -2.568  -2.331
  172    HG   LEU  28           HG       LEU  28   3.996  -5.232  -2.535
  173   1HD1  LEU  28          HD11      LEU  28   4.963  -5.242  -0.169
  174   2HD1  LEU  28          HD12      LEU  28   3.649  -6.360  -0.525
  175   3HD1  LEU  28          HD13      LEU  28   3.323  -4.874   0.363
  176   1HD2  LEU  28          HD21      LEU  28   1.740  -5.166  -2.512
  177   2HD2  LEU  28          HD22      LEU  28   2.003  -3.424  -2.423
  178   3HD2  LEU  28          HD23      LEU  28   1.673  -4.343  -0.954
  179    H    ARG  29           HN       ARG  29   6.267  -5.806  -2.837
  180    HA   ARG  29           HA       ARG  29   7.323  -6.547  -0.372
  181   1HB   ARG  29          HB2       ARG  29   7.023  -7.776  -3.010
  182   2HB   ARG  29          HB1       ARG  29   8.436  -8.345  -2.138
  183   1HG   ARG  29          HG2       ARG  29   6.252  -9.638  -1.878
  184   2HG   ARG  29          HG1       ARG  29   7.169  -9.257  -0.421
  185   1HD   ARG  29          HD2       ARG  29   5.163  -7.267  -1.248
  186   2HD   ARG  29          HD1       ARG  29   4.525  -8.815  -0.701
  187    HE   ARG  29           HE       ARG  29   5.623  -6.777   0.924
  188   1HH1  ARG  29          HH11      ARG  29   5.515 -10.250   0.600
  189   2HH1  ARG  29          HH12      ARG  29   5.746 -10.541   2.292
  190   1HH2  ARG  29          HH21      ARG  29   5.927  -7.157   3.150
  191   2HH2  ARG  29          HH22      ARG  29   5.980  -8.784   3.740
  192    H    ALA  30           HN       ALA  30   8.880  -5.696  -3.401
  193    HA   ALA  30           HA       ALA  30  11.519  -6.082  -2.690
  194   1HB   ALA  30          HB1       ALA  30  10.527  -3.824  -4.419
  195   2HB   ALA  30          HB2       ALA  30  10.676  -5.493  -4.969
  196   3HB   ALA  30          HB3       ALA  30  12.111  -4.598  -4.470
  197    H    GLN  31           HN       GLN  31   9.274  -3.692  -1.669
  198    HA   GLN  31           HA       GLN  31  11.256  -1.849  -0.667
  199   1HB   GLN  31          HB2       GLN  31   8.335  -1.862   0.059
  200   2HB   GLN  31          HB1       GLN  31   9.447  -0.501   0.039
  201   1HG   GLN  31          HG2       GLN  31   9.601  -0.955  -2.491
  202   2HG   GLN  31          HG1       GLN  31   8.122  -1.885  -2.252
  203   1HE2  GLN  31          HE21      GLN  31   9.536   1.230  -2.450
  204   2HE2  GLN  31          HE22      GLN  31   8.073   2.150  -2.290
  205    H    GLN  32           HN       GLN  32   8.581  -3.460   1.040
  206    HA   GLN  32           HA       GLN  32   8.396  -4.173   3.188
  207   1HB   GLN  32          HB2       GLN  32  10.189  -5.722   1.830
  208   2HB   GLN  32          HB1       GLN  32  11.098  -5.299   3.278
  209   1HG   GLN  32          HG2       GLN  32  10.022  -6.888   4.375
  210   2HG   GLN  32          HG1       GLN  32   8.519  -5.998   4.132
  211   1HE2  GLN  32          HE21      GLN  32   8.250  -6.247   1.395
  212   2HE2  GLN  32          HE22      GLN  32   7.945  -7.901   1.004
  213    H    GLY  33           HN       GLY  33   9.843  -1.554   2.670
  214   1HA   GLY  33          HA2       GLY  33  10.882  -1.256   5.405
  215   2HA   GLY  33          HA1       GLY  33  11.825  -0.650   4.049
  216    H    CYS  34           HN       CYS  34  10.891   1.043   2.729
  217    HA   CYS  34           HA       CYS  34   9.775   3.121   4.194
  218   1HB   CYS  34          HB2       CYS  34  11.042   3.111   1.913
  219   2HB   CYS  34          HB1       CYS  34   9.415   2.973   1.259
  220    H    PHE  35           HN       PHE  35   8.374   0.667   2.197
  221    HA   PHE  35           HA       PHE  35   5.751   1.672   2.035
  222   1HB   PHE  35          HB2       PHE  35   5.972   0.008   0.501
  223   2HB   PHE  35          HB1       PHE  35   7.135  -0.869   1.485
  224    HD1  PHE  35           HD1      PHE  35   6.453  -3.035   1.701
  225    HD2  PHE  35           HD2      PHE  35   3.559   0.066   2.050
  226    HE1  PHE  35           HE1      PHE  35   4.739  -4.706   2.250
  227    HE2  PHE  35           HE2      PHE  35   1.837  -1.603   2.605
  228    HZ   PHE  35           HZ       PHE  35   2.425  -3.992   2.706
  229    H    CYS  36           HN       CYS  36   7.369  -0.400   4.330
  230    HA   CYS  36           HA       CYS  36   5.092  -1.048   5.889
  231   1HB   CYS  36          HB2       CYS  36   7.550  -2.051   5.838
  232   2HB   CYS  36          HB1       CYS  36   7.795  -0.901   7.148
  233    H    GLN  37           HN       GLN  37   7.729   1.273   6.481
  234    HA   GLN  37           HA       GLN  37   6.589   2.439   8.743
  235   1HB   GLN  37          HB2       GLN  37   8.218   4.220   8.458
  236   2HB   GLN  37          HB1       GLN  37   8.971   2.658   8.164
  237   1HG   GLN  37          HG2       GLN  37   9.816   3.937   6.454
  238   2HG   GLN  37          HG1       GLN  37   8.444   3.146   5.680
  239   1HE2  GLN  37          HE21      GLN  37   8.000   4.658   4.163
  240   2HE2  GLN  37          HE22      GLN  37   7.480   6.266   4.521
  241    H    TYR  38           HN       TYR  38   6.007   2.865   5.382
  242    HA   TYR  38           HA       TYR  38   4.962   5.431   5.258
  243   1HB   TYR  38          HB2       TYR  38   4.891   3.040   3.633
  244   2HB   TYR  38          HB1       TYR  38   3.331   3.856   3.592
  245    HD1  TYR  38           HD1      TYR  38   3.707   6.586   3.435
  246    HD2  TYR  38           HD2      TYR  38   6.280   3.576   1.882
  247    HE1  TYR  38           HE1      TYR  38   4.586   8.193   1.796
  248    HE2  TYR  38           HE2      TYR  38   7.167   5.174   0.238
  249    HH   TYR  38           HH       TYR  38   7.374   7.563  -0.081
  250    H    ALA  39           HN       ALA  39   3.698   2.601   6.772
  251    HA   ALA  39           HA       ALA  39   0.979   3.085   6.782
  252   1HB   ALA  39          HB1       ALA  39   0.861   1.350   8.198
  253   2HB   ALA  39          HB2       ALA  39   2.037   2.051   9.311
  254   3HB   ALA  39          HB3       ALA  39   2.587   1.196   7.870
  255    H    LYS  40           HN       LYS  40   3.479   4.798   8.394
  256    HA   LYS  40           HA       LYS  40   1.486   6.246  10.008
  257   1HB   LYS  40          HB2       LYS  40   3.875   5.044  10.804
  258   2HB   LYS  40          HB1       LYS  40   4.244   6.761  10.750
  259   1HG   LYS  40          HG2       LYS  40   2.028   7.000  12.095
  260   2HG   LYS  40          HG1       LYS  40   2.296   5.296  12.467
  261   1HD   LYS  40          HD2       LYS  40   4.461   7.340  12.846
  262   2HD   LYS  40          HD1       LYS  40   3.238   7.057  14.087
  263   1HE   LYS  40          HE2       LYS  40   4.695   4.725  12.935
  264   2HE   LYS  40          HE1       LYS  40   5.522   5.752  14.105
  265   1HZ   LYS  40          HZ1       LYS  40   3.200   5.366  15.341
  266   2HZ   LYS  40          HZ2       LYS  40   4.546   4.366  15.561
  267   3HZ   LYS  40          HZ3       LYS  40   3.317   3.906  14.493
  268    H    ASP  41           HN       ASP  41   2.600   6.575   7.140
  269    HA   ASP  41           HA       ASP  41   3.897   9.141   7.208
  270   1HB   ASP  41          HB2       ASP  41   4.480   7.606   5.441
  271   2HB   ASP  41          HB1       ASP  41   2.792   7.470   4.944
  272    HA   PRO  42           HA       PRO  42  -0.109  11.204   7.427
  273   1HB   PRO  42          HB2       PRO  42   0.825  13.677   7.922
  274   2HB   PRO  42          HB1       PRO  42   0.810  12.417   9.162
  275   1HG   PRO  42          HG2       PRO  42   3.076  13.363   7.449
  276   2HG   PRO  42          HG1       PRO  42   3.066  12.983   9.182
  277   1HD   PRO  42          HD2       PRO  42   3.982  11.264   7.268
  278   2HD   PRO  42          HD1       PRO  42   3.292  10.730   8.814
  279    H    THR  43           HN       THR  43   2.561  11.920   5.307
  280    HA   THR  43           HA       THR  43   1.563  14.009   3.793
  281    HB   THR  43           HB       THR  43   2.830  12.177   2.021
  282    HG1  THR  43           HG1      THR  43   4.253  12.476   4.445
  283   1HG2  THR  43          HG21      THR  43   3.510  14.260   1.547
  284   2HG2  THR  43          HG22      THR  43   4.808  13.858   2.672
  285   3HG2  THR  43          HG23      THR  43   3.417  14.791   3.226
  286    H    TYR  44           HN       TYR  44   1.026  10.525   3.329
  287    HA   TYR  44           HA       TYR  44  -0.912  11.069   1.228
  288   1HB   TYR  44          HB2       TYR  44   0.224   8.518   2.373
  289   2HB   TYR  44          HB1       TYR  44  -1.080   8.530   1.190
  290    HD1  TYR  44           HD1      TYR  44  -0.650   9.535  -1.080
  291    HD2  TYR  44           HD2      TYR  44   2.474   8.783   1.708
  292    HE1  TYR  44           HE1      TYR  44   0.998   9.668  -2.900
  293    HE2  TYR  44           HE2      TYR  44   4.131   8.915  -0.104
  294    HH   TYR  44           HH       TYR  44   3.231   8.961  -3.418
  295    H    GLY  45           HN       GLY  45  -1.083   8.761   3.926
  296   1HA   GLY  45          HA2       GLY  45  -2.678   8.495   5.574
  297   2HA   GLY  45          HA1       GLY  45  -3.346  10.054   5.120
  298    H    GLN  46           HN       GLN  46  -4.247   9.796   2.636
  299    HA   GLN  46           HA       GLN  46  -6.574   8.228   2.937
  300   1HB   GLN  46          HB2       GLN  46  -7.134   8.955   0.682
  301   2HB   GLN  46          HB1       GLN  46  -6.520  10.306   1.624
  302   1HG   GLN  46          HG2       GLN  46  -4.239   9.631   0.532
  303   2HG   GLN  46          HG1       GLN  46  -5.282   8.874  -0.670
  304   1HE2  GLN  46          HE21      GLN  46  -3.646  11.610   0.066
  305   2HE2  GLN  46          HE22      GLN  46  -4.544  12.756  -0.880
  306    H    TYR  47           HN       TYR  47  -3.459   7.597   1.594
  307    HA   TYR  47           HA       TYR  47  -4.254   5.407  -0.057
  308   1HB   TYR  47          HB2       TYR  47  -2.112   6.909  -0.161
  309   2HB   TYR  47          HB1       TYR  47  -1.495   5.708   0.968
  310    HD1  TYR  47           HD1      TYR  47  -0.997   3.458   0.264
  311    HD2  TYR  47           HD2      TYR  47  -2.643   6.286  -2.451
  312    HE1  TYR  47           HE1      TYR  47  -0.432   1.971  -1.613
  313    HE2  TYR  47           HE2      TYR  47  -2.086   4.807  -4.339
  314    HH   TYR  47           HH       TYR  47  -0.009   2.639  -4.426
  315    H    ILE  48           HN       ILE  48  -2.499   5.635   3.024
  316    HA   ILE  48           HA       ILE  48  -2.489   2.840   3.485
  317    HB   ILE  48           HB       ILE  48  -2.161   5.046   5.519
  318   1HG1  ILE  48          HG12      ILE  48  -0.590   5.267   3.622
  319   2HG1  ILE  48          HG11      ILE  48   0.236   4.850   5.120
  320   1HG2  ILE  48          HG21      ILE  48  -2.453   2.367   5.966
  321   2HG2  ILE  48          HG22      ILE  48  -1.620   3.492   7.038
  322   3HG2  ILE  48          HG23      ILE  48  -0.701   2.538   5.875
  323   1HD1  ILE  48          HD11      ILE  48   1.116   3.622   3.202
  324   2HD1  ILE  48          HD12      ILE  48  -0.477   2.917   2.927
  325   3HD1  ILE  48          HD13      ILE  48   0.411   2.541   4.404
  326    H    ARG  49           HN       ARG  49  -4.409   5.486   4.911
  327    HA   ARG  49           HA       ARG  49  -6.095   3.627   6.317
  328   1HB   ARG  49          HB2       ARG  49  -6.479   6.599   5.948
  329   2HB   ARG  49          HB1       ARG  49  -7.268   5.580   7.144
  330   1HG   ARG  49          HG2       ARG  49  -5.145   5.176   8.242
  331   2HG   ARG  49          HG1       ARG  49  -4.309   6.125   7.010
  332   1HD   ARG  49          HD2       ARG  49  -6.516   7.271   8.698
  333   2HD   ARG  49          HD1       ARG  49  -4.832   7.283   9.219
  334    HE   ARG  49           HE       ARG  49  -5.248   8.389   6.597
  335   1HH1  ARG  49          HH11      ARG  49  -5.211   9.068  10.020
  336   2HH1  ARG  49          HH12      ARG  49  -4.904  10.759   9.808
  337   1HH2  ARG  49          HH21      ARG  49  -4.844  10.613   6.317
  338   2HH2  ARG  49          HH22      ARG  49  -4.696  11.636   7.706
  339    H    SER  50           HN       SER  50  -6.052   3.380   3.436
  340    HA   SER  50           HA       SER  50  -8.569   4.360   2.462
  341   1HB   SER  50          HB2       SER  50  -6.311   3.786   1.188
  342   2HB   SER  50          HB1       SER  50  -7.108   2.221   1.057
  343    HG   SER  50           HG       SER  50  -8.161   3.074  -0.537
  344    HA   PRO  51           HA       PRO  51 -11.087   0.987   3.792
  345   1HB   PRO  51          HB2       PRO  51 -12.930   0.906   1.786
  346   2HB   PRO  51          HB1       PRO  51 -12.927   2.140   3.050
  347   1HG   PRO  51          HG2       PRO  51 -11.881   2.293   0.251
  348   2HG   PRO  51          HG1       PRO  51 -12.806   3.496   1.168
  349   1HD   PRO  51          HD2       PRO  51 -10.130   3.671   0.848
  350   2HD   PRO  51          HD1       PRO  51 -10.946   4.233   2.321
  351    H    HIS  52           HN       HIS  52 -10.291   0.974   0.326
  352    HA   HIS  52           HA       HIS  52 -10.516  -1.891   0.145
  353   1HB   HIS  52          HB2       HIS  52  -9.188  -0.228  -1.960
  354   2HB   HIS  52          HB1       HIS  52 -10.215  -1.645  -2.144
  355    HD1  HIS  52           HD1      HIS  52 -12.846  -1.150  -1.468
  356    HD2  HIS  52           HD2      HIS  52 -10.461   2.107  -2.456
  357    HE1  HIS  52           HE1      HIS  52 -14.444   0.709  -2.028
  358    HE2  HIS  52           HE2      HIS  52 -12.979   2.642  -2.708
  359    H    ALA  53           HN       ALA  53  -8.049   0.312   1.005
  360    HA   ALA  53           HA       ALA  53  -5.750  -0.923   0.118
  361   1HB   ALA  53          HB1       ALA  53  -6.367   0.783   2.479
  362   2HB   ALA  53          HB2       ALA  53  -5.370   1.139   1.068
  363   3HB   ALA  53          HB3       ALA  53  -4.770   0.052   2.320
  364    H    ARG  54           HN       ARG  54  -7.454  -1.424   3.151
  365    HA   ARG  54           HA       ARG  54  -5.826  -3.349   4.264
  366   1HB   ARG  54          HB2       ARG  54  -8.658  -2.560   4.592
  367   2HB   ARG  54          HB1       ARG  54  -8.207  -4.139   5.222
  368   1HG   ARG  54          HG2       ARG  54  -6.485  -1.831   5.927
  369   2HG   ARG  54          HG1       ARG  54  -8.073  -1.947   6.690
  370   1HD   ARG  54          HD2       ARG  54  -6.526  -3.048   8.120
  371   2HD   ARG  54          HD1       ARG  54  -7.488  -4.297   7.330
  372    HE   ARG  54           HE       ARG  54  -4.983  -3.662   6.031
  373   1HH1  ARG  54          HH11      ARG  54  -6.622  -5.706   8.341
  374   2HH1  ARG  54          HH12      ARG  54  -5.452  -6.977   8.231
  375   1HH2  ARG  54          HH21      ARG  54  -3.446  -5.334   5.889
  376   2HH2  ARG  54          HH22      ARG  54  -3.650  -6.766   6.841
  377    H    ASP  55           HN       ASP  55  -8.615  -3.777   2.175
  378    HA   ASP  55           HA       ASP  55  -8.518  -6.589   2.099
  379   1HB   ASP  55          HB2       ASP  55 -10.415  -4.948   1.388
  380   2HB   ASP  55          HB1       ASP  55  -9.593  -5.013  -0.168
  381    H    THR  56           HN       THR  56  -7.180  -4.102   0.049
  382    HA   THR  56           HA       THR  56  -6.180  -5.675  -1.994
  383    HB   THR  56           HB       THR  56  -5.045  -3.149  -0.879
  384    HG1  THR  56           HG1      THR  56  -7.207  -2.980  -1.610
  385   1HG2  THR  56          HG21      THR  56  -3.544  -4.470  -2.447
  386   2HG2  THR  56          HG22      THR  56  -3.872  -2.785  -2.854
  387   3HG2  THR  56          HG23      THR  56  -4.726  -4.079  -3.696
  388    H    LEU  57           HN       LEU  57  -4.849  -4.902   1.153
  389    HA   LEU  57           HA       LEU  57  -2.286  -5.904   0.792
  390   1HB   LEU  57          HB2       LEU  57  -3.951  -5.065   2.991
  391   2HB   LEU  57          HB1       LEU  57  -2.889  -6.388   3.444
  392    HG   LEU  57           HG       LEU  57  -1.360  -4.479   2.004
  393   1HD1  LEU  57          HD11      LEU  57  -2.647  -3.209   4.390
  394   2HD1  LEU  57          HD12      LEU  57  -3.294  -2.985   2.765
  395   3HD1  LEU  57          HD13      LEU  57  -1.652  -2.464   3.139
  396   1HD2  LEU  57          HD21      LEU  57   0.113  -4.890   3.649
  397   2HD2  LEU  57          HD22      LEU  57  -1.022  -6.163   4.094
  398   3HD2  LEU  57          HD23      LEU  57  -1.076  -4.607   4.920
  399    H    THR  58           HN       THR  58  -5.021  -7.434   2.391
  400    HA   THR  58           HA       THR  58  -3.873  -9.960   2.655
  401    HB   THR  58           HB       THR  58  -6.830  -9.536   2.285
  402    HG1  THR  58           HG1      THR  58  -5.193  -8.747   4.438
  403   1HG2  THR  58          HG21      THR  58  -5.248 -11.704   3.203
  404   2HG2  THR  58          HG22      THR  58  -7.002 -11.590   3.066
  405   3HG2  THR  58          HG23      THR  58  -6.199 -11.088   4.554
  406    H    SER  59           HN       SER  59  -5.907  -8.584   0.110
  407    HA   SER  59           HA       SER  59  -6.258 -10.796  -1.490
  408   1HB   SER  59          HB2       SER  59  -7.067  -8.324  -1.723
  409   2HB   SER  59          HB1       SER  59  -5.616  -8.171  -2.700
  410    HG   SER  59           HG       SER  59  -6.405  -9.603  -4.147
  411    H    CYS  60           HN       CYS  60  -3.510  -8.811  -0.919
  412    HA   CYS  60           HA       CYS  60  -1.919  -9.716  -3.097
  413   1HB   CYS  60          HB2       CYS  60  -1.834  -7.649  -1.275
  414   2HB   CYS  60          HB1       CYS  60  -0.545  -8.697  -0.721
  415    H    GLY  61           HN       GLY  61  -2.319 -10.559   0.315
  416   1HA   GLY  61          HA2       GLY  61  -1.818 -12.515   1.417
  417   2HA   GLY  61          HA1       GLY  61  -1.373 -13.215  -0.129
  418    H    LEU  62           HN       LEU  62  -0.072 -10.589   1.929
  419    HA   LEU  62           HA       LEU  62   2.468 -12.047   1.970
  420   1HB   LEU  62          HB2       LEU  62   3.388  -9.499   1.921
  421   2HB   LEU  62          HB1       LEU  62   3.336 -10.571   0.541
  422    HG   LEU  62           HG       LEU  62   0.817  -9.187   0.741
  423   1HD1  LEU  62          HD11      LEU  62   3.294  -7.515   1.015
  424   2HD1  LEU  62          HD12      LEU  62   1.755  -7.378   1.870
  425   3HD1  LEU  62          HD13      LEU  62   1.866  -6.910   0.175
  426   1HD2  LEU  62          HD21      LEU  62   2.176  -8.219  -1.456
  427   2HD2  LEU  62          HD22      LEU  62   1.147  -9.651  -1.415
  428   3HD2  LEU  62          HD23      LEU  62   2.890  -9.811  -1.205
  429    H    ALA  63           HN       ALA  63   2.050  -8.774   3.179
  430    HA   ALA  63           HA       ALA  63   1.617  -9.706   5.874
  431   1HB   ALA  63          HB1       ALA  63   3.646  -8.264   6.602
  432   2HB   ALA  63          HB2       ALA  63   4.198  -8.526   4.948
  433   3HB   ALA  63          HB3       ALA  63   3.915  -9.904   6.012
  434    H    VAL  64           HN       VAL  64   1.841  -7.647   7.395
  435    HA   VAL  64           HA       VAL  64   0.304  -5.528   6.106
  436    HB   VAL  64           HB       VAL  64  -0.466  -7.050   8.215
  437   1HG1  VAL  64          HG11      VAL  64   1.409  -5.863   9.532
  438   2HG1  VAL  64          HG12      VAL  64  -0.182  -6.034  10.274
  439   3HG1  VAL  64          HG13      VAL  64   0.297  -4.495   9.560
  440   1HG2  VAL  64          HG21      VAL  64  -1.581  -5.125   6.751
  441   2HG2  VAL  64          HG22      VAL  64  -1.429  -4.254   8.277
  442   3HG2  VAL  64          HG23      VAL  64  -2.331  -5.768   8.211
  443    HA   PRO  65           HA       PRO  65   3.630  -2.753   7.062
  444   1HB   PRO  65          HB2       PRO  65   2.474  -0.400   6.679
  445   2HB   PRO  65          HB1       PRO  65   2.585  -1.556   5.339
  446   1HG   PRO  65          HG2       PRO  65   0.287  -1.095   7.226
  447   2HG   PRO  65          HG1       PRO  65   0.262  -1.084   5.448
  448   1HD   PRO  65          HD2       PRO  65  -0.434  -3.260   6.881
  449   2HD   PRO  65          HD1       PRO  65   0.403  -3.396   5.320
  450    H    HIS  66           HN       HIS  66   2.070  -3.715   9.368
  451    HA   HIS  66           HA       HIS  66   2.136  -1.356  11.111
  452   1HB   HIS  66          HB2       HIS  66   0.751  -4.011  11.333
  453   2HB   HIS  66          HB1       HIS  66   1.033  -3.032  12.764
  454    HD1  HIS  66           HD1      HIS  66  -0.676  -2.783   9.395
  455    HD2  HIS  66           HD2      HIS  66  -0.840  -1.107  13.189
  456    HE1  HIS  66           HE1      HIS  66  -2.702  -1.308   9.394
  457    HE2  HIS  66           HE2      HIS  66  -2.749  -0.249  11.675
  458    H    CYS  67           HN       CYS  67   4.534  -2.674  10.176
  459    HA   CYS  67           HA       CYS  67   5.605  -4.366  12.182
  460   1HB   CYS  67          HB2       CYS  67   7.808  -3.791  11.118
  461   2HB   CYS  67          HB1       CYS  67   6.594  -4.403  10.000
  Start of MODEL    4
    1   1H    ALA   1          HT1       ALA   1  17.040   6.878   0.292
    2   2H    ALA   1          HT2       ALA   1  15.674   7.822  -0.144
    3   3H    ALA   1          HT3       ALA   1  16.402   6.778  -1.296
    4    HA   ALA   1           HA       ALA   1  15.637   4.903  -0.298
    5   1HB   ALA   1          HB1       ALA   1  14.430   5.162   1.988
    6   2HB   ALA   1          HB2       ALA   1  15.372   6.648   2.112
    7   3HB   ALA   1          HB3       ALA   1  16.191   5.096   1.934
    8    H    CYS   2           HN       CYS   2  13.384   4.152  -0.006
    9    HA   CYS   2           HA       CYS   2  11.202   4.140  -0.645
   10   1HB   CYS   2          HB2       CYS   2  11.163   7.104  -0.092
   11   2HB   CYS   2          HB1       CYS   2   9.826   5.965   0.011
   12    H    GLN   3           HN       GLN   3  11.270   3.688  -2.789
   13    HA   GLN   3           HA       GLN   3  12.129   5.458  -4.804
   14   1HB   GLN   3          HB2       GLN   3  11.551   2.816  -4.731
   15   2HB   GLN   3          HB1       GLN   3  10.111   3.422  -5.539
   16   1HG   GLN   3          HG2       GLN   3  11.277   3.285  -7.419
   17   2HG   GLN   3          HG1       GLN   3  12.152   4.709  -6.857
   18   1HE2  GLN   3          HE21      GLN   3  13.905   4.026  -5.147
   19   2HE2  GLN   3          HE22      GLN   3  14.948   2.754  -5.675
   20    H    ALA   4           HN       ALA   4   8.973   4.841  -3.380
   21    HA   ALA   4           HA       ALA   4   6.972   5.912  -3.548
   22   1HB   ALA   4          HB1       ALA   4   8.377   7.826  -2.856
   23   2HB   ALA   4          HB2       ALA   4   7.002   8.303  -3.853
   24   3HB   ALA   4          HB3       ALA   4   8.618   8.228  -4.556
   25    H    SER   5           HN       SER   5   8.174   4.501  -5.931
   26    HA   SER   5           HA       SER   5   6.447   5.729  -7.978
   27   1HB   SER   5          HB2       SER   5   7.995   5.040  -9.698
   28   2HB   SER   5          HB1       SER   5   8.893   5.947  -8.480
   29    HG   SER   5           HG       SER   5   9.349   3.775  -7.563
   30    H    GLN   6           HN       GLN   6   7.668   2.765  -6.543
   31    HA   GLN   6           HA       GLN   6   6.028   1.109  -8.208
   32   1HB   GLN   6          HB2       GLN   6   7.791   0.408  -5.863
   33   2HB   GLN   6          HB1       GLN   6   6.993  -0.757  -6.913
   34   1HG   GLN   6          HG2       GLN   6   8.557   1.138  -8.432
   35   2HG   GLN   6          HG1       GLN   6   9.534   0.311  -7.220
   36   1HE2  GLN   6          HE21      GLN   6   7.458  -0.117 -10.002
   37   2HE2  GLN   6          HE22      GLN   6   8.014  -1.699 -10.416
   38    H    LEU   7           HN       LEU   7   4.374   2.820  -6.935
   39    HA   LEU   7           HA       LEU   7   2.815   1.024  -5.278
   40   1HB   LEU   7          HB2       LEU   7   3.599   3.752  -4.253
   41   2HB   LEU   7          HB1       LEU   7   2.540   2.606  -3.453
   42    HG   LEU   7           HG       LEU   7   5.461   2.091  -4.017
   43   1HD1  LEU   7          HD11      LEU   7   4.555   3.943  -2.263
   44   2HD1  LEU   7          HD12      LEU   7   6.043   3.019  -2.058
   45   3HD1  LEU   7          HD13      LEU   7   4.564   2.498  -1.251
   46   1HD2  LEU   7          HD21      LEU   7   3.633   0.218  -3.638
   47   2HD2  LEU   7          HD22      LEU   7   3.867   0.667  -1.949
   48   3HD2  LEU   7          HD23      LEU   7   5.235   0.104  -2.909
   49    H    ALA   8           HN       ALA   8   3.109   4.209  -6.793
   50    HA   ALA   8           HA       ALA   8   0.576   5.180  -6.648
   51   1HB   ALA   8          HB1       ALA   8   0.989   6.349  -8.743
   52   2HB   ALA   8          HB2       ALA   8   2.338   5.266  -9.085
   53   3HB   ALA   8          HB3       ALA   8   2.419   6.371  -7.713
   54    H    VAL   9           HN       VAL   9   1.746   2.796  -8.943
   55    HA   VAL   9           HA       VAL   9  -0.504   2.532 -10.525
   56    HB   VAL   9           HB       VAL   9   1.641   1.476 -11.072
   57   1HG1  VAL   9          HG11      VAL   9   0.952  -0.397  -8.813
   58   2HG1  VAL   9          HG12      VAL   9   2.328   0.701  -8.902
   59   3HG1  VAL   9          HG13      VAL   9   2.230  -0.681  -9.994
   60   1HG2  VAL   9          HG21      VAL   9  -0.814   0.568 -11.701
   61   2HG2  VAL   9          HG22      VAL   9  -0.132  -0.878 -10.957
   62   3HG2  VAL   9          HG23      VAL   9   0.677  -0.130 -12.333
   63    H    CYS  10           HN       CYS  10   0.059   1.475  -7.302
   64    HA   CYS  10           HA       CYS  10  -2.081  -0.461  -7.238
   65   1HB   CYS  10          HB2       CYS  10   0.101  -0.309  -5.783
   66   2HB   CYS  10          HB1       CYS  10  -0.878   0.759  -4.783
   67    H    ALA  11           HN       ALA  11  -1.592   2.891  -6.513
   68    HA   ALA  11           HA       ALA  11  -3.581   3.602  -4.820
   69   1HB   ALA  11          HB1       ALA  11  -3.600   5.773  -5.830
   70   2HB   ALA  11          HB2       ALA  11  -2.964   5.125  -7.342
   71   3HB   ALA  11          HB3       ALA  11  -1.953   5.145  -5.897
   72    H    SER  12           HN       SER  12  -3.937   2.543  -8.097
   73    HA   SER  12           HA       SER  12  -6.471   3.398  -8.742
   74   1HB   SER  12          HB2       SER  12  -5.471   0.625  -9.388
   75   2HB   SER  12          HB1       SER  12  -6.555   1.637 -10.342
   76    HG   SER  12           HG       SER  12  -3.784   1.745 -10.075
   77    H    ALA  13           HN       ALA  13  -5.495   0.780  -6.630
   78    HA   ALA  13           HA       ALA  13  -8.218  -0.104  -6.242
   79   1HB   ALA  13          HB1       ALA  13  -5.917  -1.481  -6.255
   80   2HB   ALA  13          HB2       ALA  13  -7.364  -2.018  -5.403
   81   3HB   ALA  13          HB3       ALA  13  -6.082  -1.186  -4.524
   82    H    ILE  14           HN       ILE  14  -5.762   1.759  -4.596
   83    HA   ILE  14           HA       ILE  14  -7.083   1.810  -2.059
   84    HB   ILE  14           HB       ILE  14  -4.890   3.544  -3.203
   85   1HG1  ILE  14          HG12      ILE  14  -3.628   2.267  -1.315
   86   2HG1  ILE  14          HG11      ILE  14  -4.974   1.133  -1.412
   87   1HG2  ILE  14          HG21      ILE  14  -6.423   3.774  -0.695
   88   2HG2  ILE  14          HG22      ILE  14  -5.555   5.003  -1.614
   89   3HG2  ILE  14          HG23      ILE  14  -4.671   3.912  -0.547
   90   1HD1  ILE  14          HD11      ILE  14  -2.707   0.957  -2.871
   91   2HD1  ILE  14          HD12      ILE  14  -3.762   1.820  -3.991
   92   3HD1  ILE  14          HD13      ILE  14  -4.255   0.256  -3.342
   93    H    LEU  15           HN       LEU  15  -6.438   4.472  -4.349
   94    HA   LEU  15           HA       LEU  15  -8.363   6.197  -3.219
   95   1HB   LEU  15          HB2       LEU  15  -7.037   6.205  -5.927
   96   2HB   LEU  15          HB1       LEU  15  -8.068   7.499  -5.345
   97    HG   LEU  15           HG       LEU  15  -5.540   6.627  -3.951
   98   1HD1  LEU  15          HD11      LEU  15  -5.998   8.483  -6.209
   99   2HD1  LEU  15          HD12      LEU  15  -4.580   7.516  -5.801
  100   3HD1  LEU  15          HD13      LEU  15  -4.903   9.018  -4.935
  101   1HD2  LEU  15          HD21      LEU  15  -7.612   8.022  -2.927
  102   2HD2  LEU  15          HD22      LEU  15  -6.652   9.331  -3.617
  103   3HD2  LEU  15          HD23      LEU  15  -5.933   8.241  -2.431
  104    H    SER  16           HN       SER  16  -8.487   4.989  -6.563
  105    HA   SER  16           HA       SER  16 -11.196   5.424  -6.947
  106   1HB   SER  16          HB2       SER  16  -9.168   4.555  -8.529
  107   2HB   SER  16          HB1       SER  16 -10.088   3.063  -8.339
  108    HG   SER  16           HG       SER  16 -10.868   5.505  -9.493
  109    H    GLY  17           HN       GLY  17  -9.795   2.160  -6.596
  110   1HA   GLY  17          HA2       GLY  17 -10.583   0.661  -4.851
  111   2HA   GLY  17          HA1       GLY  17 -12.153   1.439  -4.973
  112    H    ALA  18           HN       ALA  18 -10.359   0.669  -7.846
  113    HA   ALA  18           HA       ALA  18 -12.447  -0.816  -8.980
  114   1HB   ALA  18          HB1       ALA  18 -11.063   0.101 -10.567
  115   2HB   ALA  18          HB2       ALA  18 -10.515  -1.576 -10.564
  116   3HB   ALA  18          HB3       ALA  18  -9.596  -0.347  -9.695
  117    H    LYS  19           HN       LYS  19  -9.237  -2.144  -8.485
  118    HA   LYS  19           HA       LYS  19 -10.002  -4.258  -6.786
  119   1HB   LYS  19          HB2       LYS  19  -9.610  -6.094  -8.540
  120   2HB   LYS  19          HB1       LYS  19 -11.170  -5.283  -8.540
  121   1HG   LYS  19          HG2       LYS  19  -9.431  -3.839 -10.256
  122   2HG   LYS  19          HG1       LYS  19  -9.311  -5.552 -10.661
  123   1HD   LYS  19          HD2       LYS  19 -11.705  -5.696 -10.943
  124   2HD   LYS  19          HD1       LYS  19 -11.903  -4.030 -10.397
  125   1HE   LYS  19          HE2       LYS  19 -11.057  -3.147 -12.350
  126   2HE   LYS  19          HE1       LYS  19 -10.136  -4.601 -12.731
  127   1HZ   LYS  19          HZ1       LYS  19 -13.086  -4.643 -12.738
  128   2HZ   LYS  19          HZ2       LYS  19 -12.008  -5.673 -13.537
  129   3HZ   LYS  19          HZ3       LYS  19 -12.228  -4.089 -14.088
  130    HA   PRO  20           HA       PRO  20  -5.647  -4.550  -6.253
  131   1HB   PRO  20          HB2       PRO  20  -5.285  -7.240  -5.858
  132   2HB   PRO  20          HB1       PRO  20  -5.910  -6.137  -4.628
  133   1HG   PRO  20          HG2       PRO  20  -7.399  -7.983  -6.452
  134   2HG   PRO  20          HG1       PRO  20  -7.669  -7.649  -4.731
  135   1HD   PRO  20          HD2       PRO  20  -9.197  -6.541  -6.647
  136   2HD   PRO  20          HD1       PRO  20  -8.776  -5.661  -5.163
  137    H    SER  21           HN       SER  21  -3.814  -6.402  -6.912
  138    HA   SER  21           HA       SER  21  -4.024  -7.534  -9.476
  139   1HB   SER  21          HB2       SER  21  -3.906  -4.843  -9.732
  140   2HB   SER  21          HB1       SER  21  -2.184  -5.225  -9.718
  141    HG   SER  21           HG       SER  21  -3.697  -5.349 -11.773
  142    H    GLY  22           HN       GLY  22  -2.220  -8.745 -10.012
  143   1HA   GLY  22          HA2       GLY  22  -0.528  -9.531  -7.925
  144   2HA   GLY  22          HA1       GLY  22  -0.284  -9.913  -9.622
  145    H    GLU  23           HN       GLU  23  -0.164  -6.992 -10.285
  146    HA   GLU  23           HA       GLU  23   2.597  -6.672 -10.247
  147   1HB   GLU  23          HB2       GLU  23   0.702  -5.557 -11.674
  148   2HB   GLU  23          HB1       GLU  23   0.736  -4.330 -10.406
  149   1HG   GLU  23          HG2       GLU  23   3.396  -4.818 -11.133
  150   2HG   GLU  23          HG1       GLU  23   2.474  -4.693 -12.627
  151    H    CYS  24           HN       CYS  24   0.125  -4.917  -8.374
  152    HA   CYS  24           HA       CYS  24   1.834  -3.427  -6.797
  153   1HB   CYS  24          HB2       CYS  24  -0.571  -3.002  -6.903
  154   2HB   CYS  24          HB1       CYS  24  -0.886  -4.519  -6.069
  155    H    CYS  25           HN       CYS  25   1.001  -6.764  -6.598
  156    HA   CYS  25           HA       CYS  25   1.680  -7.241  -3.900
  157   1HB   CYS  25          HB2       CYS  25   0.963  -8.807  -6.225
  158   2HB   CYS  25          HB1       CYS  25   2.264  -9.585  -5.331
  159    H    GLY  26           HN       GLY  26   3.555  -7.581  -6.904
  160   1HA   GLY  26          HA2       GLY  26   5.954  -8.302  -5.486
  161   2HA   GLY  26          HA1       GLY  26   5.811  -7.995  -7.210
  162    H    ASN  27           HN       ASN  27   4.530  -5.332  -6.596
  163    HA   ASN  27           HA       ASN  27   6.852  -3.787  -6.736
  164   1HB   ASN  27          HB2       ASN  27   3.981  -3.031  -6.238
  165   2HB   ASN  27          HB1       ASN  27   5.267  -1.844  -6.432
  166   1HD2  ASN  27          HD21      ASN  27   6.694  -2.425  -8.448
  167   2HD2  ASN  27          HD22      ASN  27   5.791  -2.696  -9.896
  168    H    LEU  28           HN       LEU  28   4.387  -3.787  -4.220
  169    HA   LEU  28           HA       LEU  28   5.778  -2.288  -2.364
  170   1HB   LEU  28          HB2       LEU  28   4.320  -3.346  -0.647
  171   2HB   LEU  28          HB1       LEU  28   3.461  -2.667  -2.016
  172    HG   LEU  28           HG       LEU  28   3.723  -5.213  -2.858
  173   1HD1  LEU  28          HD11      LEU  28   3.264  -5.496   0.099
  174   2HD1  LEU  28          HD12      LEU  28   4.840  -5.755  -0.651
  175   3HD1  LEU  28          HD13      LEU  28   3.469  -6.768  -1.105
  176   1HD2  LEU  28          HD21      LEU  28   1.465  -5.295  -2.657
  177   2HD2  LEU  28          HD22      LEU  28   1.687  -3.581  -2.306
  178   3HD2  LEU  28          HD23      LEU  28   1.481  -4.733  -0.986
  179    H    ARG  29           HN       ARG  29   6.177  -5.578  -3.286
  180    HA   ARG  29           HA       ARG  29   7.477  -6.549  -1.024
  181   1HB   ARG  29          HB2       ARG  29   7.031  -7.415  -3.773
  182   2HB   ARG  29          HB1       ARG  29   8.572  -7.959  -3.128
  183   1HG   ARG  29          HG2       ARG  29   6.590  -9.510  -2.873
  184   2HG   ARG  29          HG1       ARG  29   7.554  -9.199  -1.431
  185   1HD   ARG  29          HD2       ARG  29   5.373  -7.306  -1.778
  186   2HD   ARG  29          HD1       ARG  29   4.817  -8.973  -1.641
  187    HE   ARG  29           HE       ARG  29   5.806  -7.358   0.452
  188   1HH1  ARG  29          HH11      ARG  29   5.929 -10.634  -0.747
  189   2HH1  ARG  29          HH12      ARG  29   6.213 -11.327   0.814
  190   1HH2  ARG  29          HH21      ARG  29   6.180  -8.269   2.507
  191   2HH2  ARG  29          HH22      ARG  29   6.355  -9.985   2.661
  192    H    ALA  30           HN       ALA  30   8.779  -5.299  -4.042
  193    HA   ALA  30           HA       ALA  30  11.463  -5.507  -3.514
  194   1HB   ALA  30          HB1       ALA  30  10.966  -2.984  -4.791
  195   2HB   ALA  30          HB2       ALA  30   9.881  -4.217  -5.434
  196   3HB   ALA  30          HB3       ALA  30  11.625  -4.470  -5.474
  197    H    GLN  31           HN       GLN  31   9.131  -3.401  -2.114
  198    HA   GLN  31           HA       GLN  31  11.060  -1.566  -0.995
  199   1HB   GLN  31          HB2       GLN  31   8.223  -1.762  -0.057
  200   2HB   GLN  31          HB1       GLN  31   9.255  -0.344  -0.187
  201   1HG   GLN  31          HG2       GLN  31   9.033  -1.232  -2.790
  202   2HG   GLN  31          HG1       GLN  31   7.429  -1.497  -2.112
  203   1HE2  GLN  31          HE21      GLN  31   9.811   0.832  -3.021
  204   2HE2  GLN  31          HE22      GLN  31   8.808   2.237  -2.846
  205    H    GLN  32           HN       GLN  32   8.558  -3.508   0.630
  206    HA   GLN  32           HA       GLN  32   8.508  -4.461   2.692
  207   1HB   GLN  32          HB2       GLN  32  10.355  -5.725   1.125
  208   2HB   GLN  32          HB1       GLN  32  11.278  -5.394   2.585
  209   1HG   GLN  32          HG2       GLN  32  10.340  -7.142   3.559
  210   2HG   GLN  32          HG1       GLN  32   8.762  -6.372   3.394
  211   1HE2  GLN  32          HE21      GLN  32   8.124  -6.461   0.872
  212   2HE2  GLN  32          HE22      GLN  32   8.115  -8.070   0.245
  213    H    GLY  33           HN       GLY  33   9.784  -1.704   2.407
  214   1HA   GLY  33          HA2       GLY  33  10.868  -1.633   5.138
  215   2HA   GLY  33          HA1       GLY  33  11.766  -0.860   3.838
  216    H    CYS  34           HN       CYS  34  10.753   0.915   2.707
  217    HA   CYS  34           HA       CYS  34   9.562   2.775   4.394
  218   1HB   CYS  34          HB2       CYS  34  10.851   3.071   2.147
  219   2HB   CYS  34          HB1       CYS  34   9.241   2.953   1.465
  220    H    PHE  35           HN       PHE  35   8.276   0.478   2.175
  221    HA   PHE  35           HA       PHE  35   5.658   1.351   1.898
  222   1HB   PHE  35          HB2       PHE  35   5.791  -0.431   0.537
  223   2HB   PHE  35          HB1       PHE  35   7.178  -1.051   1.419
  224    HD1  PHE  35           HD1      PHE  35   6.842  -2.566   3.342
  225    HD2  PHE  35           HD2      PHE  35   3.632  -1.368   0.819
  226    HE1  PHE  35           HE1      PHE  35   5.500  -4.454   4.164
  227    HE2  PHE  35           HE2      PHE  35   2.280  -3.251   1.641
  228    HZ   PHE  35           HZ       PHE  35   3.211  -4.797   3.318
  229    H    CYS  36           HN       CYS  36   7.079  -0.716   4.338
  230    HA   CYS  36           HA       CYS  36   4.713  -1.225   5.790
  231   1HB   CYS  36          HB2       CYS  36   7.037  -2.386   5.924
  232   2HB   CYS  36          HB1       CYS  36   7.418  -1.127   7.094
  233    H    GLN  37           HN       GLN  37   7.377   1.038   6.512
  234    HA   GLN  37           HA       GLN  37   6.067   2.271   8.656
  235   1HB   GLN  37          HB2       GLN  37   7.795   4.057   8.396
  236   2HB   GLN  37          HB1       GLN  37   8.444   2.431   8.537
  237   1HG   GLN  37          HG2       GLN  37   8.831   2.338   6.158
  238   2HG   GLN  37          HG1       GLN  37   8.079   3.919   5.947
  239   1HE2  GLN  37          HE21      GLN  37  10.320   4.100   4.885
  240   2HE2  GLN  37          HE22      GLN  37  11.573   4.733   5.889
  241    H    TYR  38           HN       TYR  38   5.832   2.685   5.259
  242    HA   TYR  38           HA       TYR  38   4.968   5.335   5.079
  243   1HB   TYR  38          HB2       TYR  38   4.841   2.931   3.395
  244   2HB   TYR  38          HB1       TYR  38   3.521   4.060   3.118
  245    HD1  TYR  38           HD1      TYR  38   5.045   6.626   3.661
  246    HD2  TYR  38           HD2      TYR  38   6.038   3.177   1.379
  247    HE1  TYR  38           HE1      TYR  38   6.512   7.995   2.244
  248    HE2  TYR  38           HE2      TYR  38   7.510   4.536  -0.044
  249    HH   TYR  38           HH       TYR  38   7.814   6.850  -0.699
  250    H    ALA  39           HN       ALA  39   3.434   2.604   6.452
  251    HA   ALA  39           HA       ALA  39   0.756   3.038   6.072
  252   1HB   ALA  39          HB1       ALA  39   1.705   2.273   8.786
  253   2HB   ALA  39          HB2       ALA  39   2.043   1.215   7.416
  254   3HB   ALA  39          HB3       ALA  39   0.377   1.615   7.831
  255    H    LYS  40           HN       LYS  40   2.960   4.970   7.880
  256    HA   LYS  40           HA       LYS  40   0.790   6.375   9.242
  257   1HB   LYS  40          HB2       LYS  40   3.116   5.633  10.261
  258   2HB   LYS  40          HB1       LYS  40   3.646   7.160   9.570
  259   1HG   LYS  40          HG2       LYS  40   2.959   8.111  11.452
  260   2HG   LYS  40          HG1       LYS  40   1.312   7.822  10.888
  261   1HD   LYS  40          HD2       LYS  40   1.380   6.905  13.050
  262   2HD   LYS  40          HD1       LYS  40   1.526   5.519  11.966
  263   1HE   LYS  40          HE2       LYS  40   3.867   5.366  12.344
  264   2HE   LYS  40          HE1       LYS  40   3.899   6.922  13.174
  265   1HZ   LYS  40          HZ1       LYS  40   3.804   4.591  14.439
  266   2HZ   LYS  40          HZ2       LYS  40   2.147   4.905  14.315
  267   3HZ   LYS  40          HZ3       LYS  40   3.162   6.018  15.084
  268    H    ASP  41           HN       ASP  41   2.981   6.724   6.608
  269    HA   ASP  41           HA       ASP  41   3.124   9.491   6.348
  270   1HB   ASP  41          HB2       ASP  41   4.495   7.982   5.014
  271   2HB   ASP  41          HB1       ASP  41   3.059   7.378   4.183
  272    HA   PRO  42           HA       PRO  42  -1.227  10.084   5.283
  273   1HB   PRO  42          HB2       PRO  42  -1.476  12.560   6.225
  274   2HB   PRO  42          HB1       PRO  42  -1.318  11.185   7.325
  275   1HG   PRO  42          HG2       PRO  42   0.715  13.213   6.520
  276   2HG   PRO  42          HG1       PRO  42   0.461  12.442   8.094
  277   1HD   PRO  42          HD2       PRO  42   2.368  11.696   6.179
  278   2HD   PRO  42          HD1       PRO  42   1.854  10.727   7.572
  279    H    THR  43           HN       THR  43   1.585  11.633   4.112
  280    HA   THR  43           HA       THR  43   0.656  13.731   2.588
  281    HB   THR  43           HB       THR  43   2.594  12.415   1.009
  282    HG1  THR  43           HG1      THR  43   3.364  12.370   3.725
  283   1HG2  THR  43          HG21      THR  43   3.007  14.629   1.115
  284   2HG2  THR  43          HG22      THR  43   4.103  14.104   2.393
  285   3HG2  THR  43          HG23      THR  43   2.516  14.756   2.804
  286    H    TYR  44           HN       TYR  44   0.260  10.319   2.040
  287    HA   TYR  44           HA       TYR  44  -0.392  10.442  -0.713
  288   1HB   TYR  44          HB2       TYR  44  -1.184   8.410   1.384
  289   2HB   TYR  44          HB1       TYR  44  -1.386   8.200  -0.352
  290    HD1  TYR  44           HD1      TYR  44   0.369   6.769   1.976
  291    HD2  TYR  44           HD2      TYR  44   1.177   9.291  -1.354
  292    HE1  TYR  44           HE1      TYR  44   2.639   5.837   1.829
  293    HE2  TYR  44           HE2      TYR  44   3.450   8.364  -1.511
  294    HH   TYR  44           HH       TYR  44   5.072   7.224  -0.157
  295    H    GLY  45           HN       GLY  45  -2.528  10.040   2.127
  296   1HA   GLY  45          HA2       GLY  45  -4.445  11.593   2.284
  297   2HA   GLY  45          HA1       GLY  45  -4.648  11.372   0.553
  298    H    GLN  46           HN       GLN  46  -4.851   9.742   3.674
  299    HA   GLN  46           HA       GLN  46  -6.120   8.010   4.422
  300   1HB   GLN  46          HB2       GLN  46  -7.826   9.623   3.343
  301   2HB   GLN  46          HB1       GLN  46  -7.915   8.425   2.061
  302   1HG   GLN  46          HG2       GLN  46  -8.192   6.945   4.384
  303   2HG   GLN  46          HG1       GLN  46  -9.115   8.415   4.692
  304   1HE2  GLN  46          HE21      GLN  46  -8.552   6.560   1.727
  305   2HE2  GLN  46          HE22      GLN  46 -10.229   6.267   1.386
  306    H    TYR  47           HN       TYR  47  -4.070   7.644   2.264
  307    HA   TYR  47           HA       TYR  47  -4.858   5.587   0.521
  308   1HB   TYR  47          HB2       TYR  47  -2.744   7.128   0.560
  309   2HB   TYR  47          HB1       TYR  47  -2.080   5.808   1.514
  310    HD1  TYR  47           HD1      TYR  47  -1.455   3.735   0.515
  311    HD2  TYR  47           HD2      TYR  47  -3.418   6.735  -1.768
  312    HE1  TYR  47           HE1      TYR  47  -0.899   2.515  -1.548
  313    HE2  TYR  47           HE2      TYR  47  -2.871   5.524  -3.842
  314    HH   TYR  47           HH       TYR  47  -1.629   2.322  -3.826
  315    H    ILE  48           HN       ILE  48  -2.971   5.457   3.524
  316    HA   ILE  48           HA       ILE  48  -2.950   2.625   3.645
  317    HB   ILE  48           HB       ILE  48  -2.446   4.580   5.887
  318   1HG1  ILE  48          HG12      ILE  48  -1.059   4.957   3.827
  319   2HG1  ILE  48          HG11      ILE  48  -0.127   4.544   5.261
  320   1HG2  ILE  48          HG21      ILE  48  -1.086   2.755   6.830
  321   2HG2  ILE  48          HG22      ILE  48  -1.621   1.703   5.519
  322   3HG2  ILE  48          HG23      ILE  48  -2.790   2.322   6.686
  323   1HD1  ILE  48          HD11      ILE  48  -0.744   2.828   2.882
  324   2HD1  ILE  48          HD12      ILE  48  -0.149   2.157   4.400
  325   3HD1  ILE  48          HD13      ILE  48   0.829   3.322   3.507
  326    H    ARG  49           HN       ARG  49  -4.986   5.117   5.102
  327    HA   ARG  49           HA       ARG  49  -6.401   3.214   6.727
  328   1HB   ARG  49          HB2       ARG  49  -7.249   6.044   6.144
  329   2HB   ARG  49          HB1       ARG  49  -7.693   5.053   7.526
  330   1HG   ARG  49          HG2       ARG  49  -5.677   5.368   8.577
  331   2HG   ARG  49          HG1       ARG  49  -4.821   5.696   7.069
  332   1HD   ARG  49          HD2       ARG  49  -5.231   7.889   7.193
  333   2HD   ARG  49          HD1       ARG  49  -6.921   7.634   7.623
  334    HE   ARG  49           HE       ARG  49  -5.293   7.032   9.836
  335   1HH1  ARG  49          HH11      ARG  49  -6.382   9.765   7.960
  336   2HH1  ARG  49          HH12      ARG  49  -6.262  10.879   9.280
  337   1HH2  ARG  49          HH21      ARG  49  -5.132   8.496  11.574
  338   2HH2  ARG  49          HH22      ARG  49  -5.552  10.159  11.332
  339    H    SER  50           HN       SER  50  -6.407   2.893   3.799
  340    HA   SER  50           HA       SER  50  -9.115   3.382   2.972
  341   1HB   SER  50          HB2       SER  50  -6.882   3.225   1.553
  342   2HB   SER  50          HB1       SER  50  -7.364   1.533   1.486
  343    HG   SER  50           HG       SER  50  -8.296   3.531   0.042
  344    HA   PRO  51           HA       PRO  51 -10.714  -0.519   4.278
  345   1HB   PRO  51          HB2       PRO  51 -12.772  -0.762   2.438
  346   2HB   PRO  51          HB1       PRO  51 -12.842   0.176   3.928
  347   1HG   PRO  51          HG2       PRO  51 -12.786   1.120   1.199
  348   2HG   PRO  51          HG1       PRO  51 -13.012   2.047   2.688
  349   1HD   PRO  51          HD2       PRO  51 -10.645   1.780   1.031
  350   2HD   PRO  51          HD1       PRO  51 -10.946   2.896   2.376
  351    H    HIS  52           HN       HIS  52 -10.341  -0.142   0.789
  352    HA   HIS  52           HA       HIS  52 -10.212  -2.970   0.308
  353   1HB   HIS  52          HB2       HIS  52  -9.299  -1.081  -1.785
  354   2HB   HIS  52          HB1       HIS  52 -10.396  -2.453  -1.908
  355    HD1  HIS  52           HD1      HIS  52 -10.764   0.667  -2.886
  356    HD2  HIS  52           HD2      HIS  52 -12.650  -1.290   0.253
  357    HE1  HIS  52           HE1      HIS  52 -12.878   1.960  -2.450
  358    HE2  HIS  52           HE2      HIS  52 -13.981   0.781  -0.526
  359    H    ALA  53           HN       ALA  53  -7.951  -0.375   0.752
  360    HA   ALA  53           HA       ALA  53  -5.659  -1.418  -0.355
  361   1HB   ALA  53          HB1       ALA  53  -4.410  -0.028   1.229
  362   2HB   ALA  53          HB2       ALA  53  -5.889   0.220   2.156
  363   3HB   ALA  53          HB3       ALA  53  -5.765   0.842   0.510
  364    H    ARG  54           HN       ARG  54  -7.028  -2.036   2.810
  365    HA   ARG  54           HA       ARG  54  -4.935  -3.608   3.786
  366   1HB   ARG  54          HB2       ARG  54  -6.202  -3.000   5.553
  367   2HB   ARG  54          HB1       ARG  54  -7.669  -2.918   4.590
  368   1HG   ARG  54          HG2       ARG  54  -8.032  -5.248   4.795
  369   2HG   ARG  54          HG1       ARG  54  -6.435  -5.496   5.504
  370   1HD   ARG  54          HD2       ARG  54  -7.784  -5.522   7.376
  371   2HD   ARG  54          HD1       ARG  54  -7.286  -3.832   7.315
  372    HE   ARG  54           HE       ARG  54  -9.591  -3.832   5.912
  373   1HH1  ARG  54          HH11      ARG  54  -8.734  -5.053   9.067
  374   2HH1  ARG  54          HH12      ARG  54 -10.316  -4.813   9.728
  375   1HH2  ARG  54          HH21      ARG  54 -11.673  -3.515   6.781
  376   2HH2  ARG  54          HH22      ARG  54 -11.985  -3.940   8.431
  377    H    ASP  55           HN       ASP  55  -7.671  -4.294   1.781
  378    HA   ASP  55           HA       ASP  55  -7.616  -7.110   2.041
  379   1HB   ASP  55          HB2       ASP  55  -9.484  -5.547   1.113
  380   2HB   ASP  55          HB1       ASP  55  -8.621  -5.775  -0.404
  381    H    THR  56           HN       THR  56  -6.186  -4.841  -0.182
  382    HA   THR  56           HA       THR  56  -5.160  -6.599  -2.056
  383    HB   THR  56           HB       THR  56  -3.658  -4.176  -1.259
  384    HG1  THR  56           HG1      THR  56  -5.172  -2.865  -2.087
  385   1HG2  THR  56          HG21      THR  56  -4.480  -4.779  -4.035
  386   2HG2  THR  56          HG22      THR  56  -3.190  -5.739  -3.310
  387   3HG2  THR  56          HG23      THR  56  -3.024  -3.987  -3.432
  388    H    LEU  57           HN       LEU  57  -3.633  -5.300   0.870
  389    HA   LEU  57           HA       LEU  57  -1.197  -6.592   0.608
  390   1HB   LEU  57          HB2       LEU  57  -2.623  -5.171   2.677
  391   2HB   LEU  57          HB1       LEU  57  -1.603  -6.442   3.330
  392    HG   LEU  57           HG       LEU  57  -0.083  -5.018   1.411
  393   1HD1  LEU  57          HD11      LEU  57  -0.344  -2.812   1.798
  394   2HD1  LEU  57          HD12      LEU  57  -0.835  -3.053   3.475
  395   3HD1  LEU  57          HD13      LEU  57  -1.995  -3.307   2.170
  396   1HD2  LEU  57          HD21      LEU  57   1.000  -6.104   3.185
  397   2HD2  LEU  57          HD22      LEU  57  -0.009  -5.312   4.395
  398   3HD2  LEU  57          HD23      LEU  57   1.203  -4.383   3.513
  399    H    THR  58           HN       THR  58  -4.051  -7.569   2.415
  400    HA   THR  58           HA       THR  58  -3.057 -10.004   3.343
  401    HB   THR  58           HB       THR  58  -5.955  -9.457   2.705
  402    HG1  THR  58           HG1      THR  58  -4.370  -8.551   4.861
  403   1HG2  THR  58          HG21      THR  58  -6.468 -10.863   4.555
  404   2HG2  THR  58          HG22      THR  58  -4.763 -11.015   4.982
  405   3HG2  THR  58          HG23      THR  58  -5.367 -11.738   3.491
  406    H    SER  59           HN       SER  59  -4.890  -9.197   0.423
  407    HA   SER  59           HA       SER  59  -5.307 -11.697  -0.625
  408   1HB   SER  59          HB2       SER  59  -5.907  -9.315  -1.502
  409   2HB   SER  59          HB1       SER  59  -4.397  -9.495  -2.381
  410    HG   SER  59           HG       SER  59  -5.341 -10.820  -3.703
  411    H    CYS  60           HN       CYS  60  -2.440  -9.803  -0.408
  412    HA   CYS  60           HA       CYS  60  -0.842 -11.392  -2.165
  413   1HB   CYS  60          HB2       CYS  60  -0.646  -8.877  -1.163
  414   2HB   CYS  60          HB1       CYS  60   0.456  -9.732  -0.094
  415    H    GLY  61           HN       GLY  61  -1.392 -11.172   1.326
  416   1HA   GLY  61          HA2       GLY  61  -1.057 -12.766   2.957
  417   2HA   GLY  61          HA1       GLY  61  -0.561 -13.887   1.700
  418    H    LEU  62           HN       LEU  62   0.741 -10.809   2.975
  419    HA   LEU  62           HA       LEU  62   3.290 -12.222   3.411
  420   1HB   LEU  62          HB2       LEU  62   3.795  -9.439   3.056
  421   2HB   LEU  62          HB1       LEU  62   4.384 -10.791   2.114
  422    HG   LEU  62           HG       LEU  62   1.648  -9.740   1.538
  423   1HD1  LEU  62          HD11      LEU  62   2.338  -7.725   0.936
  424   2HD1  LEU  62          HD12      LEU  62   3.494  -8.451  -0.179
  425   3HD1  LEU  62          HD13      LEU  62   3.972  -8.102   1.481
  426   1HD2  LEU  62          HD21      LEU  62   3.316 -10.315  -0.716
  427   2HD2  LEU  62          HD22      LEU  62   1.847 -11.130  -0.186
  428   3HD2  LEU  62          HD23      LEU  62   3.412 -11.647   0.436
  429    H    ALA  63           HN       ALA  63   2.331  -8.899   4.170
  430    HA   ALA  63           HA       ALA  63   2.134  -9.524   6.981
  431   1HB   ALA  63          HB1       ALA  63   4.284  -7.704   5.921
  432   2HB   ALA  63          HB2       ALA  63   4.510  -9.230   6.775
  433   3HB   ALA  63          HB3       ALA  63   3.833  -7.838   7.620
  434    H    VAL  64           HN       VAL  64   1.645  -7.503   8.273
  435    HA   VAL  64           HA       VAL  64  -0.108  -5.775   6.709
  436    HB   VAL  64           HB       VAL  64  -1.174  -7.230   8.442
  437   1HG1  VAL  64          HG11      VAL  64   0.057  -5.396  10.475
  438   2HG1  VAL  64          HG12      VAL  64   0.775  -6.949  10.050
  439   3HG1  VAL  64          HG13      VAL  64  -0.846  -6.887  10.741
  440   1HG2  VAL  64          HG21      VAL  64  -2.522  -5.386   9.463
  441   2HG2  VAL  64          HG22      VAL  64  -2.360  -5.291   7.709
  442   3HG2  VAL  64          HG23      VAL  64  -1.391  -4.240   8.742
  443    HA   PRO  65           HA       PRO  65   2.556  -2.334   7.588
  444   1HB   PRO  65          HB2       PRO  65   0.622  -0.356   7.650
  445   2HB   PRO  65          HB1       PRO  65   1.376  -0.981   6.181
  446   1HG   PRO  65          HG2       PRO  65  -1.241  -1.705   7.428
  447   2HG   PRO  65          HG1       PRO  65  -0.846  -1.456   5.717
  448   1HD   PRO  65          HD2       PRO  65  -1.094  -3.917   6.718
  449   2HD   PRO  65          HD1       PRO  65   0.163  -3.545   5.519
  450    H    HIS  66           HN       HIS  66   1.854  -0.074   9.026
  451    HA   HIS  66           HA       HIS  66   1.786   0.756  11.141
  452   1HB   HIS  66          HB2       HIS  66  -0.116  -1.567  11.467
  453   2HB   HIS  66          HB1       HIS  66   0.204  -0.407  12.752
  454    HD1  HIS  66           HD1      HIS  66  -1.658  -0.851   9.584
  455    HD2  HIS  66           HD2      HIS  66  -0.809   2.207  12.261
  456    HE1  HIS  66           HE1      HIS  66  -3.247   1.008   9.014
  457    HE2  HIS  66           HE2      HIS  66  -2.780   2.811  10.705
  458    H    CYS  67           HN       CYS  67   3.846  -1.143  10.371
  459    HA   CYS  67           HA       CYS  67   4.376  -2.805  12.662
  460   1HB   CYS  67          HB2       CYS  67   6.551  -3.236  11.502
  461   2HB   CYS  67          HB1       CYS  67   5.135  -3.588  10.517
  Start of MODEL    5
    1   1H    ALA   1          HT1       ALA   1  15.188   2.823  -5.862
    2   2H    ALA   1          HT2       ALA   1  14.820   1.170  -5.585
    3   3H    ALA   1          HT3       ALA   1  16.336   1.807  -5.094
    4    HA   ALA   1           HA       ALA   1  15.205   1.724  -3.160
    5   1HB   ALA   1          HB1       ALA   1  14.303   4.448  -3.963
    6   2HB   ALA   1          HB2       ALA   1  16.025   4.072  -3.980
    7   3HB   ALA   1          HB3       ALA   1  15.103   3.915  -2.485
    8    H    CYS   2           HN       CYS   2  13.165   2.586  -1.945
    9    HA   CYS   2           HA       CYS   2  10.894   1.333  -3.233
   10   1HB   CYS   2          HB2       CYS   2   9.782   1.726  -1.016
   11   2HB   CYS   2          HB1       CYS   2  11.248   0.755  -0.934
   12    H    GLN   3           HN       GLN   3  11.126   3.263  -4.836
   13    HA   GLN   3           HA       GLN   3  10.177   5.813  -4.099
   14   1HB   GLN   3          HB2       GLN   3  11.363   4.913  -6.292
   15   2HB   GLN   3          HB1       GLN   3   9.703   4.765  -6.851
   16   1HG   GLN   3          HG2       GLN   3   9.856   6.887  -7.468
   17   2HG   GLN   3          HG1       GLN   3   9.785   7.291  -5.754
   18   1HE2  GLN   3          HE21      GLN   3  11.405   7.932  -8.470
   19   2HE2  GLN   3          HE22      GLN   3  12.962   8.318  -7.829
   20    H    ALA   4           HN       ALA   4   8.144   6.798  -4.541
   21    HA   ALA   4           HA       ALA   4   5.923   5.255  -3.746
   22   1HB   ALA   4          HB1       ALA   4   4.956   7.239  -3.424
   23   2HB   ALA   4          HB2       ALA   4   5.225   7.735  -5.095
   24   3HB   ALA   4          HB3       ALA   4   6.503   7.943  -3.896
   25    H    SER   5           HN       SER   5   7.230   6.062  -6.864
   26    HA   SER   5           HA       SER   5   5.022   5.745  -8.510
   27   1HB   SER   5          HB2       SER   5   7.643   6.238  -8.952
   28   2HB   SER   5          HB1       SER   5   7.554   4.561  -9.492
   29    HG   SER   5           HG       SER   5   7.048   6.399 -11.032
   30    H    GLN   6           HN       GLN   6   6.863   3.348  -6.793
   31    HA   GLN   6           HA       GLN   6   6.018   1.106  -8.273
   32   1HB   GLN   6          HB2       GLN   6   7.205   1.450  -5.535
   33   2HB   GLN   6          HB1       GLN   6   6.721  -0.130  -6.135
   34   1HG   GLN   6          HG2       GLN   6   8.244   0.151  -8.044
   35   2HG   GLN   6          HG1       GLN   6   8.758   1.701  -7.381
   36   1HE2  GLN   6          HE21      GLN   6  10.046   1.745  -5.545
   37   2HE2  GLN   6          HE22      GLN   6  10.875   0.345  -4.965
   38    H    LEU   7           HN       LEU   7   4.401   3.131  -6.118
   39    HA   LEU   7           HA       LEU   7   2.424   1.055  -5.466
   40   1HB   LEU   7          HB2       LEU   7   2.345   3.713  -4.145
   41   2HB   LEU   7          HB1       LEU   7   1.953   2.130  -3.502
   42    HG   LEU   7           HG       LEU   7   4.798   2.925  -4.081
   43   1HD1  LEU   7          HD11      LEU   7   3.052   3.703  -1.809
   44   2HD1  LEU   7          HD12      LEU   7   4.396   4.567  -2.557
   45   3HD1  LEU   7          HD13      LEU   7   4.713   3.229  -1.452
   46   1HD2  LEU   7          HD21      LEU   7   4.880   1.258  -1.988
   47   2HD2  LEU   7          HD22      LEU   7   4.903   0.702  -3.662
   48   3HD2  LEU   7          HD23      LEU   7   3.394   0.688  -2.749
   49    H    ALA   8           HN       ALA   8   2.955   3.913  -7.286
   50    HA   ALA   8           HA       ALA   8   0.537   5.153  -7.454
   51   1HB   ALA   8          HB1       ALA   8   1.135   5.699  -9.812
   52   2HB   ALA   8          HB2       ALA   8   2.493   4.584  -9.661
   53   3HB   ALA   8          HB3       ALA   8   2.414   6.021  -8.641
   54    H    VAL   9           HN       VAL   9   1.550   2.578  -9.639
   55    HA   VAL   9           HA       VAL   9  -0.815   2.174 -10.971
   56    HB   VAL   9           HB       VAL   9   1.271   1.103 -11.649
   57   1HG1  VAL   9          HG11      VAL   9   1.409  -1.233 -10.155
   58   2HG1  VAL   9          HG12      VAL   9   1.156   0.039  -8.961
   59   3HG1  VAL   9          HG13      VAL   9   2.516   0.137 -10.079
   60   1HG2  VAL   9          HG21      VAL   9  -1.188   0.117 -12.007
   61   2HG2  VAL   9          HG22      VAL   9  -0.456  -1.252 -11.170
   62   3HG2  VAL   9          HG23      VAL   9   0.256  -0.651 -12.667
   63    H    CYS  10           HN       CYS  10   0.038   1.248  -7.761
   64    HA   CYS  10           HA       CYS  10  -1.970  -0.743  -7.378
   65   1HB   CYS  10          HB2       CYS  10   0.201  -0.204  -6.007
   66   2HB   CYS  10          HB1       CYS  10  -0.859   0.897  -5.131
   67    H    ALA  11           HN       ALA  11  -1.796   2.710  -7.049
   68    HA   ALA  11           HA       ALA  11  -3.862   3.383  -5.424
   69   1HB   ALA  11          HB1       ALA  11  -3.078   4.670  -8.029
   70   2HB   ALA  11          HB2       ALA  11  -2.502   5.081  -6.413
   71   3HB   ALA  11          HB3       ALA  11  -4.179   5.398  -6.859
   72    H    SER  12           HN       SER  12  -4.078   1.962  -8.568
   73    HA   SER  12           HA       SER  12  -6.629   2.544  -9.377
   74   1HB   SER  12          HB2       SER  12  -4.726   0.918 -10.334
   75   2HB   SER  12          HB1       SER  12  -5.797  -0.299  -9.639
   76    HG   SER  12           HG       SER  12  -7.493   0.613 -10.888
   77    H    ALA  13           HN       ALA  13  -5.609   0.397  -6.818
   78    HA   ALA  13           HA       ALA  13  -8.326  -0.527  -6.387
   79   1HB   ALA  13          HB1       ALA  13  -6.483  -2.167  -6.362
   80   2HB   ALA  13          HB2       ALA  13  -7.385  -2.127  -4.847
   81   3HB   ALA  13          HB3       ALA  13  -5.808  -1.345  -4.955
   82    H    ILE  14           HN       ILE  14  -5.840   1.448  -4.894
   83    HA   ILE  14           HA       ILE  14  -7.229   1.793  -2.414
   84    HB   ILE  14           HB       ILE  14  -4.966   3.388  -3.626
   85   1HG1  ILE  14          HG12      ILE  14  -3.805   2.118  -1.612
   86   2HG1  ILE  14          HG11      ILE  14  -5.124   0.976  -1.865
   87   1HG2  ILE  14          HG21      ILE  14  -5.528   4.908  -2.075
   88   2HG2  ILE  14          HG22      ILE  14  -4.797   3.776  -0.937
   89   3HG2  ILE  14          HG23      ILE  14  -6.543   3.773  -1.187
   90   1HD1  ILE  14          HD11      ILE  14  -3.880   1.675  -4.366
   91   2HD1  ILE  14          HD12      ILE  14  -4.101   0.093  -3.618
   92   3HD1  ILE  14          HD13      ILE  14  -2.693   1.073  -3.209
   93    H    LEU  15           HN       LEU  15  -6.527   4.067  -5.080
   94    HA   LEU  15           HA       LEU  15  -8.418   5.986  -4.125
   95   1HB   LEU  15          HB2       LEU  15  -6.904   5.756  -6.721
   96   2HB   LEU  15          HB1       LEU  15  -7.951   7.106  -6.328
   97    HG   LEU  15           HG       LEU  15  -5.540   6.321  -4.692
   98   1HD1  LEU  15          HD11      LEU  15  -4.254   7.875  -5.820
   99   2HD1  LEU  15          HD12      LEU  15  -5.658   8.702  -6.495
  100   3HD1  LEU  15          HD13      LEU  15  -5.175   7.128  -7.126
  101   1HD2  LEU  15          HD21      LEU  15  -7.316   7.565  -3.507
  102   2HD2  LEU  15          HD22      LEU  15  -7.184   8.849  -4.708
  103   3HD2  LEU  15          HD23      LEU  15  -5.818   8.483  -3.656
  104    H    SER  16           HN       SER  16  -8.338   4.526  -7.368
  105    HA   SER  16           HA       SER  16 -10.968   4.991  -8.032
  106   1HB   SER  16          HB2       SER  16  -8.863   3.828  -9.298
  107   2HB   SER  16          HB1       SER  16  -9.895   2.424  -9.025
  108    HG   SER  16           HG       SER  16 -10.282   3.608 -11.022
  109    H    GLY  17           HN       GLY  17  -9.654   1.943  -6.712
  110   1HA   GLY  17          HA2       GLY  17 -10.717   0.629  -5.062
  111   2HA   GLY  17          HA1       GLY  17 -12.218   1.484  -5.380
  112    H    ALA  18           HN       ALA  18 -10.396   0.320  -8.074
  113    HA   ALA  18           HA       ALA  18 -12.536  -1.273  -9.002
  114   1HB   ALA  18          HB1       ALA  18 -11.455  -0.968 -10.912
  115   2HB   ALA  18          HB2       ALA  18 -10.154  -2.013 -10.341
  116   3HB   ALA  18          HB3       ALA  18 -10.090  -0.278 -10.035
  117    H    LYS  19           HN       LYS  19  -9.253  -2.444  -8.609
  118    HA   LYS  19           HA       LYS  19  -9.891  -4.470  -6.735
  119   1HB   LYS  19          HB2       LYS  19  -9.348  -6.371  -8.397
  120   2HB   LYS  19          HB1       LYS  19 -10.971  -5.696  -8.399
  121   1HG   LYS  19          HG2       LYS  19 -10.588  -5.720 -10.631
  122   2HG   LYS  19          HG1       LYS  19  -9.915  -4.132 -10.261
  123   1HD   LYS  19          HD2       LYS  19  -7.734  -5.616  -9.850
  124   2HD   LYS  19          HD1       LYS  19  -8.551  -6.651 -11.022
  125   1HE   LYS  19          HE2       LYS  19  -7.140  -5.199 -12.258
  126   2HE   LYS  19          HE1       LYS  19  -8.790  -4.623 -12.488
  127   1HZ   LYS  19          HZ1       LYS  19  -7.353  -2.771 -12.077
  128   2HZ   LYS  19          HZ2       LYS  19  -6.752  -3.473 -10.660
  129   3HZ   LYS  19          HZ3       LYS  19  -8.364  -2.966 -10.734
  130    HA   PRO  20           HA       PRO  20  -5.560  -4.656  -6.033
  131   1HB   PRO  20          HB2       PRO  20  -5.607  -7.598  -6.476
  132   2HB   PRO  20          HB1       PRO  20  -5.030  -6.678  -5.082
  133   1HG   PRO  20          HG2       PRO  20  -7.338  -7.999  -4.972
  134   2HG   PRO  20          HG1       PRO  20  -7.163  -6.407  -4.210
  135   1HD   PRO  20          HD2       PRO  20  -8.514  -7.146  -6.771
  136   2HD   PRO  20          HD1       PRO  20  -8.986  -5.944  -5.551
  137    H    SER  21           HN       SER  21  -3.571  -6.264  -6.955
  138    HA   SER  21           HA       SER  21  -3.627  -6.792  -9.724
  139   1HB   SER  21          HB2       SER  21  -2.845  -4.057  -8.875
  140   2HB   SER  21          HB1       SER  21  -1.822  -4.828 -10.087
  141    HG   SER  21           HG       SER  21  -3.338  -3.995 -11.336
  142    H    GLY  22           HN       GLY  22  -1.903  -8.015 -10.303
  143   1HA   GLY  22          HA2       GLY  22  -0.210  -9.055  -8.320
  144   2HA   GLY  22          HA1       GLY  22   0.001  -9.270 -10.051
  145    H    GLU  23           HN       GLU  23   0.291  -6.454 -10.646
  146    HA   GLU  23           HA       GLU  23   3.036  -6.174 -10.466
  147   1HB   GLU  23          HB2       GLU  23   1.222  -4.983 -11.934
  148   2HB   GLU  23          HB1       GLU  23   1.238  -3.785 -10.639
  149   1HG   GLU  23          HG2       GLU  23   3.907  -4.256 -11.221
  150   2HG   GLU  23          HG1       GLU  23   3.096  -4.212 -12.783
  151    H    CYS  24           HN       CYS  24   0.500  -4.572  -8.552
  152    HA   CYS  24           HA       CYS  24   2.146  -3.057  -6.922
  153   1HB   CYS  24          HB2       CYS  24  -0.260  -2.702  -7.011
  154   2HB   CYS  24          HB1       CYS  24  -0.540  -4.278  -6.280
  155    H    CYS  25           HN       CYS  25   1.435  -6.431  -6.844
  156    HA   CYS  25           HA       CYS  25   2.188  -6.938  -4.155
  157   1HB   CYS  25          HB2       CYS  25   1.341  -8.473  -6.447
  158   2HB   CYS  25          HB1       CYS  25   2.707  -9.260  -5.663
  159    H    GLY  26           HN       GLY  26   3.925  -7.358  -7.240
  160   1HA   GLY  26          HA2       GLY  26   6.353  -8.228  -6.147
  161   2HA   GLY  26          HA1       GLY  26   6.169  -7.445  -7.709
  162    H    ASN  27           HN       ASN  27   5.176  -4.954  -6.786
  163    HA   ASN  27           HA       ASN  27   7.540  -3.583  -6.320
  164   1HB   ASN  27          HB2       ASN  27   4.658  -2.880  -6.259
  165   2HB   ASN  27          HB1       ASN  27   5.787  -1.748  -5.522
  166   1HD2  ASN  27          HD21      ASN  27   4.091  -1.839  -8.061
  167   2HD2  ASN  27          HD22      ASN  27   5.188  -1.335  -9.296
  168    H    LEU  28           HN       LEU  28   4.862  -4.129  -4.106
  169    HA   LEU  28           HA       LEU  28   5.859  -3.031  -1.816
  170   1HB   LEU  28          HB2       LEU  28   3.703  -4.650  -2.500
  171   2HB   LEU  28          HB1       LEU  28   4.536  -5.533  -1.236
  172    HG   LEU  28           HG       LEU  28   3.706  -2.661  -0.962
  173   1HD1  LEU  28          HD11      LEU  28   1.994  -3.902   0.639
  174   2HD1  LEU  28          HD12      LEU  28   2.187  -5.177  -0.564
  175   3HD1  LEU  28          HD13      LEU  28   1.625  -3.579  -1.055
  176   1HD2  LEU  28          HD21      LEU  28   4.947  -4.722   0.792
  177   2HD2  LEU  28          HD22      LEU  28   3.858  -3.533   1.515
  178   3HD2  LEU  28          HD23      LEU  28   5.296  -2.999   0.644
  179    H    ARG  29           HN       ARG  29   6.741  -6.051  -3.286
  180    HA   ARG  29           HA       ARG  29   8.052  -7.151  -1.087
  181   1HB   ARG  29          HB2       ARG  29   7.717  -7.815  -3.871
  182   2HB   ARG  29          HB1       ARG  29   9.340  -8.190  -3.305
  183   1HG   ARG  29          HG2       ARG  29   8.432 -10.118  -2.641
  184   2HG   ARG  29          HG1       ARG  29   7.836  -9.168  -1.276
  185   1HD   ARG  29          HD2       ARG  29   5.952  -8.708  -3.224
  186   2HD   ARG  29          HD1       ARG  29   6.377 -10.398  -3.481
  187    HE   ARG  29           HE       ARG  29   5.101  -9.247  -1.129
  188   1HH1  ARG  29          HH11      ARG  29   6.540 -12.053  -2.637
  189   2HH1  ARG  29          HH12      ARG  29   5.795 -13.171  -1.547
  190   1HH2  ARG  29          HH21      ARG  29   4.127 -10.723   0.303
  191   2HH2  ARG  29          HH22      ARG  29   4.428 -12.419   0.121
  192    H    ALA  30           HN       ALA  30   9.349  -5.477  -3.891
  193    HA   ALA  30           HA       ALA  30  12.011  -5.459  -3.216
  194   1HB   ALA  30          HB1       ALA  30  11.302  -4.620  -5.349
  195   2HB   ALA  30          HB2       ALA  30  12.168  -3.333  -4.510
  196   3HB   ALA  30          HB3       ALA  30  10.406  -3.307  -4.584
  197    H    GLN  31           HN       GLN  31   9.375  -3.776  -1.793
  198    HA   GLN  31           HA       GLN  31  10.987  -1.858  -0.360
  199   1HB   GLN  31          HB2       GLN  31   8.187  -2.441   0.464
  200   2HB   GLN  31          HB1       GLN  31   9.016  -0.898   0.320
  201   1HG   GLN  31          HG2       GLN  31   8.937  -1.331  -2.211
  202   2HG   GLN  31          HG1       GLN  31   7.716  -2.538  -1.814
  203   1HE2  GLN  31          HE21      GLN  31   8.442   0.795  -2.124
  204   2HE2  GLN  31          HE22      GLN  31   6.854   1.404  -1.785
  205    H    GLN  32           HN       GLN  32   8.657  -4.255   0.875
  206    HA   GLN  32           HA       GLN  32   8.596  -5.391   2.829
  207   1HB   GLN  32          HB2       GLN  32  10.610  -6.318   1.227
  208   2HB   GLN  32          HB1       GLN  32  11.414  -6.112   2.778
  209   1HG   GLN  32          HG2       GLN  32  10.634  -8.203   3.102
  210   2HG   GLN  32          HG1       GLN  32   9.213  -7.305   3.628
  211   1HE2  GLN  32          HE21      GLN  32   8.019  -6.565   1.344
  212   2HE2  GLN  32          HE22      GLN  32   7.516  -7.948   0.449
  213    H    GLY  33           HN       GLY  33   9.557  -2.545   2.927
  214   1HA   GLY  33          HA2       GLY  33   9.891  -2.307   5.683
  215   2HA   GLY  33          HA1       GLY  33  11.497  -2.287   4.969
  216    H    CYS  34           HN       CYS  34   8.730  -0.971   3.287
  217    HA   CYS  34           HA       CYS  34   9.583   1.708   3.918
  218   1HB   CYS  34          HB2       CYS  34  10.426   0.698   1.678
  219   2HB   CYS  34          HB1       CYS  34   8.784   1.043   1.163
  220    H    PHE  35           HN       PHE  35   7.099  -0.375   2.675
  221    HA   PHE  35           HA       PHE  35   5.065   1.475   2.283
  222   1HB   PHE  35          HB2       PHE  35   3.504  -0.461   2.682
  223   2HB   PHE  35          HB1       PHE  35   4.717  -0.730   1.439
  224    HD1  PHE  35           HD1      PHE  35   6.738  -2.135   2.041
  225    HD2  PHE  35           HD2      PHE  35   3.278  -1.868   4.505
  226    HE1  PHE  35           HE1      PHE  35   7.374  -4.214   3.158
  227    HE2  PHE  35           HE2      PHE  35   3.920  -3.957   5.634
  228    HZ   PHE  35           HZ       PHE  35   5.975  -5.135   4.962
  229    H    CYS  36           HN       CYS  36   5.551  -0.590   5.063
  230    HA   CYS  36           HA       CYS  36   3.587   0.336   6.735
  231   1HB   CYS  36          HB2       CYS  36   4.912  -1.563   7.384
  232   2HB   CYS  36          HB1       CYS  36   6.378  -0.590   7.437
  233    H    GLN  37           HN       GLN  37   6.668   1.836   5.995
  234    HA   GLN  37           HA       GLN  37   6.835   3.698   8.023
  235   1HB   GLN  37          HB2       GLN  37   7.608   4.141   5.142
  236   2HB   GLN  37          HB1       GLN  37   8.212   5.038   6.527
  237   1HG   GLN  37          HG2       GLN  37   9.196   2.938   7.396
  238   2HG   GLN  37          HG1       GLN  37   8.688   2.133   5.912
  239   1HE2  GLN  37          HE21      GLN  37   9.306   3.663   3.922
  240   2HE2  GLN  37          HE22      GLN  37  10.982   4.085   3.890
  241    H    TYR  38           HN       TYR  38   4.877   3.711   5.148
  242    HA   TYR  38           HA       TYR  38   4.065   6.419   5.257
  243   1HB   TYR  38          HB2       TYR  38   2.825   3.976   3.992
  244   2HB   TYR  38          HB1       TYR  38   2.122   5.584   3.840
  245    HD1  TYR  38           HD1      TYR  38   4.829   3.375   2.800
  246    HD2  TYR  38           HD2      TYR  38   3.278   7.329   2.557
  247    HE1  TYR  38           HE1      TYR  38   6.311   3.832   0.893
  248    HE2  TYR  38           HE2      TYR  38   4.755   7.796   0.647
  249    HH   TYR  38           HH       TYR  38   6.281   5.465  -1.112
  250    H    ALA  39           HN       ALA  39   3.169   3.656   7.094
  251    HA   ALA  39           HA       ALA  39   0.571   4.230   7.838
  252   1HB   ALA  39          HB1       ALA  39   2.535   3.094   9.785
  253   2HB   ALA  39          HB2       ALA  39   2.030   2.180   8.364
  254   3HB   ALA  39          HB3       ALA  39   0.834   2.689   9.556
  255    H    LYS  40           HN       LYS  40   3.476   5.858   8.678
  256    HA   LYS  40           HA       LYS  40   2.155   7.258  10.888
  257   1HB   LYS  40          HB2       LYS  40   4.621   6.204  10.849
  258   2HB   LYS  40          HB1       LYS  40   4.997   7.809  10.239
  259   1HG   LYS  40          HG2       LYS  40   4.159   8.845  12.205
  260   2HG   LYS  40          HG1       LYS  40   3.462   7.329  12.779
  261   1HD   LYS  40          HD2       LYS  40   6.413   7.776  12.354
  262   2HD   LYS  40          HD1       LYS  40   5.597   7.980  13.905
  263   1HE   LYS  40          HE2       LYS  40   5.938   5.815  14.277
  264   2HE   LYS  40          HE1       LYS  40   4.788   5.475  12.985
  265   1HZ   LYS  40          HZ1       LYS  40   7.527   6.071  12.186
  266   2HZ   LYS  40          HZ2       LYS  40   6.428   4.960  11.538
  267   3HZ   LYS  40          HZ3       LYS  40   7.270   4.586  12.956
  268    H    ASP  41           HN       ASP  41   3.175   7.653   7.639
  269    HA   ASP  41           HA       ASP  41   3.453  10.482   7.637
  270   1HB   ASP  41          HB2       ASP  41   4.429   9.012   5.894
  271   2HB   ASP  41          HB1       ASP  41   2.799   8.639   5.326
  272    HA   PRO  42           HA       PRO  42  -0.925  11.370   7.789
  273   1HB   PRO  42          HB2       PRO  42  -0.769  14.050   7.644
  274   2HB   PRO  42          HB1       PRO  42  -0.294  13.165   9.099
  275   1HG   PRO  42          HG2       PRO  42   1.424  14.294   6.923
  276   2HG   PRO  42          HG1       PRO  42   1.669  14.340   8.678
  277   1HD   PRO  42          HD2       PRO  42   2.918  12.559   7.026
  278   2HD   PRO  42          HD1       PRO  42   2.559  12.227   8.732
  279    H    THR  43           HN       THR  43   1.126  13.016   5.390
  280    HA   THR  43           HA       THR  43  -0.884  13.822   3.637
  281    HB   THR  43           HB       THR  43   1.300  13.194   2.012
  282    HG1  THR  43           HG1      THR  43   2.314  14.236   4.428
  283   1HG2  THR  43          HG21      THR  43   0.983  15.329   1.564
  284   2HG2  THR  43          HG22      THR  43   1.787  15.740   3.078
  285   3HG2  THR  43          HG23      THR  43   0.036  15.536   3.038
  286    H    TYR  44           HN       TYR  44   0.854  10.757   3.854
  287    HA   TYR  44           HA       TYR  44  -0.691   9.677   1.622
  288   1HB   TYR  44          HB2       TYR  44   1.660   8.633   3.193
  289   2HB   TYR  44          HB1       TYR  44   0.790   7.644   2.025
  290    HD1  TYR  44           HD1      TYR  44   0.408   9.010  -0.315
  291    HD2  TYR  44           HD2      TYR  44   3.617   9.561   2.424
  292    HE1  TYR  44           HE1      TYR  44   1.789   9.932  -2.128
  293    HE2  TYR  44           HE2      TYR  44   5.007  10.486   0.618
  294    HH   TYR  44           HH       TYR  44   5.013  10.209  -2.027
  295    H    GLY  45           HN       GLY  45  -1.608  10.253   4.533
  296   1HA   GLY  45          HA2       GLY  45  -2.240   7.719   5.665
  297   2HA   GLY  45          HA1       GLY  45  -2.945   9.263   6.120
  298    H    GLN  46           HN       GLN  46  -3.772   9.695   3.251
  299    HA   GLN  46           HA       GLN  46  -6.369   8.573   3.492
  300   1HB   GLN  46          HB2       GLN  46  -5.012  10.072   1.252
  301   2HB   GLN  46          HB1       GLN  46  -6.692   9.559   1.190
  302   1HG   GLN  46          HG2       GLN  46  -7.164  10.905   3.185
  303   2HG   GLN  46          HG1       GLN  46  -5.484  11.441   3.205
  304   1HE2  GLN  46          HE21      GLN  46  -4.902  13.128   1.992
  305   2HE2  GLN  46          HE22      GLN  46  -5.941  13.949   0.868
  306    H    TYR  47           HN       TYR  47  -3.449   7.649   1.871
  307    HA   TYR  47           HA       TYR  47  -4.620   5.807   0.043
  308   1HB   TYR  47          HB2       TYR  47  -2.273   6.951   0.023
  309   2HB   TYR  47          HB1       TYR  47  -1.828   5.559   1.003
  310    HD1  TYR  47           HD1      TYR  47  -3.256   6.525  -2.271
  311    HD2  TYR  47           HD2      TYR  47  -1.373   3.480   0.024
  312    HE1  TYR  47           HE1      TYR  47  -2.959   5.181  -4.310
  313    HE2  TYR  47           HE2      TYR  47  -1.071   2.126  -2.007
  314    HH   TYR  47           HH       TYR  47  -1.345   3.327  -5.072
  315    H    ILE  48           HN       ILE  48  -2.997   5.479   3.169
  316    HA   ILE  48           HA       ILE  48  -3.253   2.657   3.281
  317    HB   ILE  48           HB       ILE  48  -2.815   4.573   5.570
  318   1HG1  ILE  48          HG12      ILE  48  -0.851   3.194   3.728
  319   2HG1  ILE  48          HG11      ILE  48  -1.123   4.927   3.872
  320   1HG2  ILE  48          HG21      ILE  48  -2.729   2.794   6.895
  321   2HG2  ILE  48          HG22      ILE  48  -1.522   2.036   5.856
  322   3HG2  ILE  48          HG23      ILE  48  -3.239   1.789   5.538
  323   1HD1  ILE  48          HD11      ILE  48  -0.033   3.163   6.051
  324   2HD1  ILE  48          HD12      ILE  48  -0.215   4.917   6.107
  325   3HD1  ILE  48          HD13      ILE  48   0.931   4.184   4.984
  326    H    ARG  49           HN       ARG  49  -5.293   5.321   4.291
  327    HA   ARG  49           HA       ARG  49  -6.991   3.648   5.894
  328   1HB   ARG  49          HB2       ARG  49  -7.296   6.501   4.967
  329   2HB   ARG  49          HB1       ARG  49  -8.442   5.690   6.025
  330   1HG   ARG  49          HG2       ARG  49  -5.830   5.369   7.109
  331   2HG   ARG  49          HG1       ARG  49  -6.078   7.072   6.720
  332   1HD   ARG  49          HD2       ARG  49  -8.202   5.541   8.161
  333   2HD   ARG  49          HD1       ARG  49  -6.803   6.148   9.045
  334    HE   ARG  49           HE       ARG  49  -9.007   7.672   8.060
  335   1HH1  ARG  49          HH11      ARG  49  -5.597   7.813   8.787
  336   2HH1  ARG  49          HH12      ARG  49  -5.596   9.525   9.049
  337   1HH2  ARG  49          HH21      ARG  49  -9.009   9.923   8.406
  338   2HH2  ARG  49          HH22      ARG  49  -7.534  10.723   8.833
  339    H    SER  50           HN       SER  50  -6.614   3.081   3.009
  340    HA   SER  50           HA       SER  50  -9.189   3.515   1.808
  341   1HB   SER  50          HB2       SER  50  -6.778   3.224   0.719
  342   2HB   SER  50          HB1       SER  50  -7.303   1.544   0.697
  343    HG   SER  50           HG       SER  50  -8.452   3.767  -0.586
  344    HA   PRO  51           HA       PRO  51 -11.094  -0.172   3.327
  345   1HB   PRO  51          HB2       PRO  51 -12.921  -0.653   1.397
  346   2HB   PRO  51          HB1       PRO  51 -13.069   0.703   2.521
  347   1HG   PRO  51          HG2       PRO  51 -12.077   0.682  -0.302
  348   2HG   PRO  51          HG1       PRO  51 -13.145   1.848   0.500
  349   1HD   PRO  51          HD2       PRO  51 -10.486   2.286   0.106
  350   2HD   PRO  51          HD1       PRO  51 -11.393   2.978   1.465
  351    H    HIS  52           HN       HIS  52 -10.316  -0.252  -0.147
  352    HA   HIS  52           HA       HIS  52 -10.091  -3.121  -0.167
  353   1HB   HIS  52          HB2       HIS  52  -9.083  -1.356  -2.372
  354   2HB   HIS  52          HB1       HIS  52  -9.807  -2.956  -2.477
  355    HD1  HIS  52           HD1      HIS  52 -12.486  -2.924  -1.688
  356    HD2  HIS  52           HD2      HIS  52 -10.794   0.611  -3.070
  357    HE1  HIS  52           HE1      HIS  52 -14.424  -1.463  -2.345
  358    HE2  HIS  52           HE2      HIS  52 -13.374   0.639  -3.255
  359    H    ALA  53           HN       ALA  53  -7.985  -0.535   0.561
  360    HA   ALA  53           HA       ALA  53  -5.532  -1.415  -0.323
  361   1HB   ALA  53          HB1       ALA  53  -6.369   0.205   2.035
  362   2HB   ALA  53          HB2       ALA  53  -5.494   0.705   0.587
  363   3HB   ALA  53          HB3       ALA  53  -4.678  -0.249   1.827
  364    H    ARG  54           HN       ARG  54  -7.138  -2.157   2.711
  365    HA   ARG  54           HA       ARG  54  -5.179  -3.773   3.822
  366   1HB   ARG  54          HB2       ARG  54  -8.160  -4.023   4.199
  367   2HB   ARG  54          HB1       ARG  54  -6.925  -4.651   5.281
  368   1HG   ARG  54          HG2       ARG  54  -6.343  -2.540   6.049
  369   2HG   ARG  54          HG1       ARG  54  -7.062  -1.729   4.656
  370   1HD   ARG  54          HD2       ARG  54  -8.467  -3.040   6.971
  371   2HD   ARG  54          HD1       ARG  54  -8.504  -1.341   6.501
  372    HE   ARG  54           HE       ARG  54  -9.531  -2.575   4.338
  373   1HH1  ARG  54          HH11      ARG  54 -10.275  -2.775   7.742
  374   2HH1  ARG  54          HH12      ARG  54 -11.945  -3.153   7.483
  375   1HH2  ARG  54          HH21      ARG  54 -11.727  -3.073   3.995
  376   2HH2  ARG  54          HH22      ARG  54 -12.769  -3.323   5.356
  377    H    ASP  55           HN       ASP  55  -7.773  -4.544   1.618
  378    HA   ASP  55           HA       ASP  55  -7.472  -7.344   1.698
  379   1HB   ASP  55          HB2       ASP  55  -9.413  -5.890   0.748
  380   2HB   ASP  55          HB1       ASP  55  -8.454  -5.955  -0.727
  381    H    THR  56           HN       THR  56  -6.148  -4.864  -0.373
  382    HA   THR  56           HA       THR  56  -4.857  -6.477  -2.220
  383    HB   THR  56           HB       THR  56  -3.661  -3.919  -1.333
  384    HG1  THR  56           HG1      THR  56  -5.533  -3.012  -1.527
  385   1HG2  THR  56          HG21      THR  56  -3.327  -3.511  -3.674
  386   2HG2  THR  56          HG22      THR  56  -4.229  -4.971  -4.084
  387   3HG2  THR  56          HG23      THR  56  -2.679  -5.096  -3.252
  388    H    LEU  57           HN       LEU  57  -3.659  -5.096   0.813
  389    HA   LEU  57           HA       LEU  57  -1.076  -6.104   0.656
  390   1HB   LEU  57          HB2       LEU  57  -2.767  -4.902   2.680
  391   2HB   LEU  57          HB1       LEU  57  -1.569  -6.000   3.343
  392    HG   LEU  57           HG       LEU  57  -0.212  -4.376   1.497
  393   1HD1  LEU  57          HD11      LEU  57  -0.864  -2.230   1.742
  394   2HD1  LEU  57          HD12      LEU  57  -1.445  -2.480   3.388
  395   3HD1  LEU  57          HD13      LEU  57  -2.434  -2.984   2.018
  396   1HD2  LEU  57          HD21      LEU  57   0.465  -3.362   3.921
  397   2HD2  LEU  57          HD22      LEU  57   1.120  -4.852   3.242
  398   3HD2  LEU  57          HD23      LEU  57  -0.227  -4.918   4.378
  399    H    THR  58           HN       THR  58  -3.909  -7.386   2.290
  400    HA   THR  58           HA       THR  58  -2.707  -9.703   3.279
  401    HB   THR  58           HB       THR  58  -5.602  -9.645   2.504
  402    HG1  THR  58           HG1      THR  58  -4.520  -8.317   4.760
  403   1HG2  THR  58          HG21      THR  58  -5.055 -10.370   5.213
  404   2HG2  THR  58          HG22      THR  58  -4.054 -11.325   4.119
  405   3HG2  THR  58          HG23      THR  58  -5.808 -11.315   3.930
  406    H    SER  59           HN       SER  59  -4.427  -9.061   0.256
  407    HA   SER  59           HA       SER  59  -4.560 -11.600  -0.783
  408   1HB   SER  59          HB2       SER  59  -5.366  -9.305  -1.713
  409   2HB   SER  59          HB1       SER  59  -3.806  -9.326  -2.521
  410    HG   SER  59           HG       SER  59  -6.057 -10.705  -3.114
  411    H    CYS  60           HN       CYS  60  -1.905  -9.398  -0.545
  412    HA   CYS  60           HA       CYS  60  -0.114 -10.962  -2.154
  413   1HB   CYS  60          HB2       CYS  60  -0.205  -8.342  -1.439
  414   2HB   CYS  60          HB1       CYS  60   0.971  -8.952  -0.288
  415    H    GLY  61           HN       GLY  61  -0.875 -10.548   1.253
  416   1HA   GLY  61          HA2       GLY  61  -0.303 -11.815   3.078
  417   2HA   GLY  61          HA1       GLY  61   0.272 -13.039   1.956
  418    H    LEU  62           HN       LEU  62   1.293  -9.733   2.839
  419    HA   LEU  62           HA       LEU  62   4.011 -10.813   3.179
  420   1HB   LEU  62          HB2       LEU  62   4.444  -8.143   2.927
  421   2HB   LEU  62          HB1       LEU  62   4.577  -9.306   1.628
  422    HG   LEU  62           HG       LEU  62   1.885  -8.555   1.582
  423   1HD1  LEU  62          HD11      LEU  62   3.579  -6.361   2.584
  424   2HD1  LEU  62          HD12      LEU  62   1.843  -6.624   2.743
  425   3HD1  LEU  62          HD13      LEU  62   2.501  -5.968   1.246
  426   1HD2  LEU  62          HD21      LEU  62   4.208  -7.534  -0.043
  427   2HD2  LEU  62          HD22      LEU  62   2.509  -7.450  -0.505
  428   3HD2  LEU  62          HD23      LEU  62   3.302  -9.017  -0.341
  429    H    ALA  63           HN       ALA  63   2.731  -7.672   4.156
  430    HA   ALA  63           HA       ALA  63   2.735  -8.433   6.936
  431   1HB   ALA  63          HB1       ALA  63   4.436  -6.084   6.216
  432   2HB   ALA  63          HB2       ALA  63   5.108  -7.715   6.196
  433   3HB   ALA  63          HB3       ALA  63   4.438  -7.055   7.688
  434    H    VAL  64           HN       VAL  64   1.882  -6.734   8.340
  435    HA   VAL  64           HA       VAL  64   0.073  -4.964   6.888
  436    HB   VAL  64           HB       VAL  64  -0.945  -6.756   8.325
  437   1HG1  VAL  64          HG11      VAL  64  -0.956  -6.442  10.743
  438   2HG1  VAL  64          HG12      VAL  64   0.154  -5.081  10.578
  439   3HG1  VAL  64          HG13      VAL  64   0.681  -6.707  10.143
  440   1HG2  VAL  64          HG21      VAL  64  -2.589  -5.230   9.404
  441   2HG2  VAL  64          HG22      VAL  64  -2.270  -4.854   7.710
  442   3HG2  VAL  64          HG23      VAL  64  -1.539  -3.876   8.984
  443    HA   PRO  65           HA       PRO  65   2.297  -1.444   8.416
  444   1HB   PRO  65          HB2       PRO  65   0.147   0.289   8.679
  445   2HB   PRO  65          HB1       PRO  65   1.036  -0.004   7.182
  446   1HG   PRO  65          HG2       PRO  65  -1.537  -1.192   8.126
  447   2HG   PRO  65          HG1       PRO  65  -1.088  -0.634   6.502
  448   1HD   PRO  65          HD2       PRO  65  -1.105  -3.234   7.091
  449   2HD   PRO  65          HD1       PRO  65   0.167  -2.548   6.060
  450    H    HIS  66           HN       HIS  66   1.294   0.489  10.140
  451    HA   HIS  66           HA       HIS  66   1.111   0.954  12.362
  452   1HB   HIS  66          HB2       HIS  66  -0.507  -1.601  12.471
  453   2HB   HIS  66          HB1       HIS  66  -0.535  -0.293  13.649
  454    HD1  HIS  66           HD1      HIS  66  -2.486  -1.552  11.012
  455    HD2  HIS  66           HD2      HIS  66  -1.328   2.271  12.145
  456    HE1  HIS  66           HE1      HIS  66  -4.134   0.004   9.926
  457    HE2  HIS  66           HE2      HIS  66  -3.362   2.314  10.554
  458    H    CYS  67           HN       CYS  67   3.344  -0.625  11.413
  459    HA   CYS  67           HA       CYS  67   4.004  -2.779  13.051
  460   1HB   CYS  67          HB2       CYS  67   6.008  -0.767  12.031
  461   2HB   CYS  67          HB1       CYS  67   6.258  -2.482  12.340
  Start of MODEL    6
    1   1H    ALA   1          HT1       ALA   1   8.669   6.488   1.074
    2   2H    ALA   1          HT2       ALA   1   8.920   7.417   2.496
    3   3H    ALA   1          HT3       ALA   1   9.901   6.044   2.180
    4    HA   ALA   1           HA       ALA   1   9.783   8.320   0.346
    5   1HB   ALA   1          HB1       ALA   1  10.382   9.283   2.459
    6   2HB   ALA   1          HB2       ALA   1  11.837   9.151   1.471
    7   3HB   ALA   1          HB3       ALA   1  11.545   7.993   2.768
    8    H    CYS   2           HN       CYS   2   9.887   5.529  -0.208
    9    HA   CYS   2           HA       CYS   2  12.705   5.131  -0.949
   10   1HB   CYS   2          HB2       CYS   2  10.529   3.042  -1.056
   11   2HB   CYS   2          HB1       CYS   2  12.273   2.796  -1.071
   12    H    GLN   3           HN       GLN   3   9.551   4.200  -2.334
   13    HA   GLN   3           HA       GLN   3  10.059   5.611  -4.776
   14   1HB   GLN   3          HB2       GLN   3  10.738   2.761  -4.548
   15   2HB   GLN   3          HB1       GLN   3   9.693   3.147  -5.909
   16   1HG   GLN   3          HG2       GLN   3  11.303   4.281  -7.006
   17   2HG   GLN   3          HG1       GLN   3  12.034   4.897  -5.525
   18   1HE2  GLN   3          HE21      GLN   3  14.108   4.338  -5.769
   19   2HE2  GLN   3          HE22      GLN   3  14.678   2.723  -6.000
   20    H    ALA   4           HN       ALA   4   8.100   6.472  -4.970
   21    HA   ALA   4           HA       ALA   4   5.725   5.030  -4.234
   22   1HB   ALA   4          HB1       ALA   4   6.389   7.814  -4.951
   23   2HB   ALA   4          HB2       ALA   4   5.353   7.187  -3.669
   24   3HB   ALA   4          HB3       ALA   4   4.752   7.275  -5.324
   25    H    SER   5           HN       SER   5   7.477   5.781  -7.126
   26    HA   SER   5           HA       SER   5   5.381   5.407  -8.990
   27   1HB   SER   5          HB2       SER   5   8.297   4.881  -9.547
   28   2HB   SER   5          HB1       SER   5   7.057   5.448 -10.665
   29    HG   SER   5           HG       SER   5   7.122   7.427  -9.755
   30    H    GLN   6           HN       GLN   6   7.010   3.181  -7.014
   31    HA   GLN   6           HA       GLN   6   6.794   0.964  -8.805
   32   1HB   GLN   6          HB2       GLN   6   7.570   1.170  -5.901
   33   2HB   GLN   6          HB1       GLN   6   7.501  -0.356  -6.773
   34   1HG   GLN   6          HG2       GLN   6   9.078   1.696  -8.121
   35   2HG   GLN   6          HG1       GLN   6   9.697   1.244  -6.534
   36   1HE2  GLN   6          HE21      GLN   6   8.081  -0.606  -9.090
   37   2HE2  GLN   6          HE22      GLN   6   9.331  -1.787  -9.264
   38    H    LEU   7           HN       LEU   7   5.009   2.387  -6.193
   39    HA   LEU   7           HA       LEU   7   3.087   0.175  -6.208
   40   1HB   LEU   7          HB2       LEU   7   2.812   2.452  -4.324
   41   2HB   LEU   7          HB1       LEU   7   2.498   0.746  -4.073
   42    HG   LEU   7           HG       LEU   7   5.308   1.790  -4.345
   43   1HD1  LEU   7          HD11      LEU   7   4.013   1.350  -1.685
   44   2HD1  LEU   7          HD12      LEU   7   3.878   2.912  -2.494
   45   3HD1  LEU   7          HD13      LEU   7   5.467   2.263  -2.088
   46   1HD2  LEU   7          HD21      LEU   7   5.958  -0.276  -3.704
   47   2HD2  LEU   7          HD22      LEU   7   4.379  -0.740  -4.339
   48   3HD2  LEU   7          HD23      LEU   7   4.594  -0.486  -2.607
   49    H    ALA   8           HN       ALA   8   3.522   3.300  -7.462
   50    HA   ALA   8           HA       ALA   8   1.062   4.487  -7.389
   51   1HB   ALA   8          HB1       ALA   8   2.388   4.588 -10.014
   52   2HB   ALA   8          HB2       ALA   8   3.372   5.063  -8.630
   53   3HB   ALA   8          HB3       ALA   8   1.854   5.897  -8.961
   54    H    VAL   9           HN       VAL   9   2.112   1.848  -9.413
   55    HA   VAL   9           HA       VAL   9  -0.016   1.747 -11.193
   56    HB   VAL   9           HB       VAL   9   2.038   0.443 -11.506
   57   1HG1  VAL   9          HG11      VAL   9   2.432  -1.603 -10.262
   58   2HG1  VAL   9          HG12      VAL   9   0.980  -1.322  -9.300
   59   3HG1  VAL   9          HG13      VAL   9   2.356  -0.226  -9.163
   60   1HG2  VAL   9          HG21      VAL   9   0.999  -1.111 -12.763
   61   2HG2  VAL   9          HG22      VAL   9  -0.460  -0.256 -12.262
   62   3HG2  VAL   9          HG23      VAL   9   0.041  -1.718 -11.411
   63    H    CYS  10           HN       CYS  10   0.197   0.828  -7.884
   64    HA   CYS  10           HA       CYS  10  -2.178  -0.826  -7.917
   65   1HB   CYS  10          HB2       CYS  10  -0.080  -0.975  -6.345
   66   2HB   CYS  10          HB1       CYS  10  -0.933   0.254  -5.412
   67    H    ALA  11           HN       ALA  11  -1.235   2.418  -6.971
   68    HA   ALA  11           HA       ALA  11  -3.381   3.295  -5.536
   69   1HB   ALA  11          HB1       ALA  11  -2.550   5.372  -5.828
   70   2HB   ALA  11          HB2       ALA  11  -2.433   5.192  -7.579
   71   3HB   ALA  11          HB3       ALA  11  -1.196   4.491  -6.535
   72    H    SER  12           HN       SER  12  -3.255   2.583  -8.913
   73    HA   SER  12           HA       SER  12  -5.364   4.001  -9.947
   74   1HB   SER  12          HB2       SER  12  -4.514   1.171 -10.581
   75   2HB   SER  12          HB1       SER  12  -5.612   2.129 -11.575
   76    HG   SER  12           HG       SER  12  -3.025   3.040 -10.885
   77    H    ALA  13           HN       ALA  13  -5.446   1.224  -7.838
   78    HA   ALA  13           HA       ALA  13  -8.332   1.511  -7.647
   79   1HB   ALA  13          HB1       ALA  13  -8.859  -0.600  -8.244
   80   2HB   ALA  13          HB2       ALA  13  -7.371  -1.270  -7.575
   81   3HB   ALA  13          HB3       ALA  13  -7.351  -0.479  -9.151
   82    H    ILE  14           HN       ILE  14  -5.874   2.079  -5.934
   83    HA   ILE  14           HA       ILE  14  -6.160   0.270  -3.709
   84    HB   ILE  14           HB       ILE  14  -4.027   1.559  -4.422
   85   1HG1  ILE  14          HG12      ILE  14  -3.744   1.919  -1.693
   86   2HG1  ILE  14          HG11      ILE  14  -5.035   0.726  -1.809
   87   1HG2  ILE  14          HG21      ILE  14  -5.285   3.646  -2.648
   88   2HG2  ILE  14          HG22      ILE  14  -5.050   3.795  -4.389
   89   3HG2  ILE  14          HG23      ILE  14  -3.654   3.680  -3.318
   90   1HD1  ILE  14          HD11      ILE  14  -3.669  -0.862  -2.706
   91   2HD1  ILE  14          HD12      ILE  14  -2.512   0.016  -1.705
   92   3HD1  ILE  14          HD13      ILE  14  -2.587   0.321  -3.441
   93    H    LEU  15           HN       LEU  15  -7.035   3.643  -4.383
   94    HA   LEU  15           HA       LEU  15  -8.316   3.971  -1.824
   95   1HB   LEU  15          HB2       LEU  15  -8.520   5.757  -4.245
   96   2HB   LEU  15          HB1       LEU  15  -8.891   6.181  -2.585
   97    HG   LEU  15           HG       LEU  15  -6.250   5.375  -2.444
   98   1HD1  LEU  15          HD11      LEU  15  -6.506   7.127  -4.874
   99   2HD1  LEU  15          HD12      LEU  15  -6.276   5.381  -4.965
  100   3HD1  LEU  15          HD13      LEU  15  -5.048   6.393  -4.206
  101   1HD2  LEU  15          HD21      LEU  15  -6.851   8.239  -2.954
  102   2HD2  LEU  15          HD22      LEU  15  -5.891   7.492  -1.677
  103   3HD2  LEU  15          HD23      LEU  15  -7.653   7.451  -1.594
  104    H    SER  16           HN       SER  16  -9.619   4.371  -5.121
  105    HA   SER  16           HA       SER  16 -12.289   3.830  -4.196
  106   1HB   SER  16          HB2       SER  16 -11.307   4.135  -7.042
  107   2HB   SER  16          HB1       SER  16 -12.973   4.268  -6.478
  108    HG   SER  16           HG       SER  16 -10.893   6.087  -6.327
  109    H    GLY  17           HN       GLY  17 -10.330   2.318  -6.774
  110   1HA   GLY  17          HA2       GLY  17  -9.914  -0.094  -6.667
  111   2HA   GLY  17          HA1       GLY  17 -11.529  -0.268  -5.999
  112    H    ALA  18           HN       ALA  18 -10.291   1.519  -8.820
  113    HA   ALA  18           HA       ALA  18 -12.498   0.903 -10.439
  114   1HB   ALA  18          HB1       ALA  18  -9.728   1.778 -11.229
  115   2HB   ALA  18          HB2       ALA  18 -11.107   2.826 -10.895
  116   3HB   ALA  18          HB3       ALA  18 -11.130   1.761 -12.300
  117    H    LYS  19           HN       LYS  19  -9.326  -0.556 -10.171
  118    HA   LYS  19           HA       LYS  19 -10.163  -3.134 -10.854
  119   1HB   LYS  19          HB2       LYS  19  -9.075  -3.343 -13.094
  120   2HB   LYS  19          HB1       LYS  19 -10.525  -2.348 -13.089
  121   1HG   LYS  19          HG2       LYS  19  -8.105  -0.801 -12.639
  122   2HG   LYS  19          HG1       LYS  19  -8.088  -1.673 -14.173
  123   1HD   LYS  19          HD2       LYS  19 -10.250   0.201 -13.212
  124   2HD   LYS  19          HD1       LYS  19  -9.043   0.552 -14.450
  125   1HE   LYS  19          HE2       LYS  19  -9.995  -1.554 -15.621
  126   2HE   LYS  19          HE1       LYS  19 -11.382  -1.314 -14.560
  127   1HZ   LYS  19          HZ1       LYS  19 -12.032   0.513 -15.676
  128   2HZ   LYS  19          HZ2       LYS  19 -11.155  -0.178 -16.946
  129   3HZ   LYS  19          HZ3       LYS  19 -10.454   1.035 -15.998
  130    HA   PRO  20           HA       PRO  20  -6.063  -2.952  -8.826
  131   1HB   PRO  20          HB2       PRO  20  -6.362  -5.333  -7.531
  132   2HB   PRO  20          HB1       PRO  20  -6.983  -3.802  -6.905
  133   1HG   PRO  20          HG2       PRO  20  -8.424  -5.968  -8.384
  134   2HG   PRO  20          HG1       PRO  20  -8.950  -5.037  -6.969
  135   1HD   PRO  20          HD2       PRO  20  -9.813  -4.475  -9.463
  136   2HD   PRO  20          HD1       PRO  20  -9.564  -3.211  -8.242
  137    H    SER  21           HN       SER  21  -4.608  -5.177  -8.452
  138    HA   SER  21           HA       SER  21  -4.657  -7.062 -10.547
  139   1HB   SER  21          HB2       SER  21  -3.918  -4.774 -11.635
  140   2HB   SER  21          HB1       SER  21  -2.358  -5.183 -10.923
  141    HG   SER  21           HG       SER  21  -3.851  -6.632 -12.838
  142    H    GLY  22           HN       GLY  22  -3.152  -8.687 -10.249
  143   1HA   GLY  22          HA2       GLY  22  -2.115  -9.047  -7.682
  144   2HA   GLY  22          HA1       GLY  22  -1.649  -9.981  -9.095
  145    H    GLU  23           HN       GLU  23  -0.672  -7.556 -10.496
  146    HA   GLU  23           HA       GLU  23   2.002  -7.702 -10.001
  147   1HB   GLU  23          HB2       GLU  23   0.609  -6.490 -11.857
  148   2HB   GLU  23          HB1       GLU  23   0.789  -5.084 -10.807
  149   1HG   GLU  23          HG2       GLU  23   3.331  -6.076 -10.932
  150   2HG   GLU  23          HG1       GLU  23   2.708  -6.388 -12.549
  151    H    CYS  24           HN       CYS  24  -0.393  -5.779  -8.330
  152    HA   CYS  24           HA       CYS  24   1.187  -3.932  -7.036
  153   1HB   CYS  24          HB2       CYS  24  -1.301  -3.987  -6.988
  154   2HB   CYS  24          HB1       CYS  24  -1.215  -5.336  -5.860
  155    H    CYS  25           HN       CYS  25   0.937  -7.325  -6.500
  156    HA   CYS  25           HA       CYS  25   2.032  -7.316  -3.851
  157   1HB   CYS  25          HB2       CYS  25   1.191  -9.345  -5.824
  158   2HB   CYS  25          HB1       CYS  25   2.495  -9.843  -4.753
  159    H    GLY  26           HN       GLY  26   3.309  -8.151  -7.067
  160   1HA   GLY  26          HA2       GLY  26   5.936  -8.704  -6.231
  161   2HA   GLY  26          HA1       GLY  26   5.457  -8.262  -7.862
  162    H    ASN  27           HN       ASN  27   4.358  -5.674  -7.059
  163    HA   ASN  27           HA       ASN  27   6.685  -4.140  -7.316
  164   1HB   ASN  27          HB2       ASN  27   3.868  -3.338  -6.616
  165   2HB   ASN  27          HB1       ASN  27   5.160  -2.194  -6.964
  166   1HD2  ASN  27          HD21      ASN  27   6.291  -2.593  -9.089
  167   2HD2  ASN  27          HD22      ASN  27   5.285  -2.989 -10.436
  168    H    LEU  28           HN       LEU  28   4.334  -4.099  -4.698
  169    HA   LEU  28           HA       LEU  28   5.787  -2.647  -2.880
  170   1HB   LEU  28          HB2       LEU  28   4.267  -3.282  -1.261
  171   2HB   LEU  28          HB1       LEU  28   3.364  -3.528  -2.744
  172    HG   LEU  28           HG       LEU  28   4.362  -5.979  -2.491
  173   1HD1  LEU  28          HD11      LEU  28   4.007  -6.412   0.087
  174   2HD1  LEU  28          HD12      LEU  28   4.575  -4.747   0.200
  175   3HD1  LEU  28          HD13      LEU  28   5.585  -5.973  -0.568
  176   1HD2  LEU  28          HD21      LEU  28   2.043  -5.658  -2.715
  177   2HD2  LEU  28          HD22      LEU  28   1.935  -4.789  -1.184
  178   3HD2  LEU  28          HD23      LEU  28   2.245  -6.525  -1.192
  179    H    ARG  29           HN       ARG  29   6.139  -5.953  -3.802
  180    HA   ARG  29           HA       ARG  29   7.561  -6.986  -1.681
  181   1HB   ARG  29          HB2       ARG  29   6.918  -7.784  -4.310
  182   2HB   ARG  29          HB1       ARG  29   8.658  -7.973  -4.141
  183   1HG   ARG  29          HG2       ARG  29   8.393  -9.823  -2.962
  184   2HG   ARG  29          HG1       ARG  29   7.357  -8.983  -1.810
  185   1HD   ARG  29          HD2       ARG  29   5.730  -9.324  -4.014
  186   2HD   ARG  29          HD1       ARG  29   6.658 -10.823  -3.945
  187    HE   ARG  29           HE       ARG  29   5.534  -9.988  -1.424
  188   1HH1  ARG  29          HH11      ARG  29   5.012 -11.825  -4.348
  189   2HH1  ARG  29          HH12      ARG  29   3.833 -12.870  -3.629
  190   1HH2  ARG  29          HH21      ARG  29   3.985 -11.368  -0.479
  191   2HH2  ARG  29          HH22      ARG  29   3.248 -12.609  -1.435
  192    H    ALA  30           HN       ALA  30   8.679  -5.149  -4.444
  193    HA   ALA  30           HA       ALA  30  11.410  -5.317  -4.040
  194   1HB   ALA  30          HB1       ALA  30  11.636  -3.558  -5.527
  195   2HB   ALA  30          HB2       ALA  30  10.181  -2.749  -4.946
  196   3HB   ALA  30          HB3       ALA  30  10.047  -4.195  -5.947
  197    H    GLN  31           HN       GLN  31   8.989  -3.652  -2.263
  198    HA   GLN  31           HA       GLN  31  10.800  -1.846  -0.925
  199   1HB   GLN  31          HB2       GLN  31   8.069  -2.444   0.130
  200   2HB   GLN  31          HB1       GLN  31   8.943  -0.920   0.094
  201   1HG   GLN  31          HG2       GLN  31   8.529  -1.626  -2.582
  202   2HG   GLN  31          HG1       GLN  31   7.016  -1.962  -1.744
  203   1HE2  GLN  31          HE21      GLN  31   9.294   0.471  -2.692
  204   2HE2  GLN  31          HE22      GLN  31   8.291   1.840  -2.330
  205    H    GLN  32           HN       GLN  32   8.572  -4.257   0.445
  206    HA   GLN  32           HA       GLN  32   8.721  -5.539   2.316
  207   1HB   GLN  32          HB2       GLN  32  10.475  -6.393   0.478
  208   2HB   GLN  32          HB1       GLN  32  11.562  -6.117   1.834
  209   1HG   GLN  32          HG2       GLN  32  10.942  -8.042   2.726
  210   2HG   GLN  32          HG1       GLN  32   9.282  -7.455   2.820
  211   1HE2  GLN  32          HE21      GLN  32   7.966  -7.707   0.868
  212   2HE2  GLN  32          HE22      GLN  32   8.198  -9.115  -0.103
  213    H    GLY  33           HN       GLY  33   9.719  -2.671   2.461
  214   1HA   GLY  33          HA2       GLY  33  10.370  -2.672   5.206
  215   2HA   GLY  33          HA1       GLY  33  11.836  -2.441   4.264
  216    H    CYS  34           HN       CYS  34   8.782  -1.257   3.097
  217    HA   CYS  34           HA       CYS  34   9.460   1.420   3.900
  218   1HB   CYS  34          HB2       CYS  34  10.128   0.719   1.497
  219   2HB   CYS  34          HB1       CYS  34   8.417   0.931   1.192
  220    H    PHE  35           HN       PHE  35   7.029  -0.766   2.703
  221    HA   PHE  35           HA       PHE  35   4.826   0.915   2.742
  222   1HB   PHE  35          HB2       PHE  35   3.549  -1.266   3.336
  223   2HB   PHE  35          HB1       PHE  35   4.333  -1.122   1.772
  224    HD1  PHE  35           HD1      PHE  35   4.513  -2.649   5.110
  225    HD2  PHE  35           HD2      PHE  35   6.121  -2.613   1.164
  226    HE1  PHE  35           HE1      PHE  35   5.657  -4.777   5.557
  227    HE2  PHE  35           HE2      PHE  35   7.259  -4.734   1.613
  228    HZ   PHE  35           HZ       PHE  35   7.037  -5.821   3.808
  229    H    CYS  36           HN       CYS  36   5.948  -1.218   5.269
  230    HA   CYS  36           HA       CYS  36   4.082  -0.623   7.228
  231   1HB   CYS  36          HB2       CYS  36   6.082  -2.364   7.119
  232   2HB   CYS  36          HB1       CYS  36   6.902  -1.122   8.058
  233    H    GLN  37           HN       GLN  37   7.267   0.864   6.705
  234    HA   GLN  37           HA       GLN  37   7.018   2.705   8.811
  235   1HB   GLN  37          HB2       GLN  37   9.010   3.729   7.992
  236   2HB   GLN  37          HB1       GLN  37   9.176   1.994   7.764
  237   1HG   GLN  37          HG2       GLN  37   8.758   2.181   5.434
  238   2HG   GLN  37          HG1       GLN  37   8.292   3.873   5.591
  239   1HE2  GLN  37          HE21      GLN  37  10.329   2.752   3.891
  240   2HE2  GLN  37          HE22      GLN  37  11.825   3.477   4.356
  241    H    TYR  38           HN       TYR  38   5.904   2.702   5.554
  242    HA   TYR  38           HA       TYR  38   5.585   5.449   5.109
  243   1HB   TYR  38          HB2       TYR  38   4.730   2.985   3.867
  244   2HB   TYR  38          HB1       TYR  38   3.421   4.162   3.852
  245    HD1  TYR  38           HD1      TYR  38   6.078   2.957   2.009
  246    HD2  TYR  38           HD2      TYR  38   4.318   6.645   3.194
  247    HE1  TYR  38           HE1      TYR  38   7.108   4.064   0.070
  248    HE2  TYR  38           HE2      TYR  38   5.343   7.762   1.258
  249    HH   TYR  38           HH       TYR  38   6.821   6.022  -1.300
  250    H    ALA  39           HN       ALA  39   3.760   3.191   7.014
  251    HA   ALA  39           HA       ALA  39   1.319   4.464   7.220
  252   1HB   ALA  39          HB1       ALA  39   0.849   3.010   8.907
  253   2HB   ALA  39          HB2       ALA  39   2.434   3.198   9.656
  254   3HB   ALA  39          HB3       ALA  39   2.255   2.203   8.212
  255    H    LYS  40           HN       LYS  40   4.361   5.456   8.445
  256    HA   LYS  40           HA       LYS  40   3.200   7.223  10.442
  257   1HB   LYS  40          HB2       LYS  40   5.453   5.870  10.581
  258   2HB   LYS  40          HB1       LYS  40   6.099   7.256   9.715
  259   1HG   LYS  40          HG2       LYS  40   6.309   8.331  11.634
  260   2HG   LYS  40          HG1       LYS  40   4.558   8.274  11.843
  261   1HD   LYS  40          HD2       LYS  40   6.501   6.132  12.708
  262   2HD   LYS  40          HD1       LYS  40   5.745   7.321  13.770
  263   1HE   LYS  40          HE2       LYS  40   3.951   5.688  12.069
  264   2HE   LYS  40          HE1       LYS  40   4.757   4.867  13.405
  265   1HZ   LYS  40          HZ1       LYS  40   2.700   6.931  13.461
  266   2HZ   LYS  40          HZ2       LYS  40   3.887   7.015  14.664
  267   3HZ   LYS  40          HZ3       LYS  40   2.947   5.618  14.501
  268    H    ASP  41           HN       ASP  41   4.345   7.316   7.202
  269    HA   ASP  41           HA       ASP  41   4.966  10.069   7.025
  270   1HB   ASP  41          HB2       ASP  41   5.782   8.501   5.365
  271   2HB   ASP  41          HB1       ASP  41   4.130   8.086   4.899
  272    HA   PRO  42           HA       PRO  42   0.630  11.337   7.010
  273   1HB   PRO  42          HB2       PRO  42   0.973  13.783   7.957
  274   2HB   PRO  42          HB1       PRO  42   1.274  12.384   9.000
  275   1HG   PRO  42          HG2       PRO  42   3.229  14.110   7.533
  276   2HG   PRO  42          HG1       PRO  42   3.324  13.471   9.184
  277   1HD   PRO  42          HD2       PRO  42   4.555  12.350   6.955
  278   2HD   PRO  42          HD1       PRO  42   4.220  11.496   8.475
  279    H    THR  43           HN       THR  43   0.043  11.506   4.878
  280    HA   THR  43           HA       THR  43   0.075  14.053   3.661
  281    HB   THR  43           HB       THR  43   1.364  12.516   1.652
  282    HG1  THR  43           HG1      THR  43   2.267  11.367   3.454
  283   1HG2  THR  43          HG21      THR  43   3.147  14.265   1.894
  284   2HG2  THR  43          HG22      THR  43   2.189  14.940   3.212
  285   3HG2  THR  43          HG23      THR  43   1.519  14.866   1.582
  286    H    TYR  44           HN       TYR  44  -0.161  10.570   3.043
  287    HA   TYR  44           HA       TYR  44  -2.091  10.883   0.951
  288   1HB   TYR  44          HB2       TYR  44  -1.181   8.466   2.520
  289   2HB   TYR  44          HB1       TYR  44  -2.329   8.390   1.187
  290    HD1  TYR  44           HD1      TYR  44  -1.564   8.189  -1.011
  291    HD2  TYR  44           HD2      TYR  44   1.138   9.454   2.022
  292    HE1  TYR  44           HE1      TYR  44   0.298   8.024  -2.609
  293    HE2  TYR  44           HE2      TYR  44   3.007   9.293   0.432
  294    HH   TYR  44           HH       TYR  44   3.584   8.210  -1.629
  295    H    GLY  45           HN       GLY  45  -2.355   9.353   4.172
  296   1HA   GLY  45          HA2       GLY  45  -4.141   9.151   5.601
  297   2HA   GLY  45          HA1       GLY  45  -4.653  10.715   4.984
  298    H    GLN  46           HN       GLN  46  -4.306   7.899   2.946
  299    HA   GLN  46           HA       GLN  46  -7.042   7.122   3.062
  300   1HB   GLN  46          HB2       GLN  46  -6.432   9.306   1.400
  301   2HB   GLN  46          HB1       GLN  46  -6.646   7.931   0.325
  302   1HG   GLN  46          HG2       GLN  46  -8.855   7.678   0.857
  303   2HG   GLN  46          HG1       GLN  46  -8.666   8.399   2.455
  304   1HE2  GLN  46          HE21      GLN  46 -10.470   8.905   0.073
  305   2HE2  GLN  46          HE22      GLN  46 -10.365  10.620  -0.173
  306    H    TYR  47           HN       TYR  47  -4.032   7.117   1.215
  307    HA   TYR  47           HA       TYR  47  -4.462   4.813  -0.297
  308   1HB   TYR  47          HB2       TYR  47  -2.546   6.581  -0.362
  309   2HB   TYR  47          HB1       TYR  47  -1.770   5.469   0.757
  310    HD1  TYR  47           HD1      TYR  47  -2.005   2.883  -0.093
  311    HD2  TYR  47           HD2      TYR  47  -1.906   6.351  -2.557
  312    HE1  TYR  47           HE1      TYR  47  -1.215   1.515  -1.977
  313    HE2  TYR  47           HE2      TYR  47  -1.118   4.992  -4.447
  314    HH   TYR  47           HH       TYR  47   0.199   2.067  -4.188
  315    H    ILE  48           HN       ILE  48  -2.732   5.163   2.785
  316    HA   ILE  48           HA       ILE  48  -2.445   2.349   3.129
  317    HB   ILE  48           HB       ILE  48  -2.110   4.512   5.205
  318   1HG1  ILE  48          HG12      ILE  48  -0.170   3.345   3.203
  319   2HG1  ILE  48          HG11      ILE  48  -0.668   5.027   3.352
  320   1HG2  ILE  48          HG21      ILE  48  -2.166   1.785   5.542
  321   2HG2  ILE  48          HG22      ILE  48  -1.393   2.942   6.626
  322   3HG2  ILE  48          HG23      ILE  48  -0.443   2.127   5.383
  323   1HD1  ILE  48          HD11      ILE  48   0.450   5.125   5.545
  324   2HD1  ILE  48          HD12      ILE  48   1.554   4.749   4.222
  325   3HD1  ILE  48          HD13      ILE  48   1.007   3.469   5.306
  326    H    ARG  49           HN       ARG  49  -4.497   4.822   4.668
  327    HA   ARG  49           HA       ARG  49  -5.896   2.836   6.209
  328   1HB   ARG  49          HB2       ARG  49  -6.768   5.691   5.834
  329   2HB   ARG  49          HB1       ARG  49  -7.104   4.622   7.188
  330   1HG   ARG  49          HG2       ARG  49  -4.743   4.688   7.824
  331   2HG   ARG  49          HG1       ARG  49  -4.414   5.771   6.471
  332   1HD   ARG  49          HD2       ARG  49  -6.291   6.347   8.762
  333   2HD   ARG  49          HD1       ARG  49  -4.654   6.981   8.600
  334    HE   ARG  49           HE       ARG  49  -6.343   7.573   6.354
  335   1HH1  ARG  49          HH11      ARG  49  -5.357   8.611   9.537
  336   2HH1  ARG  49          HH12      ARG  49  -5.776  10.269   9.262
  337   1HH2  ARG  49          HH21      ARG  49  -6.896   9.751   5.991
  338   2HH2  ARG  49          HH22      ARG  49  -6.651  10.916   7.250
  339    H    SER  50           HN       SER  50  -5.992   2.603   3.304
  340    HA   SER  50           HA       SER  50  -8.677   3.247   2.516
  341   1HB   SER  50          HB2       SER  50  -6.423   2.956   1.106
  342   2HB   SER  50          HB1       SER  50  -7.077   1.328   0.969
  343    HG   SER  50           HG       SER  50  -8.608   3.631   0.406
  344    HA   PRO  51           HA       PRO  51 -10.557  -0.507   3.887
  345   1HB   PRO  51          HB2       PRO  51 -12.601  -0.757   2.139
  346   2HB   PRO  51          HB1       PRO  51 -12.573   0.493   3.388
  347   1HG   PRO  51          HG2       PRO  51 -11.897   0.703   0.480
  348   2HG   PRO  51          HG1       PRO  51 -12.825   1.820   1.498
  349   1HD   PRO  51          HD2       PRO  51 -10.210   2.217   0.848
  350   2HD   PRO  51          HD1       PRO  51 -10.935   2.805   2.357
  351    H    HIS  52           HN       HIS  52 -10.093  -0.280   0.368
  352    HA   HIS  52           HA       HIS  52 -10.032  -3.138   0.052
  353   1HB   HIS  52          HB2       HIS  52  -9.118  -1.184  -2.037
  354   2HB   HIS  52          HB1       HIS  52  -9.881  -2.755  -2.256
  355    HD1  HIS  52           HD1      HIS  52 -12.492  -2.741  -1.178
  356    HD2  HIS  52           HD2      HIS  52 -10.840   0.838  -2.494
  357    HE1  HIS  52           HE1      HIS  52 -14.441  -1.198  -1.555
  358    HE2  HIS  52           HE2      HIS  52 -13.413   0.986  -2.274
  359    H    ALA  53           HN       ALA  53  -7.717  -0.620   0.545
  360    HA   ALA  53           HA       ALA  53  -5.427  -1.776  -0.490
  361   1HB   ALA  53          HB1       ALA  53  -4.189  -0.362   1.124
  362   2HB   ALA  53          HB2       ALA  53  -5.730   0.042   1.882
  363   3HB   ALA  53          HB3       ALA  53  -5.418   0.515   0.212
  364    H    ARG  54           HN       ARG  54  -6.669  -1.942   2.797
  365    HA   ARG  54           HA       ARG  54  -4.745  -3.566   3.913
  366   1HB   ARG  54          HB2       ARG  54  -7.120  -2.449   4.758
  367   2HB   ARG  54          HB1       ARG  54  -7.432  -4.175   4.876
  368   1HG   ARG  54          HG2       ARG  54  -5.650  -4.494   6.388
  369   2HG   ARG  54          HG1       ARG  54  -4.999  -2.885   6.070
  370   1HD   ARG  54          HD2       ARG  54  -6.263  -3.181   8.243
  371   2HD   ARG  54          HD1       ARG  54  -6.760  -1.831   7.226
  372    HE   ARG  54           HE       ARG  54  -8.492  -3.656   6.434
  373   1HH1  ARG  54          HH11      ARG  54  -7.438  -2.897   9.679
  374   2HH1  ARG  54          HH12      ARG  54  -8.927  -3.392  10.407
  375   1HH2  ARG  54          HH21      ARG  54 -10.448  -4.301   7.397
  376   2HH2  ARG  54          HH22      ARG  54 -10.635  -4.187   9.115
  377    H    ASP  55           HN       ASP  55  -7.445  -4.401   1.899
  378    HA   ASP  55           HA       ASP  55  -7.356  -7.193   2.359
  379   1HB   ASP  55          HB2       ASP  55  -9.249  -5.729   1.326
  380   2HB   ASP  55          HB1       ASP  55  -8.381  -6.046  -0.172
  381    H    THR  56           HN       THR  56  -5.975  -5.068  -0.038
  382    HA   THR  56           HA       THR  56  -4.895  -6.977  -1.738
  383    HB   THR  56           HB       THR  56  -3.492  -4.423  -1.228
  384    HG1  THR  56           HG1      THR  56  -5.922  -4.610  -2.653
  385   1HG2  THR  56          HG21      THR  56  -3.379  -4.320  -3.670
  386   2HG2  THR  56          HG22      THR  56  -4.228  -5.864  -3.753
  387   3HG2  THR  56          HG23      THR  56  -2.626  -5.776  -3.021
  388    H    LEU  57           HN       LEU  57  -3.433  -5.293   1.019
  389    HA   LEU  57           HA       LEU  57  -0.942  -6.502   0.894
  390   1HB   LEU  57          HB2       LEU  57  -2.423  -4.897   2.775
  391   2HB   LEU  57          HB1       LEU  57  -1.375  -6.049   3.584
  392    HG   LEU  57           HG       LEU  57   0.112  -4.812   1.508
  393   1HD1  LEU  57          HD11      LEU  57  -0.034  -2.481   2.801
  394   2HD1  LEU  57          HD12      LEU  57  -1.712  -3.001   2.956
  395   3HD1  LEU  57          HD13      LEU  57  -0.982  -2.842   1.359
  396   1HD2  LEU  57          HD21      LEU  57   0.608  -5.752   3.954
  397   2HD2  LEU  57          HD22      LEU  57   0.528  -4.031   4.328
  398   3HD2  LEU  57          HD23      LEU  57   1.681  -4.621   3.131
  399    H    THR  58           HN       THR  58  -3.765  -7.367   2.798
  400    HA   THR  58           HA       THR  58  -2.690  -9.621   4.034
  401    HB   THR  58           HB       THR  58  -5.591  -9.216   3.301
  402    HG1  THR  58           HG1      THR  58  -5.069  -7.412   4.396
  403   1HG2  THR  58          HG21      THR  58  -5.401 -11.360   4.211
  404   2HG2  THR  58          HG22      THR  58  -5.912 -10.336   5.553
  405   3HG2  THR  58          HG23      THR  58  -4.226 -10.838   5.418
  406    H    SER  59           HN       SER  59  -4.500  -9.278   1.009
  407    HA   SER  59           HA       SER  59  -4.793 -11.915   0.305
  408   1HB   SER  59          HB2       SER  59  -5.514  -9.709  -0.880
  409   2HB   SER  59          HB1       SER  59  -3.991  -9.920  -1.729
  410    HG   SER  59           HG       SER  59  -4.705 -11.843  -2.551
  411    H    CYS  60           HN       CYS  60  -2.024  -9.858   0.219
  412    HA   CYS  60           HA       CYS  60  -0.361 -11.665  -1.263
  413   1HB   CYS  60          HB2       CYS  60  -0.320  -8.979  -0.763
  414   2HB   CYS  60          HB1       CYS  60   0.896  -9.561   0.360
  415    H    GLY  61           HN       GLY  61  -0.952 -10.817   2.109
  416   1HA   GLY  61          HA2       GLY  61  -0.405 -11.927   4.044
  417   2HA   GLY  61          HA1       GLY  61   0.069 -13.295   3.047
  418    H    LEU  62           HN       LEU  62   1.267  -9.977   3.617
  419    HA   LEU  62           HA       LEU  62   3.944 -11.155   3.962
  420   1HB   LEU  62          HB2       LEU  62   4.489  -8.550   3.389
  421   2HB   LEU  62          HB1       LEU  62   4.546  -9.869   2.242
  422    HG   LEU  62           HG       LEU  62   1.886  -9.016   2.155
  423   1HD1  LEU  62          HD11      LEU  62   2.578  -6.520   1.493
  424   2HD1  LEU  62          HD12      LEU  62   3.703  -6.787   2.824
  425   3HD1  LEU  62          HD13      LEU  62   1.967  -6.960   3.087
  426   1HD2  LEU  62          HD21      LEU  62   2.551  -8.133  -0.061
  427   2HD2  LEU  62          HD22      LEU  62   3.148  -9.762   0.251
  428   3HD2  LEU  62          HD23      LEU  62   4.240  -8.384   0.383
  429    H    ALA  63           HN       ALA  63   2.642  -7.918   4.656
  430    HA   ALA  63           HA       ALA  63   2.929  -8.370   7.492
  431   1HB   ALA  63          HB1       ALA  63   5.143  -7.499   6.291
  432   2HB   ALA  63          HB2       ALA  63   4.690  -7.013   7.925
  433   3HB   ALA  63          HB3       ALA  63   4.344  -5.950   6.561
  434    H    VAL  64           HN       VAL  64   2.750  -5.863   8.467
  435    HA   VAL  64           HA       VAL  64   0.602  -4.470   7.138
  436    HB   VAL  64           HB       VAL  64   0.314  -5.547   9.901
  437   1HG1  VAL  64          HG11      VAL  64  -1.830  -4.518  10.004
  438   2HG1  VAL  64          HG12      VAL  64  -1.737  -4.033   8.311
  439   3HG1  VAL  64          HG13      VAL  64  -0.680  -3.278   9.504
  440   1HG2  VAL  64          HG21      VAL  64  -0.798  -6.396   7.276
  441   2HG2  VAL  64          HG22      VAL  64  -1.747  -6.640   8.741
  442   3HG2  VAL  64          HG23      VAL  64  -0.152  -7.378   8.590
  443    HA   PRO  65           HA       PRO  65   2.843  -0.962   8.679
  444   1HB   PRO  65          HB2       PRO  65   0.729   0.810   8.875
  445   2HB   PRO  65          HB1       PRO  65   1.615   0.464   7.388
  446   1HG   PRO  65          HG2       PRO  65  -0.981  -0.659   8.355
  447   2HG   PRO  65          HG1       PRO  65  -0.529  -0.130   6.723
  448   1HD   PRO  65          HD2       PRO  65  -0.584  -2.722   7.352
  449   2HD   PRO  65          HD1       PRO  65   0.690  -2.069   6.301
  450    H    HIS  66           HN       HIS  66   1.845   0.997  10.363
  451    HA   HIS  66           HA       HIS  66   1.587   1.497  12.567
  452   1HB   HIS  66          HB2       HIS  66  -0.114  -0.997  12.447
  453   2HB   HIS  66          HB1       HIS  66   0.003   0.027  13.875
  454    HD1  HIS  66           HD1      HIS  66  -1.756  -0.317  10.688
  455    HD2  HIS  66           HD2      HIS  66  -1.045   2.702  13.448
  456    HE1  HIS  66           HE1      HIS  66  -3.428   1.485  10.166
  457    HE2  HIS  66           HE2      HIS  66  -2.920   3.338  11.789
  458    H    CYS  67           HN       CYS  67   3.896   0.024  11.769
  459    HA   CYS  67           HA       CYS  67   4.387  -1.728  14.075
  460   1HB   CYS  67          HB2       CYS  67   6.435  -2.415  12.781
  461   2HB   CYS  67          HB1       CYS  67   4.905  -2.817  12.009
  Start of MODEL    7
    1   1H    ALA   1          HT1       ALA   1  16.594   3.989  -3.234
    2   2H    ALA   1          HT2       ALA   1  15.886   2.431  -3.366
    3   3H    ALA   1          HT3       ALA   1  17.422   2.619  -2.623
    4    HA   ALA   1           HA       ALA   1  15.836   2.293  -0.956
    5   1HB   ALA   1          HB1       ALA   1  15.925   4.787  -0.001
    6   2HB   ALA   1          HB2       ALA   1  17.127   4.932  -1.284
    7   3HB   ALA   1          HB3       ALA   1  17.327   3.717  -0.021
    8    H    CYS   2           HN       CYS   2  13.836   1.855  -2.186
    9    HA   CYS   2           HA       CYS   2  11.612   2.167  -2.536
   10   1HB   CYS   2          HB2       CYS   2  11.752   4.609  -0.780
   11   2HB   CYS   2          HB1       CYS   2  10.405   3.499  -1.006
   12    H    GLN   3           HN       GLN   3  11.313   2.712  -4.608
   13    HA   GLN   3           HA       GLN   3  12.212   5.075  -5.833
   14   1HB   GLN   3          HB2       GLN   3   9.855   3.464  -6.792
   15   2HB   GLN   3          HB1       GLN   3  11.009   4.381  -7.751
   16   1HG   GLN   3          HG2       GLN   3  12.669   2.626  -6.565
   17   2HG   GLN   3          HG1       GLN   3  11.196   1.661  -6.648
   18   1HE2  GLN   3          HE21      GLN   3  10.595   0.801  -8.546
   19   2HE2  GLN   3          HE22      GLN   3  11.424   1.044 -10.042
   20    H    ALA   4           HN       ALA   4   9.444   4.440  -3.887
   21    HA   ALA   4           HA       ALA   4   7.845   5.828  -3.044
   22   1HB   ALA   4          HB1       ALA   4   8.998   8.098  -4.636
   23   2HB   ALA   4          HB2       ALA   4   9.744   7.520  -3.147
   24   3HB   ALA   4          HB3       ALA   4   8.100   8.159  -3.119
   25    H    SER   5           HN       SER   5   8.001   4.740  -6.036
   26    HA   SER   5           HA       SER   5   5.376   5.834  -6.735
   27   1HB   SER   5          HB2       SER   5   7.556   6.757  -8.036
   28   2HB   SER   5          HB1       SER   5   7.197   5.337  -9.019
   29    HG   SER   5           HG       SER   5   5.159   6.152  -9.415
   30    H    GLN   6           HN       GLN   6   6.813   3.201  -5.809
   31    HA   GLN   6           HA       GLN   6   6.132   1.367  -7.878
   32   1HB   GLN   6          HB2       GLN   6   7.059   0.963  -5.039
   33   2HB   GLN   6          HB1       GLN   6   6.768  -0.355  -6.166
   34   1HG   GLN   6          HG2       GLN   6   8.426   1.116  -7.654
   35   2HG   GLN   6          HG1       GLN   6   8.981   1.593  -6.051
   36   1HE2  GLN   6          HE21      GLN   6   8.288  -1.225  -8.060
   37   2HE2  GLN   6          HE22      GLN   6   9.486  -2.249  -7.351
   38    H    LEU   7           HN       LEU   7   4.539   2.799  -5.212
   39    HA   LEU   7           HA       LEU   7   2.486   0.723  -5.118
   40   1HB   LEU   7          HB2       LEU   7   2.423   3.204  -3.452
   41   2HB   LEU   7          HB1       LEU   7   1.807   1.604  -3.082
   42    HG   LEU   7           HG       LEU   7   4.762   2.081  -3.320
   43   1HD1  LEU   7          HD11      LEU   7   3.828   3.738  -1.733
   44   2HD1  LEU   7          HD12      LEU   7   4.895   2.558  -0.971
   45   3HD1  LEU   7          HD13      LEU   7   3.146   2.407  -0.799
   46   1HD2  LEU   7          HD21      LEU   7   2.963  -0.057  -2.403
   47   2HD2  LEU   7          HD22      LEU   7   4.359   0.249  -1.371
   48   3HD2  LEU   7          HD23      LEU   7   4.593  -0.149  -3.073
   49    H    ALA   8           HN       ALA   8   3.075   3.777  -6.541
   50    HA   ALA   8           HA       ALA   8   0.653   5.024  -6.650
   51   1HB   ALA   8          HB1       ALA   8   1.357   6.033  -8.726
   52   2HB   ALA   8          HB2       ALA   8   2.555   4.761  -8.964
   53   3HB   ALA   8          HB3       ALA   8   2.734   5.902  -7.632
   54    H    VAL   9           HN       VAL   9   1.793   2.596  -8.932
   55    HA   VAL   9           HA       VAL   9  -0.440   2.399 -10.530
   56    HB   VAL   9           HB       VAL   9   1.681   1.304 -11.072
   57   1HG1  VAL   9          HG11      VAL   9   1.075  -0.999  -9.299
   58   2HG1  VAL   9          HG12      VAL   9   1.800   0.436  -8.574
   59   3HG1  VAL   9          HG13      VAL   9   2.625  -0.399  -9.890
   60   1HG2  VAL   9          HG21      VAL   9   0.233  -1.127 -11.226
   61   2HG2  VAL   9          HG22      VAL   9   0.473   0.086 -12.482
   62   3HG2  VAL   9          HG23      VAL   9  -0.920   0.194 -11.407
   63    H    CYS  10           HN       CYS  10   0.053   1.235  -7.327
   64    HA   CYS  10           HA       CYS  10  -2.091  -0.676  -7.324
   65   1HB   CYS  10          HB2       CYS  10   0.020  -0.471  -5.771
   66   2HB   CYS  10          HB1       CYS  10  -1.021   0.593  -4.832
   67    H    ALA  11           HN       ALA  11  -1.686   2.693  -6.639
   68    HA   ALA  11           HA       ALA  11  -3.746   3.413  -5.042
   69   1HB   ALA  11          HB1       ALA  11  -3.378   5.005  -7.530
   70   2HB   ALA  11          HB2       ALA  11  -2.024   4.837  -6.412
   71   3HB   ALA  11          HB3       ALA  11  -3.541   5.547  -5.860
   72    H    SER  12           HN       SER  12  -3.969   2.276  -8.304
   73    HA   SER  12           HA       SER  12  -6.480   3.069  -9.078
   74   1HB   SER  12          HB2       SER  12  -4.670   1.555 -10.257
   75   2HB   SER  12          HB1       SER  12  -5.660   0.244  -9.617
   76    HG   SER  12           HG       SER  12  -7.462   1.259 -10.678
   77    H    ALA  13           HN       ALA  13  -5.591   0.630  -6.748
   78    HA   ALA  13           HA       ALA  13  -8.341  -0.249  -6.468
   79   1HB   ALA  13          HB1       ALA  13  -5.709  -1.341  -5.697
   80   2HB   ALA  13          HB2       ALA  13  -7.130  -2.157  -6.348
   81   3HB   ALA  13          HB3       ALA  13  -7.069  -1.720  -4.641
   82    H    ILE  14           HN       ILE  14  -5.915   1.631  -4.817
   83    HA   ILE  14           HA       ILE  14  -7.293   1.718  -2.303
   84    HB   ILE  14           HB       ILE  14  -5.020   3.371  -3.410
   85   1HG1  ILE  14          HG12      ILE  14  -3.924   2.102  -1.369
   86   2HG1  ILE  14          HG11      ILE  14  -5.253   0.976  -1.633
   87   1HG2  ILE  14          HG21      ILE  14  -4.904   3.790  -0.741
   88   2HG2  ILE  14          HG22      ILE  14  -6.649   3.747  -0.992
   89   3HG2  ILE  14          HG23      ILE  14  -5.657   4.899  -1.886
   90   1HD1  ILE  14          HD11      ILE  14  -2.816   0.929  -2.893
   91   2HD1  ILE  14          HD12      ILE  14  -3.874   1.672  -4.092
   92   3HD1  ILE  14          HD13      ILE  14  -4.274   0.091  -3.422
   93    H    LEU  15           HN       LEU  15  -6.502   4.367  -4.558
   94    HA   LEU  15           HA       LEU  15  -8.489   6.091  -3.509
   95   1HB   LEU  15          HB2       LEU  15  -6.870   6.170  -6.047
   96   2HB   LEU  15          HB1       LEU  15  -8.002   7.434  -5.605
   97    HG   LEU  15           HG       LEU  15  -5.691   6.621  -3.851
   98   1HD1  LEU  15          HD11      LEU  15  -5.819   8.886  -5.836
   99   2HD1  LEU  15          HD12      LEU  15  -4.855   7.419  -6.012
  100   3HD1  LEU  15          HD13      LEU  15  -4.502   8.555  -4.710
  101   1HD2  LEU  15          HD21      LEU  15  -7.492   9.038  -3.898
  102   2HD2  LEU  15          HD22      LEU  15  -6.093   8.834  -2.845
  103   3HD2  LEU  15          HD23      LEU  15  -7.480   7.757  -2.686
  104    H    SER  16           HN       SER  16  -8.337   5.105  -6.917
  105    HA   SER  16           HA       SER  16 -10.991   5.558  -7.511
  106   1HB   SER  16          HB2       SER  16  -9.268   5.148  -9.218
  107   2HB   SER  16          HB1       SER  16  -9.188   3.455  -8.733
  108    HG   SER  16           HG       SER  16 -11.419   3.298  -9.332
  109    H    GLY  17           HN       GLY  17  -9.552   2.355  -6.850
  110   1HA   GLY  17          HA2       GLY  17 -10.532   0.754  -5.388
  111   2HA   GLY  17          HA1       GLY  17 -12.077   1.569  -5.577
  112    H    ALA  18           HN       ALA  18 -10.040   0.824  -8.309
  113    HA   ALA  18           HA       ALA  18 -12.060  -0.472  -9.736
  114   1HB   ALA  18          HB1       ALA  18  -9.160  -0.074 -10.073
  115   2HB   ALA  18          HB2       ALA  18 -10.486   0.231 -11.195
  116   3HB   ALA  18          HB3       ALA  18  -9.877  -1.409 -10.974
  117    H    LYS  19           HN       LYS  19  -9.067  -2.114  -8.925
  118    HA   LYS  19           HA       LYS  19 -10.179  -4.161  -7.356
  119   1HB   LYS  19          HB2       LYS  19  -9.795  -5.984  -9.193
  120   2HB   LYS  19          HB1       LYS  19 -11.322  -5.118  -9.121
  121   1HG   LYS  19          HG2       LYS  19 -10.725  -5.187 -11.391
  122   2HG   LYS  19          HG1       LYS  19 -10.366  -3.545 -10.853
  123   1HD   LYS  19          HD2       LYS  19  -8.049  -3.958 -10.798
  124   2HD   LYS  19          HD1       LYS  19  -8.277  -5.706 -10.877
  125   1HE   LYS  19          HE2       LYS  19  -8.903  -5.624 -13.147
  126   2HE   LYS  19          HE1       LYS  19  -9.142  -3.878 -13.099
  127   1HZ   LYS  19          HZ1       LYS  19  -6.862  -3.492 -13.078
  128   2HZ   LYS  19          HZ2       LYS  19  -7.028  -4.762 -14.182
  129   3HZ   LYS  19          HZ3       LYS  19  -6.485  -5.074 -12.611
  130    HA   PRO  20           HA       PRO  20  -5.966  -4.945  -6.385
  131   1HB   PRO  20          HB2       PRO  20  -6.579  -7.847  -6.650
  132   2HB   PRO  20          HB1       PRO  20  -5.861  -6.968  -5.296
  133   1HG   PRO  20          HG2       PRO  20  -8.390  -7.791  -5.189
  134   2HG   PRO  20          HG1       PRO  20  -7.915  -6.218  -4.521
  135   1HD   PRO  20          HD2       PRO  20  -9.342  -6.846  -7.068
  136   2HD   PRO  20          HD1       PRO  20  -9.566  -5.481  -5.954
  137    H    SER  21           HN       SER  21  -4.097  -6.528  -7.114
  138    HA   SER  21           HA       SER  21  -4.120  -7.591  -9.716
  139   1HB   SER  21          HB2       SER  21  -3.430  -4.711  -9.455
  140   2HB   SER  21          HB1       SER  21  -2.409  -5.685 -10.512
  141    HG   SER  21           HG       SER  21  -4.084  -4.914 -11.742
  142    H    GLY  22           HN       GLY  22  -2.366  -8.862 -10.010
  143   1HA   GLY  22          HA2       GLY  22  -0.639  -9.422  -7.893
  144   2HA   GLY  22          HA1       GLY  22  -0.381  -9.919  -9.558
  145    H    GLU  23           HN       GLU  23  -0.353  -7.057 -10.434
  146    HA   GLU  23           HA       GLU  23   2.380  -6.639 -10.475
  147   1HB   GLU  23          HB2       GLU  23   0.409  -5.629 -11.873
  148   2HB   GLU  23          HB1       GLU  23   0.455  -4.353 -10.656
  149   1HG   GLU  23          HG2       GLU  23   3.075  -4.596 -11.313
  150   2HG   GLU  23          HG1       GLU  23   2.280  -4.944 -12.845
  151    H    CYS  24           HN       CYS  24  -0.093  -5.110  -8.425
  152    HA   CYS  24           HA       CYS  24   1.515  -3.344  -7.053
  153   1HB   CYS  24          HB2       CYS  24  -0.925  -3.325  -6.880
  154   2HB   CYS  24          HB1       CYS  24  -0.883  -4.851  -6.003
  155    H    CYS  25           HN       CYS  25   1.204  -6.771  -6.666
  156    HA   CYS  25           HA       CYS  25   2.409  -6.942  -4.092
  157   1HB   CYS  25          HB2       CYS  25   1.604  -8.846  -6.209
  158   2HB   CYS  25          HB1       CYS  25   2.896  -9.385  -5.144
  159    H    GLY  26           HN       GLY  26   3.663  -7.679  -7.352
  160   1HA   GLY  26          HA2       GLY  26   6.302  -8.181  -6.614
  161   2HA   GLY  26          HA1       GLY  26   5.797  -7.599  -8.194
  162    H    ASN  27           HN       ASN  27   4.653  -5.127  -7.087
  163    HA   ASN  27           HA       ASN  27   6.972  -3.539  -7.212
  164   1HB   ASN  27          HB2       ASN  27   4.123  -2.834  -6.534
  165   2HB   ASN  27          HB1       ASN  27   5.403  -1.645  -6.754
  166   1HD2  ASN  27          HD21      ASN  27   6.667  -2.050  -8.882
  167   2HD2  ASN  27          HD22      ASN  27   5.679  -2.275 -10.281
  168    H    LEU  28           HN       LEU  28   4.548  -3.687  -4.661
  169    HA   LEU  28           HA       LEU  28   6.005  -2.396  -2.718
  170   1HB   LEU  28          HB2       LEU  28   4.521  -3.342  -1.080
  171   2HB   LEU  28          HB1       LEU  28   3.613  -2.911  -2.517
  172    HG   LEU  28           HG       LEU  28   4.112  -5.478  -3.084
  173   1HD1  LEU  28          HD11      LEU  28   3.603  -5.684  -0.159
  174   2HD1  LEU  28          HD12      LEU  28   5.262  -5.527  -0.736
  175   3HD1  LEU  28          HD13      LEU  28   4.264  -6.876  -1.275
  176   1HD2  LEU  28          HD21      LEU  28   1.868  -5.923  -2.507
  177   2HD2  LEU  28          HD22      LEU  28   1.926  -4.208  -2.911
  178   3HD2  LEU  28          HD23      LEU  28   1.880  -4.715  -1.223
  179    H    ARG  29           HN       ARG  29   6.310  -5.616  -3.900
  180    HA   ARG  29           HA       ARG  29   7.608  -6.849  -1.795
  181   1HB   ARG  29          HB2       ARG  29   7.208  -7.328  -4.629
  182   2HB   ARG  29          HB1       ARG  29   8.782  -7.891  -4.088
  183   1HG   ARG  29          HG2       ARG  29   6.963  -9.591  -4.038
  184   2HG   ARG  29          HG1       ARG  29   7.813  -9.364  -2.513
  185   1HD   ARG  29          HD2       ARG  29   5.850  -7.655  -2.076
  186   2HD   ARG  29          HD1       ARG  29   5.023  -8.656  -3.267
  187    HE   ARG  29           HE       ARG  29   5.700  -9.373  -0.565
  188   1HH1  ARG  29          HH11      ARG  29   4.944 -10.582  -3.751
  189   2HH1  ARG  29          HH12      ARG  29   4.395 -12.119  -3.173
  190   1HH2  ARG  29          HH21      ARG  29   4.979 -11.395   0.196
  191   2HH2  ARG  29          HH22      ARG  29   4.414 -12.581  -0.933
  192    H    ALA  30           HN       ALA  30   8.897  -4.935  -4.436
  193    HA   ALA  30           HA       ALA  30  11.595  -5.238  -3.955
  194   1HB   ALA  30          HB1       ALA  30  10.747  -2.505  -4.649
  195   2HB   ALA  30          HB2       ALA  30  10.163  -3.786  -5.712
  196   3HB   ALA  30          HB3       ALA  30  11.895  -3.575  -5.454
  197    H    GLN  31           HN       GLN  31   9.202  -3.528  -2.168
  198    HA   GLN  31           HA       GLN  31  11.077  -1.965  -0.621
  199   1HB   GLN  31          HB2       GLN  31   8.262  -2.369   0.272
  200   2HB   GLN  31          HB1       GLN  31   9.256  -0.920   0.319
  201   1HG   GLN  31          HG2       GLN  31   9.036  -1.180  -2.320
  202   2HG   GLN  31          HG1       GLN  31   7.543  -1.976  -1.836
  203   1HE2  GLN  31          HE21      GLN  31   9.227   0.986  -2.135
  204   2HE2  GLN  31          HE22      GLN  31   7.938   2.028  -1.622
  205    H    GLN  32           HN       GLN  32   8.581  -4.253   0.463
  206    HA   GLN  32           HA       GLN  32   8.513  -5.686   2.221
  207   1HB   GLN  32          HB2       GLN  32  10.447  -6.469   0.503
  208   2HB   GLN  32          HB1       GLN  32  11.350  -6.392   2.012
  209   1HG   GLN  32          HG2       GLN  32  10.526  -8.360   2.590
  210   2HG   GLN  32          HG1       GLN  32   8.904  -7.668   2.569
  211   1HE2  GLN  32          HE21      GLN  32   7.823  -7.605   0.454
  212   2HE2  GLN  32          HE22      GLN  32   8.078  -8.924  -0.632
  213    H    GLY  33           HN       GLY  33   9.660  -2.874   2.617
  214   1HA   GLY  33          HA2       GLY  33   9.936  -2.967   5.396
  215   2HA   GLY  33          HA1       GLY  33  11.551  -2.945   4.703
  216    H    CYS  34           HN       CYS  34   8.874  -1.356   3.145
  217    HA   CYS  34           HA       CYS  34   9.783   1.216   4.060
  218   1HB   CYS  34          HB2       CYS  34  10.701   0.390   1.771
  219   2HB   CYS  34          HB1       CYS  34   9.100   0.845   1.219
  220    H    PHE  35           HN       PHE  35   7.308  -0.703   2.562
  221    HA   PHE  35           HA       PHE  35   5.335   1.159   2.122
  222   1HB   PHE  35          HB2       PHE  35   3.773  -0.850   2.885
  223   2HB   PHE  35          HB1       PHE  35   4.609  -0.854   1.341
  224    HD1  PHE  35           HD1      PHE  35   6.155  -2.585   0.823
  225    HD2  PHE  35           HD2      PHE  35   4.729  -2.118   4.813
  226    HE1  PHE  35           HE1      PHE  35   7.112  -4.758   1.424
  227    HE2  PHE  35           HE2      PHE  35   5.711  -4.288   5.416
  228    HZ   PHE  35           HZ       PHE  35   6.904  -5.612   3.720
  229    H    CYS  36           HN       CYS  36   5.906  -0.663   5.042
  230    HA   CYS  36           HA       CYS  36   3.855   0.275   6.633
  231   1HB   CYS  36          HB2       CYS  36   5.973  -1.397   7.025
  232   2HB   CYS  36          HB1       CYS  36   6.431  -0.030   8.035
  233    H    GLN  37           HN       GLN  37   7.026   1.726   6.056
  234    HA   GLN  37           HA       GLN  37   6.951   3.763   7.913
  235   1HB   GLN  37          HB2       GLN  37   8.154   3.770   5.150
  236   2HB   GLN  37          HB1       GLN  37   8.481   4.988   6.374
  237   1HG   GLN  37          HG2       GLN  37   9.487   3.341   7.812
  238   2HG   GLN  37          HG1       GLN  37   9.055   2.052   6.690
  239   1HE2  GLN  37          HE21      GLN  37   9.734   3.092   4.288
  240   2HE2  GLN  37          HE22      GLN  37  11.437   3.372   4.215
  241    H    TYR  38           HN       TYR  38   5.294   3.474   4.888
  242    HA   TYR  38           HA       TYR  38   4.515   6.241   4.749
  243   1HB   TYR  38          HB2       TYR  38   3.684   3.785   3.205
  244   2HB   TYR  38          HB1       TYR  38   2.984   5.375   2.913
  245    HD1  TYR  38           HD1      TYR  38   4.733   7.292   2.468
  246    HD2  TYR  38           HD2      TYR  38   5.541   3.144   1.983
  247    HE1  TYR  38           HE1      TYR  38   6.596   7.838   0.959
  248    HE2  TYR  38           HE2      TYR  38   7.407   3.678   0.473
  249    HH   TYR  38           HH       TYR  38   7.902   6.815  -0.799
  250    H    ALA  39           HN       ALA  39   3.307   3.383   6.245
  251    HA   ALA  39           HA       ALA  39   0.595   3.886   6.392
  252   1HB   ALA  39          HB1       ALA  39   2.319   2.582   8.485
  253   2HB   ALA  39          HB2       ALA  39   1.630   1.780   7.074
  254   3HB   ALA  39          HB3       ALA  39   0.570   2.422   8.328
  255    H    LYS  40           HN       LYS  40   3.168   5.571   7.900
  256    HA   LYS  40           HA       LYS  40   1.302   6.852   9.778
  257   1HB   LYS  40          HB2       LYS  40   3.518   5.722  10.543
  258   2HB   LYS  40          HB1       LYS  40   4.281   7.175   9.911
  259   1HG   LYS  40          HG2       LYS  40   3.949   7.484  12.242
  260   2HG   LYS  40          HG1       LYS  40   2.791   8.514  11.399
  261   1HD   LYS  40          HD2       LYS  40   1.813   5.816  12.021
  262   2HD   LYS  40          HD1       LYS  40   2.166   6.815  13.432
  263   1HE   LYS  40          HE2       LYS  40   0.832   8.609  11.973
  264   2HE   LYS  40          HE1       LYS  40   0.097   7.139  11.335
  265   1HZ   LYS  40          HZ1       LYS  40  -0.702   6.547  13.436
  266   2HZ   LYS  40          HZ2       LYS  40  -1.010   8.207  13.327
  267   3HZ   LYS  40          HZ3       LYS  40   0.299   7.649  14.242
  268    H    ASP  41           HN       ASP  41   2.212   7.351   6.774
  269    HA   ASP  41           HA       ASP  41   3.151  10.067   6.902
  270   1HB   ASP  41          HB2       ASP  41   3.876   8.674   5.063
  271   2HB   ASP  41          HB1       ASP  41   2.205   8.353   4.597
  272    HA   PRO  42           HA       PRO  42  -0.889  11.872   7.374
  273   1HB   PRO  42          HB2       PRO  42  -0.234  14.423   6.624
  274   2HB   PRO  42          HB1       PRO  42   0.092  13.749   8.224
  275   1HG   PRO  42          HG2       PRO  42   1.932  14.074   5.892
  276   2HG   PRO  42          HG1       PRO  42   2.248  14.329   7.617
  277   1HD   PRO  42          HD2       PRO  42   3.052  12.104   6.306
  278   2HD   PRO  42          HD1       PRO  42   2.583  12.086   8.018
  279    H    THR  43           HN       THR  43   0.849  13.225   4.555
  280    HA   THR  43           HA       THR  43  -1.373  13.803   3.013
  281    HB   THR  43           HB       THR  43   0.411  13.250   1.079
  282    HG1  THR  43           HG1      THR  43   2.056  12.410   2.165
  283   1HG2  THR  43          HG21      THR  43   1.396  15.490   1.423
  284   2HG2  THR  43          HG22      THR  43   0.550  15.585   2.967
  285   3HG2  THR  43          HG23      THR  43  -0.367  15.478   1.464
  286    H    TYR  44           HN       TYR  44   0.154  10.735   3.590
  287    HA   TYR  44           HA       TYR  44  -1.410   9.462   1.468
  288   1HB   TYR  44          HB2       TYR  44   0.905   8.586   3.166
  289   2HB   TYR  44          HB1       TYR  44  -0.077   7.400   2.317
  290    HD1  TYR  44           HD1      TYR  44   0.593  10.724   0.893
  291    HD2  TYR  44           HD2      TYR  44   1.754   6.630   0.941
  292    HE1  TYR  44           HE1      TYR  44   1.926  11.085  -1.140
  293    HE2  TYR  44           HE2      TYR  44   3.090   6.982  -1.093
  294    HH   TYR  44           HH       TYR  44   3.250   8.491  -2.955
  295    H    GLY  45           HN       GLY  45  -2.322  10.496   4.256
  296   1HA   GLY  45          HA2       GLY  45  -3.089   8.304   5.825
  297   2HA   GLY  45          HA1       GLY  45  -3.875   9.875   5.824
  298    H    GLN  46           HN       GLN  46  -4.635   9.777   3.030
  299    HA   GLN  46           HA       GLN  46  -7.095   8.379   3.322
  300   1HB   GLN  46          HB2       GLN  46  -5.976   9.570   0.785
  301   2HB   GLN  46          HB1       GLN  46  -7.664   9.255   1.162
  302   1HG   GLN  46          HG2       GLN  46  -6.208  11.065   2.987
  303   2HG   GLN  46          HG1       GLN  46  -6.547  11.665   1.365
  304   1HE2  GLN  46          HE21      GLN  46  -7.619  12.784   3.683
  305   2HE2  GLN  46          HE22      GLN  46  -9.338  12.536   3.671
  306    H    TYR  47           HN       TYR  47  -4.024   7.652   1.895
  307    HA   TYR  47           HA       TYR  47  -4.924   5.524   0.218
  308   1HB   TYR  47          HB2       TYR  47  -2.725   6.940   0.128
  309   2HB   TYR  47          HB1       TYR  47  -2.149   5.699   1.234
  310    HD1  TYR  47           HD1      TYR  47  -1.670   3.474   0.487
  311    HD2  TYR  47           HD2      TYR  47  -3.337   6.343  -2.173
  312    HE1  TYR  47           HE1      TYR  47  -1.143   2.005  -1.414
  313    HE2  TYR  47           HE2      TYR  47  -2.819   4.883  -4.081
  314    HH   TYR  47           HH       TYR  47  -0.718   2.592  -4.128
  315    H    ILE  48           HN       ILE  48  -3.338   5.706   3.372
  316    HA   ILE  48           HA       ILE  48  -3.245   2.905   3.784
  317    HB   ILE  48           HB       ILE  48  -3.147   5.079   5.874
  318   1HG1  ILE  48          HG12      ILE  48  -1.484   5.374   4.034
  319   2HG1  ILE  48          HG11      ILE  48  -0.748   5.074   5.604
  320   1HG2  ILE  48          HG21      ILE  48  -2.006   3.473   7.249
  321   2HG2  ILE  48          HG22      ILE  48  -2.015   2.287   5.944
  322   3HG2  ILE  48          HG23      ILE  48  -3.530   2.772   6.704
  323   1HD1  ILE  48          HD11      ILE  48  -1.052   3.135   3.328
  324   2HD1  ILE  48          HD12      ILE  48  -0.501   2.682   4.941
  325   3HD1  ILE  48          HD13      ILE  48   0.440   3.818   3.974
  326    H    ARG  49           HN       ARG  49  -5.563   5.420   4.670
  327    HA   ARG  49           HA       ARG  49  -7.125   3.611   6.265
  328   1HB   ARG  49          HB2       ARG  49  -7.733   6.410   5.314
  329   2HB   ARG  49          HB1       ARG  49  -8.720   5.501   6.450
  330   1HG   ARG  49          HG2       ARG  49  -5.824   6.057   6.985
  331   2HG   ARG  49          HG1       ARG  49  -7.088   7.220   7.393
  332   1HD   ARG  49          HD2       ARG  49  -8.206   5.192   8.571
  333   2HD   ARG  49          HD1       ARG  49  -6.590   4.489   8.511
  334    HE   ARG  49           HE       ARG  49  -5.925   5.952  10.144
  335   1HH1  ARG  49          HH11      ARG  49  -8.985   7.014   8.845
  336   2HH1  ARG  49          HH12      ARG  49  -9.217   8.233  10.053
  337   1HH2  ARG  49          HH21      ARG  49  -6.228   7.555  11.733
  338   2HH2  ARG  49          HH22      ARG  49  -7.652   8.541  11.692
  339    H    SER  50           HN       SER  50  -6.689   3.026   3.406
  340    HA   SER  50           HA       SER  50  -9.274   3.265   2.173
  341   1HB   SER  50          HB2       SER  50  -6.864   3.134   1.086
  342   2HB   SER  50          HB1       SER  50  -7.233   1.412   1.126
  343    HG   SER  50           HG       SER  50  -8.726   3.456  -0.136
  344    HA   PRO  51           HA       PRO  51 -10.823  -0.591   3.670
  345   1HB   PRO  51          HB2       PRO  51 -12.666  -1.090   1.660
  346   2HB   PRO  51          HB1       PRO  51 -12.932  -0.044   3.053
  347   1HG   PRO  51          HG2       PRO  51 -12.644   0.688   0.276
  348   2HG   PRO  51          HG1       PRO  51 -13.054   1.716   1.655
  349   1HD   PRO  51          HD2       PRO  51 -10.523   1.431   0.260
  350   2HD   PRO  51          HD1       PRO  51 -11.006   2.642   1.462
  351    H    HIS  52           HN       HIS  52 -10.174  -0.499   0.200
  352    HA   HIS  52           HA       HIS  52  -9.834  -3.346   0.003
  353   1HB   HIS  52          HB2       HIS  52  -8.890  -1.572  -2.184
  354   2HB   HIS  52          HB1       HIS  52  -9.854  -3.043  -2.264
  355    HD1  HIS  52           HD1      HIS  52 -10.450  -0.155  -3.628
  356    HD2  HIS  52           HD2      HIS  52 -12.318  -1.816  -0.312
  357    HE1  HIS  52           HE1      HIS  52 -12.680   0.998  -3.454
  358    HE2  HIS  52           HE2      HIS  52 -13.759   0.025  -1.406
  359    H    ALA  53           HN       ALA  53  -7.801  -0.706   0.772
  360    HA   ALA  53           HA       ALA  53  -5.356  -1.516  -0.233
  361   1HB   ALA  53          HB1       ALA  53  -5.453   0.642   0.667
  362   2HB   ALA  53          HB2       ALA  53  -4.405  -0.258   1.762
  363   3HB   ALA  53          HB3       ALA  53  -6.082   0.057   2.207
  364    H    ARG  54           HN       ARG  54  -6.723  -2.160   2.942
  365    HA   ARG  54           HA       ARG  54  -4.690  -3.776   3.905
  366   1HB   ARG  54          HB2       ARG  54  -7.120  -2.843   4.857
  367   2HB   ARG  54          HB1       ARG  54  -7.312  -4.590   4.861
  368   1HG   ARG  54          HG2       ARG  54  -5.550  -4.900   6.360
  369   2HG   ARG  54          HG1       ARG  54  -4.906  -3.282   6.073
  370   1HD   ARG  54          HD2       ARG  54  -6.118  -3.625   8.263
  371   2HD   ARG  54          HD1       ARG  54  -6.657  -2.263   7.282
  372    HE   ARG  54           HE       ARG  54  -8.352  -4.178   6.511
  373   1HH1  ARG  54          HH11      ARG  54  -7.338  -3.165   9.696
  374   2HH1  ARG  54          HH12      ARG  54  -8.831  -3.614  10.448
  375   1HH2  ARG  54          HH21      ARG  54 -10.313  -4.770   7.502
  376   2HH2  ARG  54          HH22      ARG  54 -10.519  -4.525   9.204
  377    H    ASP  55           HN       ASP  55  -7.411  -4.521   1.880
  378    HA   ASP  55           HA       ASP  55  -7.218  -7.334   2.064
  379   1HB   ASP  55          HB2       ASP  55  -9.169  -5.845   1.191
  380   2HB   ASP  55          HB1       ASP  55  -8.310  -5.991  -0.338
  381    H    THR  56           HN       THR  56  -5.945  -4.964  -0.158
  382    HA   THR  56           HA       THR  56  -4.825  -6.690  -2.022
  383    HB   THR  56           HB       THR  56  -3.514  -4.127  -1.341
  384    HG1  THR  56           HG1      THR  56  -5.158  -2.994  -2.322
  385   1HG2  THR  56          HG21      THR  56  -3.809  -3.924  -3.912
  386   2HG2  THR  56          HG22      THR  56  -4.019  -5.673  -3.823
  387   3HG2  THR  56          HG23      THR  56  -2.528  -4.932  -3.241
  388    H    LEU  57           HN       LEU  57  -3.380  -5.171   0.835
  389    HA   LEU  57           HA       LEU  57  -0.849  -6.284   0.561
  390   1HB   LEU  57          HB2       LEU  57  -2.337  -4.878   2.611
  391   2HB   LEU  57          HB1       LEU  57  -1.145  -5.988   3.265
  392    HG   LEU  57           HG       LEU  57   0.096  -4.512   1.190
  393   1HD1  LEU  57          HD11      LEU  57  -0.160  -2.245   1.861
  394   2HD1  LEU  57          HD12      LEU  57  -1.176  -2.704   3.227
  395   3HD1  LEU  57          HD13      LEU  57  -1.774  -2.898   1.579
  396   1HD2  LEU  57          HD21      LEU  57   1.746  -4.353   2.710
  397   2HD2  LEU  57          HD22      LEU  57   0.759  -5.501   3.613
  398   3HD2  LEU  57          HD23      LEU  57   0.662  -3.779   3.977
  399    H    THR  58           HN       THR  58  -3.621  -7.361   2.427
  400    HA   THR  58           HA       THR  58  -2.446  -9.640   3.529
  401    HB   THR  58           HB       THR  58  -5.356  -9.151   2.869
  402    HG1  THR  58           HG1      THR  58  -4.911  -7.632   4.302
  403   1HG2  THR  58          HG21      THR  58  -4.007 -11.338   4.297
  404   2HG2  THR  58          HG22      THR  58  -5.565 -11.302   3.472
  405   3HG2  THR  58          HG23      THR  58  -5.414 -10.639   5.099
  406    H    SER  59           HN       SER  59  -4.274  -9.168   0.536
  407    HA   SER  59           HA       SER  59  -4.491 -11.764  -0.333
  408   1HB   SER  59          HB2       SER  59  -5.273  -9.506  -1.377
  409   2HB   SER  59          HB1       SER  59  -3.745  -9.623  -2.236
  410    HG   SER  59           HG       SER  59  -4.413 -11.632  -3.054
  411    H    CYS  60           HN       CYS  60  -1.782  -9.634  -0.257
  412    HA   CYS  60           HA       CYS  60  -0.062 -11.257  -1.873
  413   1HB   CYS  60          HB2       CYS  60  -0.075  -8.637  -1.151
  414   2HB   CYS  60          HB1       CYS  60   1.104  -9.280  -0.021
  415    H    GLY  61           HN       GLY  61  -0.748 -10.807   1.545
  416   1HA   GLY  61          HA2       GLY  61  -0.222 -12.131   3.349
  417   2HA   GLY  61          HA1       GLY  61   0.389 -13.329   2.218
  418    H    LEU  62           HN       LEU  62   1.332 -10.034   3.229
  419    HA   LEU  62           HA       LEU  62   4.053 -11.084   3.632
  420   1HB   LEU  62          HB2       LEU  62   4.462  -8.407   3.307
  421   2HB   LEU  62          HB1       LEU  62   4.693  -9.624   2.072
  422    HG   LEU  62           HG       LEU  62   1.983  -8.915   1.875
  423   1HD1  LEU  62          HD11      LEU  62   1.939  -6.916   2.937
  424   2HD1  LEU  62          HD12      LEU  62   2.560  -6.367   1.381
  425   3HD1  LEU  62          HD13      LEU  62   3.668  -6.637   2.726
  426   1HD2  LEU  62          HD21      LEU  62   4.413  -8.135   0.282
  427   2HD2  LEU  62          HD22      LEU  62   2.754  -7.857  -0.245
  428   3HD2  LEU  62          HD23      LEU  62   3.337  -9.503  -0.001
  429    H    ALA  63           HN       ALA  63   2.649  -7.941   4.457
  430    HA   ALA  63           HA       ALA  63   2.636  -8.602   7.264
  431   1HB   ALA  63          HB1       ALA  63   4.965  -7.923   6.825
  432   2HB   ALA  63          HB2       ALA  63   4.137  -6.833   7.937
  433   3HB   ALA  63          HB3       ALA  63   4.376  -6.361   6.255
  434    H    VAL  64           HN       VAL  64   1.877  -6.689   8.591
  435    HA   VAL  64           HA       VAL  64  -0.155  -5.236   7.083
  436    HB   VAL  64           HB       VAL  64  -0.941  -6.853   8.827
  437   1HG1  VAL  64          HG11      VAL  64  -0.435  -6.680  11.030
  438   2HG1  VAL  64          HG12      VAL  64  -0.256  -4.926  10.967
  439   3HG1  VAL  64          HG13      VAL  64   1.039  -5.966  10.374
  440   1HG2  VAL  64          HG21      VAL  64  -2.436  -5.131   8.122
  441   2HG2  VAL  64          HG22      VAL  64  -1.628  -3.936   9.138
  442   3HG2  VAL  64          HG23      VAL  64  -2.547  -5.247   9.878
  443    HA   PRO  65           HA       PRO  65   1.995  -1.459   8.015
  444   1HB   PRO  65          HB2       PRO  65  -0.126   0.271   7.866
  445   2HB   PRO  65          HB1       PRO  65   0.715  -0.377   6.454
  446   1HG   PRO  65          HG2       PRO  65  -1.834  -1.292   7.727
  447   2HG   PRO  65          HG1       PRO  65  -1.454  -1.085   6.007
  448   1HD   PRO  65          HD2       PRO  65  -1.438  -3.507   7.150
  449   2HD   PRO  65          HD1       PRO  65  -0.252  -3.068   5.903
  450    H    HIS  66           HN       HIS  66   0.999   0.719   9.334
  451    HA   HIS  66           HA       HIS  66   0.786   1.582  11.427
  452   1HB   HIS  66          HB2       HIS  66  -1.132  -0.743  11.613
  453   2HB   HIS  66          HB1       HIS  66  -0.960   0.464  12.884
  454    HD1  HIS  66           HD1      HIS  66  -2.226   0.018   9.389
  455    HD2  HIS  66           HD2      HIS  66  -2.154   2.924  12.353
  456    HE1  HIS  66           HE1      HIS  66  -3.806   1.809   8.619
  457    HE2  HIS  66           HE2      HIS  66  -3.673   3.602  10.378
  458    H    CYS  67           HN       CYS  67   2.970  -0.203  10.970
  459    HA   CYS  67           HA       CYS  67   3.236  -1.832  13.350
  460   1HB   CYS  67          HB2       CYS  67   5.476  -2.371  12.433
  461   2HB   CYS  67          HB1       CYS  67   4.181  -2.674  11.279
  Start of MODEL    8
    1   1H    ALA   1          HT1       ALA   1  10.932   5.097   2.363
    2   2H    ALA   1          HT2       ALA   1  10.277   5.939   1.019
    3   3H    ALA   1          HT3       ALA   1  10.640   6.783   2.469
    4    HA   ALA   1           HA       ALA   1  12.246   7.135   0.702
    5   1HB   ALA   1          HB1       ALA   1  13.216   5.745   3.195
    6   2HB   ALA   1          HB2       ALA   1  12.880   7.466   3.009
    7   3HB   ALA   1          HB3       ALA   1  14.217   6.728   2.128
    8    H    CYS   2           HN       CYS   2  11.773   5.675  -1.066
    9    HA   CYS   2           HA       CYS   2  13.861   3.717  -1.394
   10   1HB   CYS   2          HB2       CYS   2  11.980   2.039  -2.218
   11   2HB   CYS   2          HB1       CYS   2  12.501   2.075  -0.538
   12    H    GLN   3           HN       GLN   3  10.705   4.562  -2.840
   13    HA   GLN   3           HA       GLN   3  11.960   5.672  -5.168
   14   1HB   GLN   3          HB2       GLN   3  11.897   3.060  -5.371
   15   2HB   GLN   3          HB1       GLN   3  10.199   3.322  -5.740
   16   1HG   GLN   3          HG2       GLN   3  10.998   3.403  -7.846
   17   2HG   GLN   3          HG1       GLN   3  11.258   5.094  -7.422
   18   1HE2  GLN   3          HE21      GLN   3  13.408   5.633  -6.551
   19   2HE2  GLN   3          HE22      GLN   3  14.782   4.804  -7.192
   20    H    ALA   4           HN       ALA   4   8.981   4.386  -3.742
   21    HA   ALA   4           HA       ALA   4   6.897   5.285  -3.540
   22   1HB   ALA   4          HB1       ALA   4   7.540   7.843  -4.866
   23   2HB   ALA   4          HB2       ALA   4   8.457   7.467  -3.407
   24   3HB   ALA   4          HB3       ALA   4   6.696   7.527  -3.349
   25    H    SER   5           HN       SER   5   8.013   4.024  -6.053
   26    HA   SER   5           HA       SER   5   5.906   4.962  -7.888
   27   1HB   SER   5          HB2       SER   5   8.558   5.141  -8.414
   28   2HB   SER   5          HB1       SER   5   8.217   3.538  -9.064
   29    HG   SER   5           HG       SER   5   7.909   5.538 -10.445
   30    H    GLN   6           HN       GLN   6   7.290   2.299  -6.210
   31    HA   GLN   6           HA       GLN   6   6.234   0.248  -7.849
   32   1HB   GLN   6          HB2       GLN   6   7.268   0.204  -5.016
   33   2HB   GLN   6          HB1       GLN   6   6.819  -1.232  -5.927
   34   1HG   GLN   6          HG2       GLN   6   8.749   0.572  -7.231
   35   2HG   GLN   6          HG1       GLN   6   9.317  -0.269  -5.790
   36   1HE2  GLN   6          HE21      GLN   6   8.517  -0.526  -9.100
   37   2HE2  GLN   6          HE22      GLN   6   8.873  -2.205  -9.293
   38    H    LEU   7           HN       LEU   7   4.755   2.407  -5.792
   39    HA   LEU   7           HA       LEU   7   2.561   0.527  -5.225
   40   1HB   LEU   7          HB2       LEU   7   2.871   3.095  -3.738
   41   2HB   LEU   7          HB1       LEU   7   2.121   1.596  -3.224
   42    HG   LEU   7           HG       LEU   7   5.100   1.886  -3.599
   43   1HD1  LEU   7          HD11      LEU   7   3.835   3.366  -1.799
   44   2HD1  LEU   7          HD12      LEU   7   5.381   2.590  -1.454
   45   3HD1  LEU   7          HD13      LEU   7   3.880   1.854  -0.894
   46   1HD2  LEU   7          HD21      LEU   7   4.791  -0.048  -1.794
   47   2HD2  LEU   7          HD22      LEU   7   4.779  -0.363  -3.529
   48   3HD2  LEU   7          HD23      LEU   7   3.258  -0.233  -2.645
   49    H    ALA   8           HN       ALA   8   3.455   3.444  -6.820
   50    HA   ALA   8           HA       ALA   8   1.150   4.907  -6.930
   51   1HB   ALA   8          HB1       ALA   8   3.476   5.265  -8.053
   52   2HB   ALA   8          HB2       ALA   8   2.032   6.000  -8.749
   53   3HB   ALA   8          HB3       ALA   8   2.691   4.520  -9.446
   54    H    VAL   9           HN       VAL   9   2.035   2.248  -9.055
   55    HA   VAL   9           HA       VAL   9  -0.221   2.219 -10.658
   56    HB   VAL   9           HB       VAL   9   1.798   0.927 -11.175
   57   1HG1  VAL   9          HG11      VAL   9   0.920  -0.748  -8.834
   58   2HG1  VAL   9          HG12      VAL   9   2.454   0.095  -9.053
   59   3HG1  VAL   9          HG13      VAL   9   2.069  -1.308 -10.050
   60   1HG2  VAL   9          HG21      VAL   9   0.725  -0.816 -12.271
   61   2HG2  VAL   9          HG22      VAL   9  -0.577   0.345 -12.014
   62   3HG2  VAL   9          HG23      VAL   9  -0.430  -1.062 -10.961
   63    H    CYS  10           HN       CYS  10   0.182   1.207  -7.401
   64    HA   CYS  10           HA       CYS  10  -2.128  -0.522  -7.335
   65   1HB   CYS  10          HB2       CYS  10   0.024  -0.547  -5.835
   66   2HB   CYS  10          HB1       CYS  10  -0.859   0.644  -4.885
   67    H    ALA  11           HN       ALA  11  -1.335   2.784  -6.579
   68    HA   ALA  11           HA       ALA  11  -3.362   3.641  -4.989
   69   1HB   ALA  11          HB1       ALA  11  -2.828   5.421  -7.272
   70   2HB   ALA  11          HB2       ALA  11  -1.416   4.893  -6.357
   71   3HB   ALA  11          HB3       ALA  11  -2.733   5.736  -5.540
   72    H    SER  12           HN       SER  12  -3.582   2.690  -8.306
   73    HA   SER  12           HA       SER  12  -5.966   3.849  -9.081
   74   1HB   SER  12          HB2       SER  12  -4.428   1.454  -9.896
   75   2HB   SER  12          HB1       SER  12  -6.127   1.478 -10.367
   76    HG   SER  12           HG       SER  12  -4.062   3.259 -11.071
   77    H    ALA  13           HN       ALA  13  -5.428   0.791  -7.374
   78    HA   ALA  13           HA       ALA  13  -8.227   0.226  -7.156
   79   1HB   ALA  13          HB1       ALA  13  -7.165  -1.767  -7.147
   80   2HB   ALA  13          HB2       ALA  13  -7.128  -1.486  -5.406
   81   3HB   ALA  13          HB3       ALA  13  -5.713  -1.111  -6.390
   82    H    ILE  14           HN       ILE  14  -5.812   1.814  -5.217
   83    HA   ILE  14           HA       ILE  14  -7.201   1.689  -2.737
   84    HB   ILE  14           HB       ILE  14  -4.932   3.361  -3.772
   85   1HG1  ILE  14          HG12      ILE  14  -4.030   2.258  -1.514
   86   2HG1  ILE  14          HG11      ILE  14  -5.313   1.101  -1.867
   87   1HG2  ILE  14          HG21      ILE  14  -6.158   4.924  -2.423
   88   2HG2  ILE  14          HG22      ILE  14  -4.743   4.387  -1.520
   89   3HG2  ILE  14          HG23      ILE  14  -6.334   3.736  -1.131
   90   1HD1  ILE  14          HD11      ILE  14  -3.335   1.846  -3.978
   91   2HD1  ILE  14          HD12      ILE  14  -4.296   0.377  -3.811
   92   3HD1  ILE  14          HD13      ILE  14  -2.925   0.660  -2.739
   93    H    LEU  15           HN       LEU  15  -6.637   4.481  -4.889
   94    HA   LEU  15           HA       LEU  15  -8.647   6.063  -3.656
   95   1HB   LEU  15          HB2       LEU  15  -7.227   6.366  -6.300
   96   2HB   LEU  15          HB1       LEU  15  -8.295   7.575  -5.612
   97    HG   LEU  15           HG       LEU  15  -6.059   6.675  -3.891
   98   1HD1  LEU  15          HD11      LEU  15  -4.516   8.267  -5.033
   99   2HD1  LEU  15          HD12      LEU  15  -5.654   8.323  -6.379
  100   3HD1  LEU  15          HD13      LEU  15  -4.864   6.804  -5.954
  101   1HD2  LEU  15          HD21      LEU  15  -6.349   8.686  -2.910
  102   2HD2  LEU  15          HD22      LEU  15  -7.930   8.595  -3.687
  103   3HD2  LEU  15          HD23      LEU  15  -6.628   9.515  -4.441
  104    H    SER  16           HN       SER  16  -8.578   5.179  -7.100
  105    HA   SER  16           HA       SER  16 -11.271   5.562  -7.584
  106   1HB   SER  16          HB2       SER  16  -9.043   4.254  -8.959
  107   2HB   SER  16          HB1       SER  16 -10.608   3.538  -9.345
  108    HG   SER  16           HG       SER  16 -11.111   5.265 -10.430
  109    H    GLY  17           HN       GLY  17  -9.734   2.353  -7.247
  110   1HA   GLY  17          HA2       GLY  17 -10.541   0.595  -5.885
  111   2HA   GLY  17          HA1       GLY  17 -12.073   1.442  -5.741
  112    H    ALA  18           HN       ALA  18 -10.418   0.880  -8.780
  113    HA   ALA  18           HA       ALA  18 -12.703  -0.216 -10.004
  114   1HB   ALA  18          HB1       ALA  18 -11.306   0.790 -11.525
  115   2HB   ALA  18          HB2       ALA  18 -10.907  -0.911 -11.772
  116   3HB   ALA  18          HB3       ALA  18  -9.853   0.110 -10.793
  117    H    LYS  19           HN       LYS  19  -9.655  -1.709  -9.074
  118    HA   LYS  19           HA       LYS  19 -10.727  -4.048  -8.017
  119   1HB   LYS  19          HB2       LYS  19  -9.900  -5.581  -9.969
  120   2HB   LYS  19          HB1       LYS  19 -11.507  -4.873 -10.031
  121   1HG   LYS  19          HG2       LYS  19 -10.279  -4.761 -12.176
  122   2HG   LYS  19          HG1       LYS  19 -10.772  -3.182 -11.561
  123   1HD   LYS  19          HD2       LYS  19  -8.572  -2.667 -10.854
  124   2HD   LYS  19          HD1       LYS  19  -8.036  -4.335 -11.070
  125   1HE   LYS  19          HE2       LYS  19  -7.216  -2.933 -12.878
  126   2HE   LYS  19          HE1       LYS  19  -8.367  -4.122 -13.488
  127   1HZ   LYS  19          HZ1       LYS  19  -9.128  -1.338 -12.808
  128   2HZ   LYS  19          HZ2       LYS  19 -10.033  -2.477 -13.670
  129   3HZ   LYS  19          HZ3       LYS  19  -8.641  -1.808 -14.359
  130    HA   PRO  20           HA       PRO  20  -6.525  -4.513  -6.777
  131   1HB   PRO  20          HB2       PRO  20  -6.300  -7.199  -6.439
  132   2HB   PRO  20          HB1       PRO  20  -7.206  -6.163  -5.330
  133   1HG   PRO  20          HG2       PRO  20  -8.212  -7.887  -7.561
  134   2HG   PRO  20          HG1       PRO  20  -8.871  -7.672  -5.929
  135   1HD   PRO  20          HD2       PRO  20  -9.909  -6.419  -8.090
  136   2HD   PRO  20          HD1       PRO  20  -9.910  -5.686  -6.473
  137    H    SER  21           HN       SER  21  -4.517  -6.006  -7.238
  138    HA   SER  21           HA       SER  21  -4.347  -7.130  -9.852
  139   1HB   SER  21          HB2       SER  21  -2.449  -4.874  -9.635
  140   2HB   SER  21          HB1       SER  21  -3.314  -5.490 -11.043
  141    HG   SER  21           HG       SER  21  -4.032  -3.402 -10.396
  142    H    GLY  22           HN       GLY  22  -2.808  -8.647  -9.862
  143   1HA   GLY  22          HA2       GLY  22  -1.353  -9.316  -7.579
  144   2HA   GLY  22          HA1       GLY  22  -1.017  -9.918  -9.196
  145    H    GLU  23           HN       GLU  23  -0.526  -7.176 -10.214
  146    HA   GLU  23           HA       GLU  23   2.221  -7.076 -10.003
  147   1HB   GLU  23          HB2       GLU  23   0.521  -5.906 -11.617
  148   2HB   GLU  23          HB1       GLU  23   0.620  -4.585 -10.452
  149   1HG   GLU  23          HG2       GLU  23   3.233  -5.152 -10.841
  150   2HG   GLU  23          HG1       GLU  23   2.555  -5.520 -12.423
  151    H    CYS  24           HN       CYS  24  -0.219  -5.187  -8.241
  152    HA   CYS  24           HA       CYS  24   1.461  -3.553  -6.786
  153   1HB   CYS  24          HB2       CYS  24  -0.956  -3.231  -6.825
  154   2HB   CYS  24          HB1       CYS  24  -1.188  -4.736  -5.940
  155    H    CYS  25           HN       CYS  25   0.677  -6.892  -6.331
  156    HA   CYS  25           HA       CYS  25   1.739  -7.085  -3.673
  157   1HB   CYS  25          HB2       CYS  25   0.035  -8.651  -4.315
  158   2HB   CYS  25          HB1       CYS  25   0.957  -9.164  -5.722
  159    H    GLY  26           HN       GLY  26   2.924  -7.644  -6.936
  160   1HA   GLY  26          HA2       GLY  26   5.419  -8.785  -6.046
  161   2HA   GLY  26          HA1       GLY  26   4.995  -8.358  -7.696
  162    H    ASN  27           HN       ASN  27   4.277  -5.606  -6.993
  163    HA   ASN  27           HA       ASN  27   6.784  -4.420  -7.355
  164   1HB   ASN  27          HB2       ASN  27   4.117  -3.216  -6.643
  165   2HB   ASN  27          HB1       ASN  27   5.545  -2.263  -7.037
  166   1HD2  ASN  27          HD21      ASN  27   6.610  -2.975  -9.152
  167   2HD2  ASN  27          HD22      ASN  27   5.537  -3.227 -10.482
  168    H    LEU  28           HN       LEU  28   4.551  -4.073  -4.649
  169    HA   LEU  28           HA       LEU  28   6.198  -2.707  -2.934
  170   1HB   LEU  28          HB2       LEU  28   4.815  -3.431  -1.126
  171   2HB   LEU  28          HB1       LEU  28   3.797  -3.177  -2.532
  172    HG   LEU  28           HG       LEU  28   4.206  -5.764  -2.863
  173   1HD1  LEU  28          HD11      LEU  28   5.575  -5.413  -0.518
  174   2HD1  LEU  28          HD12      LEU  28   4.933  -6.946  -1.109
  175   3HD1  LEU  28          HD13      LEU  28   4.002  -5.983   0.039
  176   1HD2  LEU  28          HD21      LEU  28   2.076  -6.144  -1.955
  177   2HD2  LEU  28          HD22      LEU  28   2.064  -4.448  -2.439
  178   3HD2  LEU  28          HD23      LEU  28   2.275  -4.880  -0.742
  179    H    ARG  29           HN       ARG  29   6.278  -6.037  -3.830
  180    HA   ARG  29           HA       ARG  29   7.681  -7.177  -1.765
  181   1HB   ARG  29          HB2       ARG  29   6.943  -7.909  -4.373
  182   2HB   ARG  29          HB1       ARG  29   8.679  -8.167  -4.273
  183   1HG   ARG  29          HG2       ARG  29   8.398 -10.012  -3.085
  184   2HG   ARG  29          HG1       ARG  29   7.394  -9.160  -1.913
  185   1HD   ARG  29          HD2       ARG  29   5.753  -9.445  -4.125
  186   2HD   ARG  29          HD1       ARG  29   6.629 -10.973  -4.039
  187    HE   ARG  29           HE       ARG  29   5.507 -10.063  -1.537
  188   1HH1  ARG  29          HH11      ARG  29   4.995 -11.969  -4.419
  189   2HH1  ARG  29          HH12      ARG  29   3.787 -12.973  -3.691
  190   1HH2  ARG  29          HH21      ARG  29   3.920 -11.385  -0.580
  191   2HH2  ARG  29          HH22      ARG  29   3.175 -12.641  -1.512
  192    H    ALA  30           HN       ALA  30   8.892  -5.394  -4.530
  193    HA   ALA  30           HA       ALA  30  11.612  -5.711  -4.094
  194   1HB   ALA  30          HB1       ALA  30  11.954  -3.842  -5.502
  195   2HB   ALA  30          HB2       ALA  30  10.377  -3.162  -5.101
  196   3HB   ALA  30          HB3       ALA  30  10.484  -4.623  -6.083
  197    H    GLN  31           HN       GLN  31   9.250  -3.910  -2.379
  198    HA   GLN  31           HA       GLN  31  11.112  -2.172  -1.023
  199   1HB   GLN  31          HB2       GLN  31   8.283  -2.677  -0.145
  200   2HB   GLN  31          HB1       GLN  31   9.250  -1.221   0.044
  201   1HG   GLN  31          HG2       GLN  31   8.732  -2.033  -2.733
  202   2HG   GLN  31          HG1       GLN  31   7.319  -1.536  -1.803
  203   1HE2  GLN  31          HE21      GLN  31   7.022   0.563  -1.327
  204   2HE2  GLN  31          HE22      GLN  31   8.086   1.836  -1.832
  205    H    GLN  32           HN       GLN  32   8.743  -4.455   0.326
  206    HA   GLN  32           HA       GLN  32   8.787  -5.731   2.203
  207   1HB   GLN  32          HB2       GLN  32  10.578  -6.667   0.438
  208   2HB   GLN  32          HB1       GLN  32  11.622  -6.417   1.834
  209   1HG   GLN  32          HG2       GLN  32  10.891  -8.302   2.729
  210   2HG   GLN  32          HG1       GLN  32   9.247  -7.664   2.728
  211   1HE2  GLN  32          HE21      GLN  32   8.020  -7.915   0.725
  212   2HE2  GLN  32          HE22      GLN  32   8.262  -9.341  -0.218
  213    H    GLY  33           HN       GLY  33   9.901  -2.894   2.348
  214   1HA   GLY  33          HA2       GLY  33  10.384  -2.831   5.107
  215   2HA   GLY  33          HA1       GLY  33  11.936  -2.789   4.284
  216    H    CYS  34           HN       CYS  34   9.099  -1.366   2.854
  217    HA   CYS  34           HA       CYS  34   9.978   1.272   3.598
  218   1HB   CYS  34          HB2       CYS  34  10.771   0.380   1.291
  219   2HB   CYS  34          HB1       CYS  34   9.124   0.756   0.827
  220    H    PHE  35           HN       PHE  35   7.466  -0.782   2.363
  221    HA   PHE  35           HA       PHE  35   5.421   1.030   1.998
  222   1HB   PHE  35          HB2       PHE  35   3.943  -0.975   2.863
  223   2HB   PHE  35          HB1       PHE  35   4.735  -1.034   1.297
  224    HD1  PHE  35           HD1      PHE  35   6.376  -2.707   0.831
  225    HD2  PHE  35           HD2      PHE  35   4.883  -2.200   4.789
  226    HE1  PHE  35           HE1      PHE  35   7.380  -4.842   1.486
  227    HE2  PHE  35           HE2      PHE  35   5.911  -4.333   5.449
  228    HZ   PHE  35           HZ       PHE  35   7.162  -5.658   3.796
  229    H    CYS  36           HN       CYS  36   6.176  -0.750   4.906
  230    HA   CYS  36           HA       CYS  36   4.222   0.202   6.600
  231   1HB   CYS  36          HB2       CYS  36   6.186  -1.530   6.959
  232   2HB   CYS  36          HB1       CYS  36   6.981  -0.140   7.690
  233    H    GLN  37           HN       GLN  37   7.293   1.705   5.738
  234    HA   GLN  37           HA       GLN  37   7.331   3.760   7.587
  235   1HB   GLN  37          HB2       GLN  37   8.314   3.783   4.737
  236   2HB   GLN  37          HB1       GLN  37   8.735   4.983   5.949
  237   1HG   GLN  37          HG2       GLN  37   9.839   3.293   7.284
  238   2HG   GLN  37          HG1       GLN  37   9.358   2.045   6.135
  239   1HE2  GLN  37          HE21      GLN  37   9.871   3.172   3.743
  240   2HE2  GLN  37          HE22      GLN  37  11.559   3.498   3.574
  241    H    TYR  38           HN       TYR  38   5.422   3.376   4.732
  242    HA   TYR  38           HA       TYR  38   4.617   6.124   4.544
  243   1HB   TYR  38          HB2       TYR  38   3.642   3.586   3.243
  244   2HB   TYR  38          HB1       TYR  38   2.856   5.138   2.972
  245    HD1  TYR  38           HD1      TYR  38   4.690   7.085   2.421
  246    HD2  TYR  38           HD2      TYR  38   5.120   2.932   1.610
  247    HE1  TYR  38           HE1      TYR  38   6.321   7.605   0.656
  248    HE2  TYR  38           HE2      TYR  38   6.754   3.439  -0.156
  249    HH   TYR  38           HH       TYR  38   7.164   6.462  -1.468
  250    H    ALA  39           HN       ALA  39   3.480   3.285   6.202
  251    HA   ALA  39           HA       ALA  39   0.841   3.886   6.677
  252   1HB   ALA  39          HB1       ALA  39   2.714   2.643   8.677
  253   2HB   ALA  39          HB2       ALA  39   1.988   1.783   7.319
  254   3HB   ALA  39          HB3       ALA  39   0.964   2.447   8.592
  255    H    LYS  40           HN       LYS  40   3.656   5.422   7.936
  256    HA   LYS  40           HA       LYS  40   2.060   6.888   9.911
  257   1HB   LYS  40          HB2       LYS  40   4.324   5.695  10.434
  258   2HB   LYS  40          HB1       LYS  40   5.037   7.115   9.682
  259   1HG   LYS  40          HG2       LYS  40   4.949   8.068  11.684
  260   2HG   LYS  40          HG1       LYS  40   3.203   8.174  11.453
  261   1HD   LYS  40          HD2       LYS  40   4.324   5.619  12.481
  262   2HD   LYS  40          HD1       LYS  40   4.270   7.000  13.579
  263   1HE   LYS  40          HE2       LYS  40   1.971   7.085  13.576
  264   2HE   LYS  40          HE1       LYS  40   1.839   6.312  11.996
  265   1HZ   LYS  40          HZ1       LYS  40   2.408   4.212  12.971
  266   2HZ   LYS  40          HZ2       LYS  40   1.122   4.878  13.845
  267   3HZ   LYS  40          HZ3       LYS  40   2.689   4.925  14.480
  268    H    ASP  41           HN       ASP  41   3.733   7.219   6.922
  269    HA   ASP  41           HA       ASP  41   4.296   9.947   6.883
  270   1HB   ASP  41          HB2       ASP  41   5.077   8.348   5.171
  271   2HB   ASP  41          HB1       ASP  41   3.425   8.211   4.561
  272    HA   PRO  42           HA       PRO  42  -0.021  11.303   6.854
  273   1HB   PRO  42          HB2       PRO  42   0.372  13.739   7.842
  274   2HB   PRO  42          HB1       PRO  42   0.565  12.313   8.874
  275   1HG   PRO  42          HG2       PRO  42   2.663  13.950   7.497
  276   2HG   PRO  42          HG1       PRO  42   2.644  13.335   9.161
  277   1HD   PRO  42          HD2       PRO  42   3.972  12.121   7.078
  278   2HD   PRO  42          HD1       PRO  42   3.400  11.268   8.525
  279    H    THR  43           HN       THR  43  -0.345  11.391   4.623
  280    HA   THR  43           HA       THR  43  -0.248  14.002   3.467
  281    HB   THR  43           HB       THR  43   0.922  12.477   1.418
  282    HG1  THR  43           HG1      THR  43   2.478  12.277   3.772
  283   1HG2  THR  43          HG21      THR  43   2.670  14.038   1.449
  284   2HG2  THR  43          HG22      THR  43   2.428  14.396   3.159
  285   3HG2  THR  43          HG23      THR  43   1.235  14.920   1.971
  286    H    TYR  44           HN       TYR  44  -0.726  10.545   2.857
  287    HA   TYR  44           HA       TYR  44  -2.807  11.123   0.907
  288   1HB   TYR  44          HB2       TYR  44  -1.721   8.481   1.903
  289   2HB   TYR  44          HB1       TYR  44  -2.875   8.678   0.588
  290    HD1  TYR  44           HD1      TYR  44   0.619   8.908   1.579
  291    HD2  TYR  44           HD2      TYR  44  -2.160   9.674  -1.550
  292    HE1  TYR  44           HE1      TYR  44   2.481   9.138  -0.010
  293    HE2  TYR  44           HE2      TYR  44  -0.306   9.905  -3.148
  294    HH   TYR  44           HH       TYR  44   2.921   9.021  -2.362
  295    H    GLY  45           HN       GLY  45  -2.591   9.021   3.790
  296   1HA   GLY  45          HA2       GLY  45  -4.093   8.758   5.530
  297   2HA   GLY  45          HA1       GLY  45  -5.044  10.073   4.858
  298    H    GLN  46           HN       GLN  46  -5.957   9.321   2.536
  299    HA   GLN  46           HA       GLN  46  -7.863   7.317   3.141
  300   1HB   GLN  46          HB2       GLN  46  -7.727   9.398   1.362
  301   2HB   GLN  46          HB1       GLN  46  -7.553   8.004   0.305
  302   1HG   GLN  46          HG2       GLN  46  -9.643   7.139   0.919
  303   2HG   GLN  46          HG1       GLN  46  -9.758   8.193   2.327
  304   1HE2  GLN  46          HE21      GLN  46 -11.881   8.152   0.765
  305   2HE2  GLN  46          HE22      GLN  46 -11.998   9.591  -0.201
  306    H    TYR  47           HN       TYR  47  -4.697   7.142   1.962
  307    HA   TYR  47           HA       TYR  47  -5.027   4.794   0.345
  308   1HB   TYR  47          HB2       TYR  47  -3.187   6.644   0.232
  309   2HB   TYR  47          HB1       TYR  47  -2.419   5.644   1.458
  310    HD1  TYR  47           HD1      TYR  47  -2.720   6.212  -1.981
  311    HD2  TYR  47           HD2      TYR  47  -2.229   3.086   0.861
  312    HE1  TYR  47           HE1      TYR  47  -1.787   4.767  -3.741
  313    HE2  TYR  47           HE2      TYR  47  -1.295   1.631  -0.889
  314    HH   TYR  47           HH       TYR  47  -1.438   2.444  -4.223
  315    H    ILE  48           HN       ILE  48  -3.407   5.439   3.445
  316    HA   ILE  48           HA       ILE  48  -2.932   2.721   4.036
  317    HB   ILE  48           HB       ILE  48  -3.131   4.992   6.014
  318   1HG1  ILE  48          HG12      ILE  48  -1.577   5.559   4.204
  319   2HG1  ILE  48          HG11      ILE  48  -0.705   5.249   5.702
  320   1HG2  ILE  48          HG21      ILE  48  -1.256   3.417   7.032
  321   2HG2  ILE  48          HG22      ILE  48  -2.154   2.193   6.135
  322   3HG2  ILE  48          HG23      ILE  48  -2.970   3.163   7.360
  323   1HD1  ILE  48          HD11      ILE  48   0.393   4.280   3.733
  324   2HD1  ILE  48          HD12      ILE  48  -1.028   3.273   3.457
  325   3HD1  ILE  48          HD13      ILE  48  -0.067   3.061   4.921
  326    H    ARG  49           HN       ARG  49  -5.314   4.991   5.425
  327    HA   ARG  49           HA       ARG  49  -6.706   2.833   6.719
  328   1HB   ARG  49          HB2       ARG  49  -7.655   5.680   6.438
  329   2HB   ARG  49          HB1       ARG  49  -8.135   4.503   7.654
  330   1HG   ARG  49          HG2       ARG  49  -5.412   4.654   7.988
  331   2HG   ARG  49          HG1       ARG  49  -5.862   6.316   7.600
  332   1HD   ARG  49          HD2       ARG  49  -7.810   5.655   9.362
  333   2HD   ARG  49          HD1       ARG  49  -6.470   4.688   9.976
  334    HE   ARG  49           HE       ARG  49  -5.424   6.615  10.649
  335   1HH1  ARG  49          HH11      ARG  49  -8.043   7.433   8.492
  336   2HH1  ARG  49          HH12      ARG  49  -7.930   9.133   8.799
  337   1HH2  ARG  49          HH21      ARG  49  -5.275   8.851  11.054
  338   2HH2  ARG  49          HH22      ARG  49  -6.359   9.939  10.253
  339    H    SER  50           HN       SER  50  -6.551   2.720   3.830
  340    HA   SER  50           HA       SER  50  -9.177   3.313   2.826
  341   1HB   SER  50          HB2       SER  50  -6.831   3.174   1.591
  342   2HB   SER  50          HB1       SER  50  -7.357   1.508   1.375
  343    HG   SER  50           HG       SER  50  -8.075   3.577  -0.048
  344    HA   PRO  51           HA       PRO  51 -10.970  -0.622   3.696
  345   1HB   PRO  51          HB2       PRO  51 -12.716  -0.796   1.539
  346   2HB   PRO  51          HB1       PRO  51 -13.023   0.070   3.042
  347   1HG   PRO  51          HG2       PRO  51 -12.583   1.149   0.411
  348   2HG   PRO  51          HG1       PRO  51 -12.978   2.011   1.905
  349   1HD   PRO  51          HD2       PRO  51 -10.416   1.732   0.550
  350   2HD   PRO  51          HD1       PRO  51 -10.877   2.841   1.854
  351    H    HIS  52           HN       HIS  52 -10.185  -0.192   0.278
  352    HA   HIS  52           HA       HIS  52  -9.918  -3.014  -0.193
  353   1HB   HIS  52          HB2       HIS  52  -8.852  -1.099  -2.185
  354   2HB   HIS  52          HB1       HIS  52  -9.901  -2.494  -2.413
  355    HD1  HIS  52           HD1      HIS  52 -10.266   0.564  -3.492
  356    HD2  HIS  52           HD2      HIS  52 -12.355  -1.321  -0.437
  357    HE1  HIS  52           HE1      HIS  52 -12.429   1.830  -3.264
  358    HE2  HIS  52           HE2      HIS  52 -13.661   0.690  -1.396
  359    H    ALA  53           HN       ALA  53  -7.818  -0.425   0.689
  360    HA   ALA  53           HA       ALA  53  -5.380  -1.302  -0.254
  361   1HB   ALA  53          HB1       ALA  53  -4.388  -0.058   1.661
  362   2HB   ALA  53          HB2       ALA  53  -6.023   0.174   2.281
  363   3HB   ALA  53          HB3       ALA  53  -5.564   0.865   0.725
  364    H    ARG  54           HN       ARG  54  -6.914  -2.026   2.823
  365    HA   ARG  54           HA       ARG  54  -4.959  -3.658   3.903
  366   1HB   ARG  54          HB2       ARG  54  -7.938  -3.936   4.298
  367   2HB   ARG  54          HB1       ARG  54  -6.685  -4.530   5.379
  368   1HG   ARG  54          HG2       ARG  54  -5.988  -2.237   5.838
  369   2HG   ARG  54          HG1       ARG  54  -7.239  -1.638   4.748
  370   1HD   ARG  54          HD2       ARG  54  -8.156  -3.483   6.852
  371   2HD   ARG  54          HD1       ARG  54  -7.558  -1.923   7.417
  372    HE   ARG  54           HE       ARG  54  -9.243  -1.234   5.427
  373   1HH1  ARG  54          HH11      ARG  54  -9.595  -3.302   8.216
  374   2HH1  ARG  54          HH12      ARG  54 -11.291  -2.995   8.385
  375   1HH2  ARG  54          HH21      ARG  54 -11.472  -0.827   5.649
  376   2HH2  ARG  54          HH22      ARG  54 -12.357  -1.591   6.928
  377    H    ASP  55           HN       ASP  55  -7.436  -4.362   1.576
  378    HA   ASP  55           HA       ASP  55  -7.263  -7.175   1.679
  379   1HB   ASP  55          HB2       ASP  55  -9.066  -5.634   0.599
  380   2HB   ASP  55          HB1       ASP  55  -8.011  -5.746  -0.805
  381    H    THR  56           HN       THR  56  -5.661  -4.740  -0.229
  382    HA   THR  56           HA       THR  56  -4.333  -6.371  -2.032
  383    HB   THR  56           HB       THR  56  -3.053  -3.927  -0.963
  384    HG1  THR  56           HG1      THR  56  -5.451  -4.058  -2.434
  385   1HG2  THR  56          HG21      THR  56  -3.097  -5.367  -3.520
  386   2HG2  THR  56          HG22      THR  56  -1.800  -4.453  -2.750
  387   3HG2  THR  56          HG23      THR  56  -3.087  -3.606  -3.609
  388    H    LEU  57           HN       LEU  57  -3.209  -5.094   1.082
  389    HA   LEU  57           HA       LEU  57  -0.710  -6.265   1.107
  390   1HB   LEU  57          HB2       LEU  57  -2.496  -5.054   3.032
  391   2HB   LEU  57          HB1       LEU  57  -1.465  -6.277   3.753
  392    HG   LEU  57           HG       LEU  57   0.211  -4.697   2.156
  393   1HD1  LEU  57          HD11      LEU  57  -0.324  -2.493   3.529
  394   2HD1  LEU  57          HD12      LEU  57  -1.964  -3.128   3.406
  395   3HD1  LEU  57          HD13      LEU  57  -1.031  -2.810   1.944
  396   1HD2  LEU  57          HD21      LEU  57   0.908  -3.866   4.524
  397   2HD2  LEU  57          HD22      LEU  57   1.126  -5.560   4.088
  398   3HD2  LEU  57          HD23      LEU  57  -0.249  -5.075   5.079
  399    H    THR  58           HN       THR  58  -3.735  -7.489   2.405
  400    HA   THR  58           HA       THR  58  -2.725  -9.911   3.368
  401    HB   THR  58           HB       THR  58  -5.541  -9.412   2.400
  402    HG1  THR  58           HG1      THR  58  -4.262  -8.702   4.814
  403   1HG2  THR  58          HG21      THR  58  -4.309 -11.624   3.742
  404   2HG2  THR  58          HG22      THR  58  -5.961 -11.446   3.149
  405   3HG2  THR  58          HG23      THR  58  -5.540 -10.886   4.768
  406    H    SER  59           HN       SER  59  -4.106  -8.994   0.253
  407    HA   SER  59           HA       SER  59  -4.308 -11.459  -0.946
  408   1HB   SER  59          HB2       SER  59  -4.886  -9.068  -1.804
  409   2HB   SER  59          HB1       SER  59  -3.260  -9.147  -2.469
  410    HG   SER  59           HG       SER  59  -3.843 -10.768  -3.786
  411    H    CYS  60           HN       CYS  60  -1.552  -9.429  -0.404
  412    HA   CYS  60           HA       CYS  60   0.266 -11.081  -1.894
  413   1HB   CYS  60          HB2       CYS  60   0.302  -8.472  -1.197
  414   2HB   CYS  60          HB1       CYS  60   1.280  -9.136   0.100
  415    H    GLY  61           HN       GLY  61  -0.781 -10.687   1.425
  416   1HA   GLY  61          HA2       GLY  61  -0.456 -12.009   3.268
  417   2HA   GLY  61          HA1       GLY  61   0.140 -13.249   2.177
  418    H    LEU  62           HN       LEU  62   1.324 -10.024   3.164
  419    HA   LEU  62           HA       LEU  62   3.896 -11.320   3.775
  420   1HB   LEU  62          HB2       LEU  62   4.559  -8.690   3.615
  421   2HB   LEU  62          HB1       LEU  62   4.739  -9.851   2.321
  422    HG   LEU  62           HG       LEU  62   2.151  -8.917   1.956
  423   1HD1  LEU  62          HD11      LEU  62   3.766  -6.878   3.322
  424   2HD1  LEU  62          HD12      LEU  62   2.017  -7.019   3.147
  425   3HD1  LEU  62          HD13      LEU  62   2.982  -6.348   1.834
  426   1HD2  LEU  62          HD21      LEU  62   3.105  -7.766   0.027
  427   2HD2  LEU  62          HD22      LEU  62   3.801  -9.375   0.225
  428   3HD2  LEU  62          HD23      LEU  62   4.719  -7.951   0.712
  429    H    ALA  63           HN       ALA  63   2.619  -8.140   4.668
  430    HA   ALA  63           HA       ALA  63   2.427  -8.922   7.437
  431   1HB   ALA  63          HB1       ALA  63   4.843  -8.009   6.647
  432   2HB   ALA  63          HB2       ALA  63   4.199  -7.817   8.277
  433   3HB   ALA  63          HB3       ALA  63   4.058  -6.500   7.113
  434    H    VAL  64           HN       VAL  64   2.340  -6.379   8.563
  435    HA   VAL  64           HA       VAL  64   0.258  -4.968   7.112
  436    HB   VAL  64           HB       VAL  64   0.039  -5.652  10.005
  437   1HG1  VAL  64          HG11      VAL  64  -1.015  -3.522   9.270
  438   2HG1  VAL  64          HG12      VAL  64  -2.154  -4.701   9.920
  439   3HG1  VAL  64          HG13      VAL  64  -2.029  -4.464   8.176
  440   1HG2  VAL  64          HG21      VAL  64  -0.214  -7.596   8.416
  441   2HG2  VAL  64          HG22      VAL  64  -1.648  -6.778   7.796
  442   3HG2  VAL  64          HG23      VAL  64  -1.583  -7.287   9.483
  443    HA   PRO  65           HA       PRO  65   2.653  -1.389   8.150
  444   1HB   PRO  65          HB2       PRO  65   0.574   0.440   8.312
  445   2HB   PRO  65          HB1       PRO  65   1.382  -0.047   6.820
  446   1HG   PRO  65          HG2       PRO  65  -1.180  -1.031   8.000
  447   2HG   PRO  65          HG1       PRO  65  -0.792  -0.667   6.308
  448   1HD   PRO  65          HD2       PRO  65  -0.862  -3.187   7.175
  449   2HD   PRO  65          HD1       PRO  65   0.381  -2.661   6.022
  450    H    HIS  66           HN       HIS  66   1.790   0.757   9.685
  451    HA   HIS  66           HA       HIS  66   1.578   1.499  11.826
  452   1HB   HIS  66          HB2       HIS  66   0.319  -1.156  12.519
  453   2HB   HIS  66          HB1       HIS  66   0.100   0.389  13.333
  454    HD1  HIS  66           HD1      HIS  66  -1.759  -1.752  11.340
  455    HD2  HIS  66           HD2      HIS  66  -0.992   2.322  11.126
  456    HE1  HIS  66           HE1      HIS  66  -3.609  -0.788   9.940
  457    HE2  HIS  66           HE2      HIS  66  -3.168   1.688   9.890
  458    H    CYS  67           HN       CYS  67   3.991   0.408  11.062
  459    HA   CYS  67           HA       CYS  67   5.064  -1.588  12.672
  460   1HB   CYS  67          HB2       CYS  67   6.254   0.779  11.263
  461   2HB   CYS  67          HB1       CYS  67   7.261  -0.228  12.298
  Start of MODEL    9
    1   1H    ALA   1          HT1       ALA   1  15.171   2.087  -0.303
    2   2H    ALA   1          HT2       ALA   1  15.063   3.515   0.643
    3   3H    ALA   1          HT3       ALA   1  16.465   3.211  -0.299
    4    HA   ALA   1           HA       ALA   1  15.177   4.824  -1.377
    5   1HB   ALA   1          HB1       ALA   1  16.157   2.607  -2.541
    6   2HB   ALA   1          HB2       ALA   1  15.399   3.926  -3.434
    7   3HB   ALA   1          HB3       ALA   1  14.465   2.487  -3.026
    8    H    CYS   2           HN       CYS   2  13.321   5.750  -0.749
    9    HA   CYS   2           HA       CYS   2  10.905   4.165  -0.450
   10   1HB   CYS   2          HB2       CYS   2  11.479   7.092   0.039
   11   2HB   CYS   2          HB1       CYS   2   9.908   6.343   0.300
   12    H    GLN   3           HN       GLN   3  11.237   3.762  -2.908
   13    HA   GLN   3           HA       GLN   3  10.630   5.750  -4.789
   14   1HB   GLN   3          HB2       GLN   3  10.598   2.776  -4.760
   15   2HB   GLN   3          HB1       GLN   3   9.724   3.579  -6.057
   16   1HG   GLN   3          HG2       GLN   3  11.681   4.631  -6.854
   17   2HG   GLN   3          HG1       GLN   3  12.590   4.191  -5.409
   18   1HE2  GLN   3          HE21      GLN   3  13.169   3.655  -8.217
   19   2HE2  GLN   3          HE22      GLN   3  13.304   1.939  -8.359
   20    H    ALA   4           HN       ALA   4   8.860   6.982  -4.666
   21    HA   ALA   4           HA       ALA   4   6.357   5.891  -3.734
   22   1HB   ALA   4          HB1       ALA   4   5.710   8.407  -4.353
   23   2HB   ALA   4          HB2       ALA   4   7.454   8.595  -4.170
   24   3HB   ALA   4          HB3       ALA   4   6.490   7.961  -2.836
   25    H    SER   5           HN       SER   5   7.741   5.472  -6.535
   26    HA   SER   5           HA       SER   5   5.373   6.130  -8.152
   27   1HB   SER   5          HB2       SER   5   8.280   5.816  -8.853
   28   2HB   SER   5          HB1       SER   5   7.034   5.646 -10.089
   29    HG   SER   5           HG       SER   5   7.005   7.734 -10.163
   30    H    GLN   6           HN       GLN   6   7.314   3.559  -6.913
   31    HA   GLN   6           HA       GLN   6   6.521   1.563  -8.743
   32   1HB   GLN   6          HB2       GLN   6   7.719   1.441  -5.982
   33   2HB   GLN   6          HB1       GLN   6   7.365   0.002  -6.930
   34   1HG   GLN   6          HG2       GLN   6   8.981   2.104  -8.237
   35   2HG   GLN   6          HG1       GLN   6   9.743   1.196  -6.932
   36   1HE2  GLN   6          HE21      GLN   6  10.910  -0.415  -7.661
   37   2HE2  GLN   6          HE22      GLN   6  10.544  -1.415  -9.021
   38    H    LEU   7           HN       LEU   7   4.870   3.158  -6.292
   39    HA   LEU   7           HA       LEU   7   3.022   0.910  -5.888
   40   1HB   LEU   7          HB2       LEU   7   2.928   3.406  -4.253
   41   2HB   LEU   7          HB1       LEU   7   2.471   1.771  -3.814
   42    HG   LEU   7           HG       LEU   7   5.349   2.491  -4.299
   43   1HD1  LEU   7          HD11      LEU   7   4.473   2.395  -1.508
   44   2HD1  LEU   7          HD12      LEU   7   3.876   3.789  -2.409
   45   3HD1  LEU   7          HD13      LEU   7   5.610   3.479  -2.308
   46   1HD2  LEU   7          HD21      LEU   7   5.802   0.435  -3.522
   47   2HD2  LEU   7          HD22      LEU   7   4.114   0.095  -3.906
   48   3HD2  LEU   7          HD23      LEU   7   4.573   0.531  -2.260
   49    H    ALA   8           HN       ALA   8   3.336   3.978  -7.379
   50    HA   ALA   8           HA       ALA   8   0.825   5.057  -7.318
   51   1HB   ALA   8          HB1       ALA   8   2.880   5.981  -8.456
   52   2HB   ALA   8          HB2       ALA   8   1.354   6.218  -9.307
   53   3HB   ALA   8          HB3       ALA   8   2.468   4.954  -9.829
   54    H    VAL   9           HN       VAL   9   1.952   2.338  -9.174
   55    HA   VAL   9           HA       VAL   9  -0.254   2.058 -10.871
   56    HB   VAL   9           HB       VAL   9   1.871   0.947 -11.330
   57   1HG1  VAL   9          HG11      VAL   9   1.220  -0.974  -9.108
   58   2HG1  VAL   9          HG12      VAL   9   2.315   0.394  -8.911
   59   3HG1  VAL   9          HG13      VAL   9   2.696  -0.880 -10.069
   60   1HG2  VAL   9          HG21      VAL   9  -0.116  -1.260 -10.946
   61   2HG2  VAL   9          HG22      VAL   9   0.987  -0.971 -12.292
   62   3HG2  VAL   9          HG23      VAL   9  -0.437   0.049 -12.084
   63    H    CYS  10           HN       CYS  10   0.249   1.240  -7.570
   64    HA   CYS  10           HA       CYS  10  -1.929  -0.657  -7.415
   65   1HB   CYS  10          HB2       CYS  10   0.247  -0.489  -5.952
   66   2HB   CYS  10          HB1       CYS  10  -0.704   0.661  -5.020
   67    H    ALA  11           HN       ALA  11  -1.344   2.715  -6.812
   68    HA   ALA  11           HA       ALA  11  -3.362   3.527  -5.194
   69   1HB   ALA  11          HB1       ALA  11  -2.857   5.087  -7.688
   70   2HB   ALA  11          HB2       ALA  11  -1.577   4.894  -6.490
   71   3HB   ALA  11          HB3       ALA  11  -3.100   5.661  -6.038
   72    H    SER  12           HN       SER  12  -3.644   2.394  -8.452
   73    HA   SER  12           HA       SER  12  -6.134   3.324  -9.183
   74   1HB   SER  12          HB2       SER  12  -4.391   1.803 -10.445
   75   2HB   SER  12          HB1       SER  12  -5.401   0.496  -9.828
   76    HG   SER  12           HG       SER  12  -6.866   0.996 -11.244
   77    H    ALA  13           HN       ALA  13  -5.284   0.606  -7.120
   78    HA   ALA  13           HA       ALA  13  -8.011  -0.234  -6.795
   79   1HB   ALA  13          HB1       ALA  13  -6.312  -1.928  -6.769
   80   2HB   ALA  13          HB2       ALA  13  -7.053  -1.848  -5.170
   81   3HB   ALA  13          HB3       ALA  13  -5.470  -1.121  -5.446
   82    H    ILE  14           HN       ILE  14  -5.587   1.505  -4.906
   83    HA   ILE  14           HA       ILE  14  -7.091   1.681  -2.517
   84    HB   ILE  14           HB       ILE  14  -4.877   3.457  -3.559
   85   1HG1  ILE  14          HG12      ILE  14  -3.688   2.196  -1.596
   86   2HG1  ILE  14          HG11      ILE  14  -4.974   1.012  -1.822
   87   1HG2  ILE  14          HG21      ILE  14  -5.339   4.873  -1.914
   88   2HG2  ILE  14          HG22      ILE  14  -4.994   3.588  -0.757
   89   3HG2  ILE  14          HG23      ILE  14  -6.642   3.838  -1.331
   90   1HD1  ILE  14          HD11      ILE  14  -2.591   1.003  -3.127
   91   2HD1  ILE  14          HD12      ILE  14  -3.636   1.807  -4.298
   92   3HD1  ILE  14          HD13      ILE  14  -4.058   0.206  -3.694
   93    H    LEU  15           HN       LEU  15  -6.456   4.168  -4.999
   94    HA   LEU  15           HA       LEU  15  -8.152   6.124  -4.031
   95   1HB   LEU  15          HB2       LEU  15  -7.333   5.473  -6.855
   96   2HB   LEU  15          HB1       LEU  15  -8.259   6.903  -6.439
   97    HG   LEU  15           HG       LEU  15  -5.506   6.263  -5.378
   98   1HD1  LEU  15          HD11      LEU  15  -4.897   8.267  -6.811
   99   2HD1  LEU  15          HD12      LEU  15  -6.447   8.027  -7.619
  100   3HD1  LEU  15          HD13      LEU  15  -5.226   6.755  -7.659
  101   1HD2  LEU  15          HD21      LEU  15  -6.692   7.590  -3.793
  102   2HD2  LEU  15          HD22      LEU  15  -7.313   8.650  -5.058
  103   3HD2  LEU  15          HD23      LEU  15  -5.594   8.660  -4.665
  104    H    SER  16           HN       SER  16  -9.043   4.495  -7.050
  105    HA   SER  16           HA       SER  16 -11.817   4.887  -6.561
  106   1HB   SER  16          HB2       SER  16 -11.080   4.890  -8.836
  107   2HB   SER  16          HB1       SER  16 -10.324   3.306  -8.659
  108    HG   SER  16           HG       SER  16 -12.377   2.399  -8.446
  109    H    GLY  17           HN       GLY  17 -10.402   1.747  -7.410
  110   1HA   GLY  17          HA2       GLY  17 -10.466   0.066  -5.479
  111   2HA   GLY  17          HA1       GLY  17 -12.158   0.531  -5.377
  112    H    ALA  18           HN       ALA  18 -10.152  -0.032  -8.246
  113    HA   ALA  18           HA       ALA  18 -12.116  -1.464  -9.624
  114   1HB   ALA  18          HB1       ALA  18 -10.463  -0.536 -10.965
  115   2HB   ALA  18          HB2       ALA  18 -10.101  -2.261 -11.011
  116   3HB   ALA  18          HB3       ALA  18  -9.160  -1.190  -9.973
  117    H    LYS  19           HN       LYS  19  -9.041  -2.923  -8.772
  118    HA   LYS  19           HA       LYS  19 -10.050  -4.977  -7.142
  119   1HB   LYS  19          HB2       LYS  19  -9.661  -6.862  -8.830
  120   2HB   LYS  19          HB1       LYS  19 -11.149  -5.939  -8.983
  121   1HG   LYS  19          HG2       LYS  19 -10.524  -5.962 -11.158
  122   2HG   LYS  19          HG1       LYS  19  -9.652  -4.516 -10.647
  123   1HD   LYS  19          HD2       LYS  19  -7.804  -6.363 -10.065
  124   2HD   LYS  19          HD1       LYS  19  -8.632  -7.197 -11.381
  125   1HE   LYS  19          HE2       LYS  19  -7.426  -4.435 -11.489
  126   2HE   LYS  19          HE1       LYS  19  -6.766  -5.891 -12.232
  127   1HZ   LYS  19          HZ1       LYS  19  -9.070  -5.954 -13.394
  128   2HZ   LYS  19          HZ2       LYS  19  -7.863  -4.924 -13.980
  129   3HZ   LYS  19          HZ3       LYS  19  -9.110  -4.304 -13.020
  130    HA   PRO  20           HA       PRO  20  -5.760  -5.210  -6.119
  131   1HB   PRO  20          HB2       PRO  20  -6.297  -8.120  -5.757
  132   2HB   PRO  20          HB1       PRO  20  -5.548  -6.967  -4.646
  133   1HG   PRO  20          HG2       PRO  20  -8.050  -7.788  -4.263
  134   2HG   PRO  20          HG1       PRO  20  -7.589  -6.102  -3.960
  135   1HD   PRO  20          HD2       PRO  20  -9.108  -7.272  -6.246
  136   2HD   PRO  20          HD1       PRO  20  -9.302  -5.699  -5.446
  137    H    SER  21           HN       SER  21  -3.834  -6.790  -6.579
  138    HA   SER  21           HA       SER  21  -3.876  -8.411  -8.878
  139   1HB   SER  21          HB2       SER  21  -4.096  -5.831  -9.645
  140   2HB   SER  21          HB1       SER  21  -2.340  -5.973  -9.570
  141    HG   SER  21           HG       SER  21  -3.631  -6.605 -11.594
  142    H    GLY  22           HN       GLY  22  -2.005  -9.562  -9.072
  143   1HA   GLY  22          HA2       GLY  22  -0.216  -9.641  -6.930
  144   2HA   GLY  22          HA1       GLY  22   0.056 -10.389  -8.496
  145    H    GLU  23           HN       GLU  23  -0.159  -7.681  -9.800
  146    HA   GLU  23           HA       GLU  23   2.524  -7.094 -10.044
  147   1HB   GLU  23          HB2       GLU  23   0.417  -6.387 -11.431
  148   2HB   GLU  23          HB1       GLU  23   0.442  -4.968 -10.383
  149   1HG   GLU  23          HG2       GLU  23   3.027  -5.635 -11.531
  150   2HG   GLU  23          HG1       GLU  23   1.793  -5.246 -12.724
  151    H    CYS  24           HN       CYS  24   0.063  -5.462  -8.065
  152    HA   CYS  24           HA       CYS  24   1.670  -3.479  -6.996
  153   1HB   CYS  24          HB2       CYS  24  -0.754  -3.442  -6.761
  154   2HB   CYS  24          HB1       CYS  24  -0.693  -4.872  -5.736
  155    H    CYS  25           HN       CYS  25   1.233  -6.795  -6.033
  156    HA   CYS  25           HA       CYS  25   2.554  -6.666  -3.543
  157   1HB   CYS  25          HB2       CYS  25   2.056  -8.945  -5.455
  158   2HB   CYS  25          HB1       CYS  25   2.861  -9.168  -3.907
  159    H    GLY  26           HN       GLY  26   3.698  -7.319  -6.821
  160   1HA   GLY  26          HA2       GLY  26   6.329  -8.061  -6.145
  161   2HA   GLY  26          HA1       GLY  26   5.812  -7.435  -7.703
  162    H    ASN  27           HN       ASN  27   4.943  -4.886  -6.919
  163    HA   ASN  27           HA       ASN  27   7.368  -3.498  -6.900
  164   1HB   ASN  27          HB2       ASN  27   4.618  -2.418  -6.302
  165   2HB   ASN  27          HB1       ASN  27   6.025  -1.471  -6.775
  166   1HD2  ASN  27          HD21      ASN  27   6.849  -1.719  -8.905
  167   2HD2  ASN  27          HD22      ASN  27   5.822  -2.260 -10.185
  168    H    LEU  28           HN       LEU  28   4.818  -3.495  -4.463
  169    HA   LEU  28           HA       LEU  28   6.158  -2.139  -2.484
  170   1HB   LEU  28          HB2       LEU  28   4.661  -3.174  -0.874
  171   2HB   LEU  28          HB1       LEU  28   3.795  -2.677  -2.315
  172    HG   LEU  28           HG       LEU  28   4.214  -5.172  -3.032
  173   1HD1  LEU  28          HD11      LEU  28   5.536  -5.960  -1.261
  174   2HD1  LEU  28          HD12      LEU  28   3.927  -6.613  -0.961
  175   3HD1  LEU  28          HD13      LEU  28   4.497  -5.217  -0.046
  176   1HD2  LEU  28          HD21      LEU  28   2.106  -3.817  -1.531
  177   2HD2  LEU  28          HD22      LEU  28   2.075  -5.573  -1.372
  178   3HD2  LEU  28          HD23      LEU  28   2.001  -4.831  -2.969
  179    H    ARG  29           HN       ARG  29   6.597  -5.368  -3.587
  180    HA   ARG  29           HA       ARG  29   7.838  -6.520  -1.411
  181   1HB   ARG  29          HB2       ARG  29   7.244  -7.256  -4.024
  182   2HB   ARG  29          HB1       ARG  29   8.996  -7.373  -3.923
  183   1HG   ARG  29          HG2       ARG  29   8.883  -9.240  -2.743
  184   2HG   ARG  29          HG1       ARG  29   7.743  -8.520  -1.606
  185   1HD   ARG  29          HD2       ARG  29   6.216  -8.918  -3.860
  186   2HD   ARG  29          HD1       ARG  29   7.269 -10.334  -3.829
  187    HE   ARG  29           HE       ARG  29   5.999  -9.684  -1.317
  188   1HH1  ARG  29          HH11      ARG  29   5.786 -11.505  -4.291
  189   2HH1  ARG  29          HH12      ARG  29   4.721 -12.699  -3.631
  190   1HH2  ARG  29          HH21      ARG  29   4.602 -11.260  -0.450
  191   2HH2  ARG  29          HH22      ARG  29   4.046 -12.559  -1.451
  192    H    ALA  30           HN       ALA  30   9.321  -5.016  -4.224
  193    HA   ALA  30           HA       ALA  30  11.958  -5.178  -3.477
  194   1HB   ALA  30          HB1       ALA  30  11.143  -2.612  -4.696
  195   2HB   ALA  30          HB2       ALA  30  10.708  -4.079  -5.574
  196   3HB   ALA  30          HB3       ALA  30  12.397  -3.752  -5.185
  197    H    GLN  31           HN       GLN  31   9.437  -3.222  -2.195
  198    HA   GLN  31           HA       GLN  31  11.196  -1.412  -0.787
  199   1HB   GLN  31          HB2       GLN  31   8.277  -1.717  -0.176
  200   2HB   GLN  31          HB1       GLN  31   9.283  -0.278  -0.089
  201   1HG   GLN  31          HG2       GLN  31   9.444  -0.785  -2.714
  202   2HG   GLN  31          HG1       GLN  31   7.847  -1.446  -2.371
  203   1HE2  GLN  31          HE21      GLN  31   9.702   1.348  -2.847
  204   2HE2  GLN  31          HE22      GLN  31   8.460   2.515  -2.530
  205    H    GLN  32           HN       GLN  32   8.586  -3.486   0.460
  206    HA   GLN  32           HA       GLN  32   8.347  -4.537   2.467
  207   1HB   GLN  32          HB2       GLN  32  10.255  -5.775   1.002
  208   2HB   GLN  32          HB1       GLN  32  11.143  -5.455   2.484
  209   1HG   GLN  32          HG2       GLN  32  10.097  -7.085   3.563
  210   2HG   GLN  32          HG1       GLN  32   8.516  -6.504   3.040
  211   1HE2  GLN  32          HE21      GLN  32   7.765  -7.166   0.936
  212   2HE2  GLN  32          HE22      GLN  32   8.264  -8.688   0.291
  213    H    GLY  33           HN       GLY  33   9.613  -1.780   2.460
  214   1HA   GLY  33          HA2       GLY  33  10.402  -1.839   5.277
  215   2HA   GLY  33          HA1       GLY  33  11.514  -1.104   4.130
  216    H    CYS  34           HN       CYS  34  10.756   0.751   2.906
  217    HA   CYS  34           HA       CYS  34   9.528   2.671   4.482
  218   1HB   CYS  34          HB2       CYS  34  11.039   2.901   2.375
  219   2HB   CYS  34          HB1       CYS  34   9.497   2.898   1.539
  220    H    PHE  35           HN       PHE  35   8.268   0.571   2.024
  221    HA   PHE  35           HA       PHE  35   5.754   1.629   1.602
  222   1HB   PHE  35          HB2       PHE  35   5.895  -0.166   0.237
  223   2HB   PHE  35          HB1       PHE  35   7.070  -0.943   1.283
  224    HD1  PHE  35           HD1      PHE  35   3.474  -0.113   1.912
  225    HD2  PHE  35           HD2      PHE  35   6.440  -3.129   1.434
  226    HE1  PHE  35           HE1      PHE  35   1.823  -1.833   2.517
  227    HE2  PHE  35           HE2      PHE  35   4.801  -4.849   2.044
  228    HZ   PHE  35           HZ       PHE  35   2.484  -4.204   2.587
  229    H    CYS  36           HN       CYS  36   6.924  -0.400   4.175
  230    HA   CYS  36           HA       CYS  36   4.403  -0.539   5.551
  231   1HB   CYS  36          HB2       CYS  36   6.464  -2.162   5.680
  232   2HB   CYS  36          HB1       CYS  36   7.037  -1.031   6.901
  233    H    GLN  37           HN       GLN  37   7.259   1.473   5.615
  234    HA   GLN  37           HA       GLN  37   6.828   2.803   8.026
  235   1HB   GLN  37          HB2       GLN  37   8.207   3.741   5.513
  236   2HB   GLN  37          HB1       GLN  37   8.269   4.594   7.047
  237   1HG   GLN  37          HG2       GLN  37   9.203   2.400   7.995
  238   2HG   GLN  37          HG1       GLN  37   9.483   1.961   6.312
  239   1HE2  GLN  37          HE21      GLN  37  10.594   3.796   5.030
  240   2HE2  GLN  37          HE22      GLN  37  11.946   4.529   5.814
  241    H    TYR  38           HN       TYR  38   5.527   3.260   4.839
  242    HA   TYR  38           HA       TYR  38   4.495   5.843   5.095
  243   1HB   TYR  38          HB2       TYR  38   3.851   3.484   3.389
  244   2HB   TYR  38          HB1       TYR  38   2.701   4.817   3.427
  245    HD1  TYR  38           HD1      TYR  38   3.645   7.178   2.943
  246    HD2  TYR  38           HD2      TYR  38   5.690   3.578   1.964
  247    HE1  TYR  38           HE1      TYR  38   5.006   8.404   1.302
  248    HE2  TYR  38           HE2      TYR  38   7.057   4.794   0.321
  249    HH   TYR  38           HH       TYR  38   7.797   7.343   0.067
  250    H    ALA  39           HN       ALA  39   3.491   2.915   6.581
  251    HA   ALA  39           HA       ALA  39   0.792   3.229   6.942
  252   1HB   ALA  39          HB1       ALA  39   1.231   2.077   9.202
  253   2HB   ALA  39          HB2       ALA  39   2.914   2.037   8.676
  254   3HB   ALA  39          HB3       ALA  39   1.671   1.229   7.720
  255    H    LYS  40           HN       LYS  40   3.355   5.076   8.326
  256    HA   LYS  40           HA       LYS  40   1.455   6.430  10.115
  257   1HB   LYS  40          HB2       LYS  40   4.258   5.666  10.387
  258   2HB   LYS  40          HB1       LYS  40   3.973   7.352  10.797
  259   1HG   LYS  40          HG2       LYS  40   3.782   6.101  12.796
  260   2HG   LYS  40          HG1       LYS  40   2.148   6.576  12.328
  261   1HD   LYS  40          HD2       LYS  40   1.860   4.349  12.878
  262   2HD   LYS  40          HD1       LYS  40   2.109   4.263  11.133
  263   1HE   LYS  40          HE2       LYS  40   4.017   3.116  11.354
  264   2HE   LYS  40          HE1       LYS  40   4.594   4.158  12.654
  265   1HZ   LYS  40          HZ1       LYS  40   4.304   2.280  13.843
  266   2HZ   LYS  40          HZ2       LYS  40   3.136   1.644  12.798
  267   3HZ   LYS  40          HZ3       LYS  40   2.703   2.820  13.934
  268    H    ASP  41           HN       ASP  41   3.460   6.808   7.353
  269    HA   ASP  41           HA       ASP  41   3.903   9.566   7.361
  270   1HB   ASP  41          HB2       ASP  41   4.930   7.878   5.798
  271   2HB   ASP  41          HB1       ASP  41   3.403   7.866   4.912
  272    HA   PRO  42           HA       PRO  42  -0.409  10.745   6.796
  273   1HB   PRO  42          HB2       PRO  42  -0.131  13.343   7.391
  274   2HB   PRO  42          HB1       PRO  42  -0.064  12.094   8.641
  275   1HG   PRO  42          HG2       PRO  42   2.177  13.556   7.300
  276   2HG   PRO  42          HG1       PRO  42   1.976  13.142   9.012
  277   1HD   PRO  42          HD2       PRO  42   3.535  11.715   7.259
  278   2HD   PRO  42          HD1       PRO  42   2.799  11.027   8.719
  279    H    THR  43           HN       THR  43   2.183  11.291   4.810
  280    HA   THR  43           HA       THR  43   1.573  13.466   3.232
  281    HB   THR  43           HB       THR  43   2.667  12.197   1.363
  282    HG1  THR  43           HG1      THR  43   2.539  10.129   3.280
  283   1HG2  THR  43          HG21      THR  43   3.880  12.637   4.002
  284   2HG2  THR  43          HG22      THR  43   4.372  13.208   2.408
  285   3HG2  THR  43          HG23      THR  43   4.761  11.565   2.915
  286    H    TYR  44           HN       TYR  44   0.211  10.207   3.088
  287    HA   TYR  44           HA       TYR  44  -1.689  11.129   1.042
  288   1HB   TYR  44          HB2       TYR  44  -1.061   8.297   1.902
  289   2HB   TYR  44          HB1       TYR  44  -2.103   8.773   0.565
  290    HD1  TYR  44           HD1      TYR  44  -1.191   9.360  -1.558
  291    HD2  TYR  44           HD2      TYR  44   1.391   8.678   1.754
  292    HE1  TYR  44           HE1      TYR  44   0.741   9.330  -3.078
  293    HE2  TYR  44           HE2      TYR  44   3.331   8.646   0.243
  294    HH   TYR  44           HH       TYR  44   3.592   8.078  -2.405
  295    H    GLY  45           HN       GLY  45  -1.701   8.902   3.836
  296   1HA   GLY  45          HA2       GLY  45  -3.165   8.818   5.630
  297   2HA   GLY  45          HA1       GLY  45  -3.966  10.249   5.000
  298    H    GLN  46           HN       GLN  46  -5.040   9.676   2.718
  299    HA   GLN  46           HA       GLN  46  -7.136   7.870   3.339
  300   1HB   GLN  46          HB2       GLN  46  -7.186   9.994   1.862
  301   2HB   GLN  46          HB1       GLN  46  -6.604   8.937   0.583
  302   1HG   GLN  46          HG2       GLN  46  -8.585   7.896   0.351
  303   2HG   GLN  46          HG1       GLN  46  -8.952   7.973   2.074
  304   1HE2  GLN  46          HE21      GLN  46 -10.247   8.795  -0.646
  305   2HE2  GLN  46          HE22      GLN  46 -10.926  10.350  -0.277
  306    H    TYR  47           HN       TYR  47  -4.095   7.513   1.785
  307    HA   TYR  47           HA       TYR  47  -4.754   5.247   0.187
  308   1HB   TYR  47          HB2       TYR  47  -2.745   6.914   0.009
  309   2HB   TYR  47          HB1       TYR  47  -2.001   5.779   1.128
  310    HD1  TYR  47           HD1      TYR  47  -1.537   3.459   0.445
  311    HD2  TYR  47           HD2      TYR  47  -3.062   6.339  -2.289
  312    HE1  TYR  47           HE1      TYR  47  -0.877   2.015  -1.434
  313    HE2  TYR  47           HE2      TYR  47  -2.409   4.903  -4.175
  314    HH   TYR  47           HH       TYR  47  -0.353   2.221  -3.818
  315    H    ILE  48           HN       ILE  48  -3.036   5.667   3.258
  316    HA   ILE  48           HA       ILE  48  -2.660   2.905   3.728
  317    HB   ILE  48           HB       ILE  48  -2.682   5.158   5.738
  318   1HG1  ILE  48          HG12      ILE  48  -1.077   5.470   3.859
  319   2HG1  ILE  48          HG11      ILE  48  -0.285   5.268   5.418
  320   1HG2  ILE  48          HG21      ILE  48  -1.442   2.413   5.906
  321   2HG2  ILE  48          HG22      ILE  48  -2.897   2.937   6.755
  322   3HG2  ILE  48          HG23      ILE  48  -1.341   3.680   7.129
  323   1HD1  ILE  48          HD11      ILE  48  -0.526   3.255   3.203
  324   2HD1  ILE  48          HD12      ILE  48   0.043   2.856   4.824
  325   3HD1  ILE  48          HD13      ILE  48   0.938   4.009   3.834
  326    H    ARG  49           HN       ARG  49  -4.952   5.238   5.164
  327    HA   ARG  49           HA       ARG  49  -6.399   3.123   6.470
  328   1HB   ARG  49          HB2       ARG  49  -7.309   5.978   6.187
  329   2HB   ARG  49          HB1       ARG  49  -7.750   4.821   7.435
  330   1HG   ARG  49          HG2       ARG  49  -5.352   4.851   8.173
  331   2HG   ARG  49          HG1       ARG  49  -5.104   6.196   7.057
  332   1HD   ARG  49          HD2       ARG  49  -6.909   7.430   8.235
  333   2HD   ARG  49          HD1       ARG  49  -6.998   6.112   9.402
  334    HE   ARG  49           HE       ARG  49  -4.357   7.184   9.141
  335   1HH1  ARG  49          HH11      ARG  49  -7.452   7.636  10.685
  336   2HH1  ARG  49          HH12      ARG  49  -6.797   8.516  12.025
  337   1HH2  ARG  49          HH21      ARG  49  -3.491   8.342  10.903
  338   2HH2  ARG  49          HH22      ARG  49  -4.548   8.918  12.149
  339    H    SER  50           HN       SER  50  -6.268   2.997   3.580
  340    HA   SER  50           HA       SER  50  -8.880   3.663   2.589
  341   1HB   SER  50          HB2       SER  50  -6.553   3.464   1.337
  342   2HB   SER  50          HB1       SER  50  -7.109   1.806   1.137
  343    HG   SER  50           HG       SER  50  -8.360   4.179   0.259
  344    HA   PRO  51           HA       PRO  51 -10.888  -0.102   3.732
  345   1HB   PRO  51          HB2       PRO  51 -12.816  -0.242   1.834
  346   2HB   PRO  51          HB1       PRO  51 -12.864   0.929   3.157
  347   1HG   PRO  51          HG2       PRO  51 -11.985   1.310   0.321
  348   2HG   PRO  51          HG1       PRO  51 -12.984   2.369   1.334
  349   1HD   PRO  51          HD2       PRO  51 -10.343   2.816   0.905
  350   2HD   PRO  51          HD1       PRO  51 -11.159   3.267   2.415
  351    H    HIS  52           HN       HIS  52 -10.193   0.273   0.267
  352    HA   HIS  52           HA       HIS  52 -10.165  -2.570  -0.182
  353   1HB   HIS  52          HB2       HIS  52  -9.014  -0.621  -2.138
  354   2HB   HIS  52          HB1       HIS  52  -9.937  -2.089  -2.438
  355    HD1  HIS  52           HD1      HIS  52 -12.571  -1.899  -1.976
  356    HD2  HIS  52           HD2      HIS  52 -10.480   1.689  -2.122
  357    HE1  HIS  52           HE1      HIS  52 -14.317  -0.115  -2.279
  358    HE2  HIS  52           HE2      HIS  52 -13.022   2.040  -2.440
  359    H    ALA  53           HN       ALA  53  -7.881  -0.230   0.825
  360    HA   ALA  53           HA       ALA  53  -5.516  -1.258  -0.187
  361   1HB   ALA  53          HB1       ALA  53  -4.488  -0.201   1.895
  362   2HB   ALA  53          HB2       ALA  53  -6.132   0.300   2.291
  363   3HB   ALA  53          HB3       ALA  53  -5.376   0.855   0.797
  364    H    ARG  54           HN       ARG  54  -6.972  -1.837   2.965
  365    HA   ARG  54           HA       ARG  54  -5.169  -3.730   3.871
  366   1HB   ARG  54          HB2       ARG  54  -7.505  -2.565   4.831
  367   2HB   ARG  54          HB1       ARG  54  -7.864  -4.286   4.787
  368   1HG   ARG  54          HG2       ARG  54  -6.228  -4.804   6.332
  369   2HG   ARG  54          HG1       ARG  54  -5.320  -3.323   6.019
  370   1HD   ARG  54          HD2       ARG  54  -6.621  -3.465   8.213
  371   2HD   ARG  54          HD1       ARG  54  -6.819  -2.008   7.242
  372    HE   ARG  54           HE       ARG  54  -9.006  -2.607   6.810
  373   1HH1  ARG  54          HH11      ARG  54  -7.360  -5.222   8.441
  374   2HH1  ARG  54          HH12      ARG  54  -8.818  -6.092   8.779
  375   1HH2  ARG  54          HH21      ARG  54 -10.921  -3.755   7.254
  376   2HH2  ARG  54          HH22      ARG  54 -10.838  -5.262   8.105
  377    H    ASP  55           HN       ASP  55  -7.942  -4.064   1.803
  378    HA   ASP  55           HA       ASP  55  -8.129  -6.872   1.875
  379   1HB   ASP  55          HB2       ASP  55  -9.806  -5.098   0.966
  380   2HB   ASP  55          HB1       ASP  55  -8.905  -5.327  -0.528
  381    H    THR  56           HN       THR  56  -6.601  -4.685  -0.405
  382    HA   THR  56           HA       THR  56  -5.565  -6.594  -2.131
  383    HB   THR  56           HB       THR  56  -4.090  -4.091  -1.567
  384    HG1  THR  56           HG1      THR  56  -5.623  -2.910  -2.662
  385   1HG2  THR  56          HG21      THR  56  -3.911  -5.934  -3.589
  386   2HG2  THR  56          HG22      THR  56  -3.274  -4.289  -3.618
  387   3HG2  THR  56          HG23      THR  56  -4.865  -4.631  -4.298
  388    H    LEU  57           HN       LEU  57  -4.092  -5.019   0.675
  389    HA   LEU  57           HA       LEU  57  -1.644  -6.338   0.542
  390   1HB   LEU  57          HB2       LEU  57  -3.044  -4.641   2.416
  391   2HB   LEU  57          HB1       LEU  57  -2.019  -5.819   3.218
  392    HG   LEU  57           HG       LEU  57  -0.528  -4.656   1.104
  393   1HD1  LEU  57          HD11      LEU  57  -1.618  -2.669   0.950
  394   2HD1  LEU  57          HD12      LEU  57  -0.558  -2.300   2.310
  395   3HD1  LEU  57          HD13      LEU  57  -2.237  -2.755   2.599
  396   1HD2  LEU  57          HD21      LEU  57   0.772  -5.364   2.824
  397   2HD2  LEU  57          HD22      LEU  57  -0.400  -4.883   4.051
  398   3HD2  LEU  57          HD23      LEU  57   0.626  -3.669   3.287
  399    H    THR  58           HN       THR  58  -4.542  -7.025   2.397
  400    HA   THR  58           HA       THR  58  -3.594  -9.301   3.703
  401    HB   THR  58           HB       THR  58  -6.430  -8.573   2.950
  402    HG1  THR  58           HG1      THR  58  -5.168  -7.133   4.362
  403   1HG2  THR  58          HG21      THR  58  -7.196 -10.377   3.969
  404   2HG2  THR  58          HG22      THR  58  -6.189 -10.068   5.383
  405   3HG2  THR  58          HG23      THR  58  -5.543 -10.989   4.024
  406    H    SER  59           HN       SER  59  -5.296  -8.914   0.621
  407    HA   SER  59           HA       SER  59  -5.747 -11.542  -0.023
  408   1HB   SER  59          HB2       SER  59  -6.291  -9.348  -1.306
  409   2HB   SER  59          HB1       SER  59  -4.742  -9.658  -2.078
  410    HG   SER  59           HG       SER  59  -5.886 -10.891  -3.342
  411    H    CYS  60           HN       CYS  60  -2.848  -9.650  -0.212
  412    HA   CYS  60           HA       CYS  60  -1.281 -11.719  -1.449
  413   1HB   CYS  60          HB2       CYS  60  -1.066  -9.023  -1.364
  414   2HB   CYS  60          HB1       CYS  60   0.045  -9.463  -0.074
  415    H    GLY  61           HN       GLY  61  -1.752 -10.349   1.782
  416   1HA   GLY  61          HA2       GLY  61  -1.172 -11.121   3.858
  417   2HA   GLY  61          HA1       GLY  61  -1.130 -12.720   3.131
  418    H    LEU  62           HN       LEU  62   0.881  -9.813   2.675
  419    HA   LEU  62           HA       LEU  62   3.212 -11.500   3.301
  420   1HB   LEU  62          HB2       LEU  62   4.485  -9.768   1.911
  421   2HB   LEU  62          HB1       LEU  62   3.502 -10.953   1.075
  422    HG   LEU  62           HG       LEU  62   1.682  -9.140   1.012
  423   1HD1  LEU  62          HD11      LEU  62   2.115  -7.214   2.032
  424   2HD1  LEU  62          HD12      LEU  62   3.420  -6.932   0.882
  425   3HD1  LEU  62          HD13      LEU  62   3.755  -7.738   2.412
  426   1HD2  LEU  62          HD21      LEU  62   2.488  -8.332  -1.053
  427   2HD2  LEU  62          HD22      LEU  62   3.156  -9.954  -0.877
  428   3HD2  LEU  62          HD23      LEU  62   4.170  -8.545  -0.569
  429    H    ALA  63           HN       ALA  63   1.839  -8.257   3.657
  430    HA   ALA  63           HA       ALA  63   3.282  -7.964   6.137
  431   1HB   ALA  63          HB1       ALA  63   4.697  -7.054   4.193
  432   2HB   ALA  63          HB2       ALA  63   4.482  -6.042   5.622
  433   3HB   ALA  63          HB3       ALA  63   3.535  -5.727   4.167
  434    H    VAL  64           HN       VAL  64   2.720  -5.708   7.110
  435    HA   VAL  64           HA       VAL  64   0.063  -4.816   6.410
  436    HB   VAL  64           HB       VAL  64   0.378  -6.717   8.388
  437   1HG1  VAL  64          HG11      VAL  64   1.400  -4.955   9.832
  438   2HG1  VAL  64          HG12      VAL  64  -0.042  -5.712  10.509
  439   3HG1  VAL  64          HG13      VAL  64  -0.145  -4.105   9.791
  440   1HG2  VAL  64          HG21      VAL  64  -1.883  -6.661   8.464
  441   2HG2  VAL  64          HG22      VAL  64  -1.664  -5.622   7.056
  442   3HG2  VAL  64          HG23      VAL  64  -1.945  -4.908   8.644
  443    HA   PRO  65           HA       PRO  65   1.818  -0.913   7.582
  444   1HB   PRO  65          HB2       PRO  65  -0.372   0.582   7.867
  445   2HB   PRO  65          HB1       PRO  65   0.044  -0.107   6.288
  446   1HG   PRO  65          HG2       PRO  65  -1.807  -1.228   8.383
  447   2HG   PRO  65          HG1       PRO  65  -2.171  -0.893   6.673
  448   1HD   PRO  65          HD2       PRO  65  -1.494  -3.348   7.468
  449   2HD   PRO  65          HD1       PRO  65  -0.877  -2.696   5.932
  450    H    HIS  66           HN       HIS  66   1.376  -2.842   9.743
  451    HA   HIS  66           HA       HIS  66   1.072  -0.935  11.955
  452   1HB   HIS  66          HB2       HIS  66   0.177  -3.824  12.036
  453   2HB   HIS  66          HB1       HIS  66  -0.016  -2.623  13.308
  454    HD1  HIS  66           HD1      HIS  66  -1.561  -0.487  12.526
  455    HD2  HIS  66           HD2      HIS  66  -2.004  -4.056  10.453
  456    HE1  HIS  66           HE1      HIS  66  -3.781  -0.330  11.377
  457    HE2  HIS  66           HE2      HIS  66  -3.986  -2.451  10.043
  458    H    CYS  67           HN       CYS  67   3.442  -1.884  10.528
  459    HA   CYS  67           HA       CYS  67   4.772  -3.708  12.337
  460   1HB   CYS  67          HB2       CYS  67   6.711  -3.407  10.832
  461   2HB   CYS  67          HB1       CYS  67   5.255  -3.868   9.958