*HEADER    CYTOKINE                                25-FEB-00   1EIH              
*TITLE     SOLUTION STRUCTURE OF THE HUMAN CHEMOKINE EOTAXIN-2                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EOTAXIN-2;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PET28A                                    
*KEYWDS    CHEMOKINE, CHEMOTACTIC CYTOKINE, EOSINOPHIL CHEMOATTRACTANT           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.L.MAYER, M.J.STONE                                                  
*REVDAT   1   06-DEC-00 1EIH    0                                              !c13_intra_1014.tbl
assign (resid 1 and name HA) (resid 1 and name HB) 3.3 1.5 0.0
assign (resid 1 and name HA) (resid 1 and name HG**) 5.0 3.2 2.5
assign (resid 2 and name HA) (resid 2 and name HB) 2.7 0.9 0.0
assign (resid 3 and name HA) (resid 3 and name HB) 2.7 0.9 0.0
assign (resid 3 and name HA) (resid 3 and name HD#) 3.3 1.5 1.5
assign (resid 3 and name HA) (resid 3 and name HG1*) 3.3 1.5 1.0
assign (resid 3 and name HA) (resid 3 and name HG2#) 2.7 0.9 1.5
!assign (resid 3 and name HG1*) (resid 3 and name HB) 2.7 0.9 1.0
assign (resid 3 and name HG1*) (resid 3 and name HD#) 2.7 0.9 2.5
assign (resid 4 and name HD*) (resid 4 and name HB*) 3.3 1.5 2.0
assign (resid 6 and name HA) (resid 6 and name HB*) 2.7 0.9 1.0
assign (resid 6 and name HA) (resid 6 and name HG*) 2.7 0.9 1.0
assign (resid 7 and name HA) (resid 7 and name HB*) 2.7 0.9 1.0
assign (resid 8 and name HB*) (resid 8 and name HA) 3.3 1.5 1.0
!assign (resid 10 and name HA) (resid 10 and name HB*) 2.7 0.9 1.0
assign (resid 11 and name HA) (resid 11 and name HB*) 2.7 0.9 1.0
assign (resid 12 and name HA) (resid 12 and name HB) 2.7 0.9 0.0
assign (resid 12 and name HA) (resid 12 and name HG**) 2.7 0.9 2.5
assign (resid 12 and name HG1#) (resid 12 and name HA) 3.3 1.5 1.5
assign (resid 12 and name HG1#) (resid 12 and name HB) 2.7 0.9 1.5
assign (resid 13 and name HA) (resid 13 and name HB*) 2.7 0.9 1.0
assign (resid 14 and name HG*) (resid 14 and name HB*) 2.7 0.9 2.0
assign (resid 14 and name HG*) (resid 14 and name HE*) 2.7 0.9 2.0
!loosen to M 10/21 back to S and remove stereo 10/28
!assign (resid 15 and name HA) (resid 15 and name HB1) 3.3 1.5 0.0
assign (resid 15 and name HA) (resid 15 and name HB*) 2.7 0.9 1.0
assign (resid 15 and name HA) (resid 15 and name HG*) 2.7 0.9 1.0
!rem stereo 10/28
!assign (resid 15 and name HB1) (resid 15 and name HD*) 3.3 1.5 1.0
!assign (resid 15 and name HB1) (resid 15 and name HG*) 2.7 0.9 1.0
assign (resid 15 and name HB*) (resid 15 and name HD*) 3.3 1.5 2.0
assign (resid 15 and name HB*) (resid 15 and name HG*) 2.7 0.9 2.0
assign (resid 15 and name HG*) (resid 15 and name HD*) 2.7 0.9 2.0
assign (resid 16 and name HB) (resid 16 and name HA) 3.3 1.5 0.0
assign (resid 16 and name HG1*) (resid 16 and name HB) 2.7 0.9 1.0
assign (resid 16 and name HG1*) (resid 16 and name HD#) 2.7 0.9 2.5
assign (resid 17 and name HA) (resid 17 and name HB*) 2.7 0.9 1.0
assign (resid 17 and name HA) (resid 17 and name HD*) 3.3 1.5 1.0
assign (resid 17 and name HA) (resid 17 and name HG*) 2.7 0.9 1.0
assign (resid 17 and name HD*) (resid 17 and name HB*) 3.3 1.5 2.0
assign (resid 18 and name HA) (resid 18 and name HG*) 2.7 0.9 1.0
assign (resid 19 and name HA) (resid 19 and name HB*) 2.7 0.9 1.0
!loosen to M 10/21
assign (resid 21 and name HA) (resid 21 and name HB) 3.3 1.5 0.0
assign (resid 21 and name HA) (resid 21 and name HG2#) 2.7 0.9 1.5
assign (resid 21 and name HA) (resid 21 and name HG1#) 2.7 0.9 1.5
assign (resid 21 and name HB) (resid 21 and name HG2#) 2.7 0.9 1.5
assign (resid 21 and name HB) (resid 21 and name HG1#) 2.7 0.9 1.5
assign (resid 22 and name HA) (resid 22 and name HB) 2.7 0.9 0.0
assign (resid 22 and name HA) (resid 22 and name HG2#) 2.7 0.9 1.5
assign (resid 22 and name HA) (resid 22 and name HG1#) 2.7 0.9 1.5
assign (resid 22 and name HB) (resid 22 and name HG2#) 2.7 0.9 1.5
assign (resid 22 and name HB) (resid 22 and name HG1#) 2.7 0.9 1.5
assign (resid 23 and name HA) (resid 23 and name HB*) 2.7 0.9 1.0
!assign (resid 24 and name HA) (resid 24 and name HB*) 2.7 0.9 1.0
assign (resid 26 and name HD2#) (resid 26 and name HB*) 2.7 0.9 2.5
assign (resid 26 and name HD1#) (resid 26 and name HB*) 2.7 0.9 2.5
assign (resid 27 and name HA) (resid 27 and name HB*) 2.7 0.9 1.0
assign (resid 28 and name HA) (resid 28 and name HB*) 2.7 0.9 1.0
!rem stereo 11/29
!assign (resid 29 and name HB2) (resid 29 and name HA) 3.3 1.5 0.0
assign (resid 29 and name HB*) (resid 29 and name HA) 3.3 1.5 1.0
!losened to M 11/29
assign (resid 29 and name HG*) (resid 29 and name HA) 3.3 1.5 1.0
assign (resid 30 and name HA) (resid 30 and name HB*) 2.7 0.9 1.0
assign (resid 31 and name HA) (resid 31 and name HG2#) 2.7 0.9 1.5
assign (resid 32 and name HA) (resid 32 and name HB*) 2.7 0.9 1.0
!changed from HG* to HD** 10/26
assign (resid 33 and name HB*) (resid 33 and name HD**) 2.7 0.9 3.5
assign (resid 34 and name HE*) (resid 34 and name HG*) 2.7 0.9 2.0
assign (resid 34 and name HG*) (resid 34 and name HB*) 2.7 0.9 2.0
!loosen to M 10/21
assign (resid 37 and name HA) (resid 37 and name HB) 3.3 1.5 0.0
assign (resid 37 and name HA) (resid 37 and name HG1#) 2.7 0.9 1.5
assign (resid 37 and name HA) (resid 37 and name HG2#) 2.7 0.9 1.5
assign (resid 37 and name HB) (resid 37 and name HG1#) 2.7 0.9 1.5
assign (resid 37 and name HB) (resid 37 and name HG2#) 2.7 0.9 1.5
assign (resid 37 and name HG2#) (resid 37 and name HG1#) 2.7 0.9 3.0
!loosen to M 10/21
assign (resid 38 and name HA) (resid 38 and name HB) 3.3 1.5 0.0
assign (resid 38 and name HA) (resid 38 and name HG1*) 2.7 0.9 1.0
assign (resid 38 and name HB) (resid 38 and name HG1*) 2.7 0.9 1.0
!assign (resid 39 and name HA) (resid 39 and name HB*) 2.7 0.9 1.0
!assign (resid 39 and name HB*) (resid 39 and name HD) 2.7 0.9 1.0
assign (resid 40 and name HA) (resid 40 and name HB) 3.3 1.5 0.0
assign (resid 40 and name HA) (resid 40 and name HG2#) 2.7 0.9 1.5
assign (resid 40 and name HB) (resid 40 and name HG2#) 2.7 0.9 1.5
assign (resid 41 and name HA) (resid 41 and name HB) 3.3 1.5 0.0
assign (resid 41 and name HA) (resid 41 and name HG2#) 2.7 0.9 1.5
assign (resid 41 and name HG2#) (resid 41 and name HB) 5.0 3.2 1.5
assign (resid 42 and name HA) (resid 42 and name HB*) 2.7 0.9 1.0
assign (resid 42 and name HA) (resid 42 and name HG*) 2.7 0.9 1.0
assign (resid 42 and name HB*) (resid 42 and name HE*) 2.7 0.9 2.0
!removed stereo 10/21
assign (resid 43 and name HB*) (resid 43 and name HA) 2.7 0.9 1.0
assign (resid 43 and name HB*) (resid 43 and name HE*) 3.3 1.5 2.0
!assign (resid 43 and name HB2) (resid 43 and name HA) 2.7 0.9 0.0
!assign (resid 43 and name HB2) (resid 43 and name HE*) 3.3 1.5 1.0
!assign (resid 43 and name HB1) (resid 43 and name HA) 2.7 0.9 0.0
!assign (resid 43 and name HB1) (resid 43 and name HE*) 5.0 3.2 1.0
assign (resid 45 and name HB*) (resid 45 and name HA) 5.0 3.2 1.0
assign (resid 46 and name HA) (resid 46 and name HB*) 2.7 0.9 1.0
assign (resid 46 and name HA) (resid 46 and name HG*) 2.7 0.9 1.0
assign (resid 47 and name HA) (resid 47 and name HB*) 2.7 0.9 1.0
assign (resid 48 and name HA) (resid 48 and name HB*) 2.7 0.9 1.0
assign (resid 50 and name HA) (resid 50 and name HB*) 2.7 0.9 1.0
!assign (resid 51 and name HB*) (resid 51 and name HA) 2.7 0.9 1.0
assign (resid 52 and name HA) (resid 52 and name HB*) 2.7 0.9 1.0
assign (resid 53 and name HA) (resid 53 and name HB*) 2.7 0.9 1.0
assign (resid 53 and name HA) (resid 53 and name HG*) 2.7 0.9 1.0
assign (resid 53 and name HB*) (resid 53 and name HG*) 2.7 0.9 2.0
assign (resid 54 and name HA) (resid 54 and name HB*) 2.7 0.9 1.0
assign (resid 54 and name HA) (resid 54 and name HG*) 2.7 0.9 1.0
assign (resid 54 and name HG*) (resid 54 and name HB*) 2.7 0.9 2.0
!assign (resid 55 and name HA) (resid 55 and name HB*) 2.7 0.9 1.0
!loosen to M 10/21
assign (resid 56 and name HA) (resid 56 and name HB) 3.3 1.5 0.0
assign (resid 56 and name HA) (resid 56 and name HG2#) 2.7 0.9 1.5
assign (resid 56 and name HA) (resid 56 and name HG1#) 2.7 0.9 1.5
assign (resid 56 and name HB) (resid 56 and name HG2#) 2.7 0.9 1.5
assign (resid 56 and name HB) (resid 56 and name HG1#) 2.7 0.9 1.5
assign (resid 56 and name HG2#) (resid 56 and name HG1#) 2.7 0.9 3.0
assign (resid 57 and name HA) (resid 57 and name HG*) 2.7 0.9 1.0
assign (resid 57 and name HB*) (resid 57 and name HA) 2.7 0.9 1.0
assign (resid 57 and name HB*) (resid 57 and name HG*) 2.7 0.9 2.0
assign (resid 58 and name HB*) (resid 58 and name HA) 2.7 0.9 1.0
assign (resid 58 and name HB*) (resid 58 and name HG*) 2.7 0.9 2.0
assign (resid 58 and name HG*) (resid 58 and name HA) 2.7 0.9 1.0
assign (resid 58 and name HG*) (resid 58 and name HD*) 2.7 0.9 2.0
!assign (resid 59 and name HA) (resid 59 and name HB2) 2.7 0.9 0.0
assign (resid 59 and name HA) (resid 59 and name HB*) 2.7 0.9 1.0
!assign (resid 60 and name HA) (resid 60 and name HB2) 2.7 0.9 0.0
!assign (resid 60 and name HA) (resid 60 and name HB1) 2.7 0.9 0.0
!assign (resid 60 and name HA) (resid 60 and name HB*) 2.7 0.9 1.0
assign (resid 60 and name HA) (resid 60 and name HG*) 2.7 0.9 1.0
!assign (resid 60 and name HB1) (resid 60 and name HB2) 2.7 0.9 0.0
!assign (resid 60 and name HB1) (resid 60 and name HG*) 2.7 0.9 1.0
!assign (resid 60 and name HG*) (resid 60 and name HB2) 2.7 0.9 1.0
!assign (resid 60 and name HG*) (resid 60 and name HB*) 2.7 0.9 2.0
assign (resid 61 and name HB*) (resid 61 and name HA) 2.7 0.9 1.0
assign (resid 61 and name HB*) (resid 61 and name HD*) 2.7 0.9 2.0
assign (resid 61 and name HB*) (resid 61 and name HG*) 2.7 0.9 2.0
assign (resid 62 and name HA) (resid 62 and name HB*) 2.7 0.9 1.0
assign (resid 63 and name HD2#) (resid 63 and name HA) 2.7 0.9 1.5
assign (resid 63 and name HD1#) (resid 63 and name HA) 3.3 1.5 1.5
assign (resid 63 and name HD1#) (resid 63 and name HD2#) 2.7 0.9 3.0
assign (resid 63 and name HG) (resid 63 and name HA) 2.7 0.9 0.0
assign (resid 63 and name HG) (resid 63 and name HD2#) 2.7 0.9 1.5
assign (resid 63 and name HG) (resid 63 and name HD1#) 2.7 0.9 1.5
assign (resid 64 and name HA) (resid 64 and name HB*) 2.7 0.9 1.0
assign (resid 65 and name HA) (resid 65 and name HB#) 2.7 0.9 1.5
assign (resid 66 and name HB#) (resid 66 and name HA) 2.7 0.9 1.5
assign (resid 67 and name HA) (resid 67 and name HB*) 2.7 0.9 1.0
assign (resid 67 and name HA) (resid 67 and name HG*) 2.7 0.9 1.0
assign (resid 67 and name HB*) (resid 67 and name HG*) 2.7 0.9 2.0
assign (resid 68 and name HG*) (resid 68 and name HA) 3.3 1.5 1.0
assign (resid 69 and name HG*) (resid 69 and name HA) 3.3 1.5 1.0
assign (resid 70 and name HA) (resid 70 and name HB#) 2.7 0.9 1.5
assign (resid 12 and name HB) (resid 12 and name HG**) 2.7 0.9 2.5
assign (resid 12 and name HG2#) (resid 12 and name HB) 2.7 0.9 1.5
assign (resid 18 and name HB*) (resid 18 and name HG*) 2.7 0.9 2.0
assign (resid 51 and name HA) (resid 51 and name HB*) 2.7 0.9 1.0
assign (resid 60 and name HA) (resid 60 and name HE#) 2.7 0.9 1.5
!assign (resid 60 and name HB*) (resid 60 and name HE#) 2.7 0.9 2.5
!assign (resid 60 and name HB2) (resid 60 and name HE#) 2.7 0.9 1.5
!assign (resid 60 and name HB1) (resid 60 and name HE#) 2.7 0.9 1.5
assign (resid 60 and name HG*) (resid 60 and name HE#) 5.0 3.2 2.5
assign (resid 9 and name HB*) (resid 9 and name HG*) 2.7 0.9 2.0
assign (resid 18 and name HA) (resid 18 and name HB*) 2.7 0.9 1.0
assign (resid 33 and name HA) (resid 33 and name HB*) 2.7 0.9 1.0
assign (resid 33 and name HA) (resid 33 and name HD**) 2.7 0.9 2.5
assign (resid 3 and name HD#) (resid 3 and name HG2#) 2.7 0.9 3.0
!assign (resid 3 and name HD#) (resid 3 and name HG1*) 2.7 0.9 2.5
!assign (resid 3 and name HG2#) (resid 3 and name HB) 2.7 0.9 1.5
!assign (resid 3 and name HG2#) (resid 3 and name HG1*) 2.7 0.9 2.5
assign (resid 15 and name HD*) (resid 15 and name HA) 3.3 1.5 1.0
assign (resid 16 and name HB) (resid 16 and name HD#) 2.7 0.9 1.5
assign (resid 16 and name HA) (resid 16 and name HG1*) 2.7 0.9 1.0
assign (resid 26 and name HA) (resid 26 and name HD2#) 2.7 0.9 1.5
!rem stereo 10/28
!assign (resid 63 and name HB2) (resid 63 and name HD2#) 2.7 0.9 1.5
!assign (resid 63 and name HB2) (resid 63 and name HD1#) 2.7 0.9 1.5
!assign (resid 63 and name HB2) (resid 63 and name HG) 2.7 0.9 0.0
!assign (resid 63 and name HB2) (resid 63 and name HA) 3.3 1.5 0.0
!assign (resid 63 and name HB1) (resid 63 and name HD2#) 2.7 0.9 1.5
!assign (resid 63 and name HB1) (resid 63 and name HD1#) 2.7 0.9 1.5
!assign (resid 63 and name HB1) (resid 63 and name HG) 3.3 1.5 0.0
!assign (resid 63 and name HB1) (resid 63 and name HB2) 2.7 0.9 0.0
!assign (resid 63 and name HB1) (resid 63 and name HA) 3.3 1.5 0.0
!assign (resid 63 and name HB*) (resid 63 and name HD2#) 2.7 0.9 2.5
!assign (resid 63 and name HB*) (resid 63 and name HD1#) 2.7 0.9 2.5
!assign (resid 63 and name HB*) (resid 63 and name HG) 2.7 0.9 1.0
!assign (resid 63 and name HB*) (resid 63 and name HA) 3.3 1.5 1.0
assign (resid 38 and name HD#) (resid 38 and name HG1*) 2.7 0.9 2.5
assign (resid 38 and name HD#) (resid 38 and name HB) 2.7 0.9 1.5
assign (resid 38 and name HD#) (resid 38 and name HA) 3.3 1.5 1.5
assign (resid 38 and name HG2#) (resid 38 and name HG1*) 2.7 0.9 2.5
assign (resid 38 and name HG2#) (resid 38 and name HB) 2.7 0.9 1.5
assign (resid 38 and name HG2#) (resid 38 and name HA) 3.3 1.5 1.5
!added stereo 12/13
!assign (resid 20 and name HB*) (resid 20 and name HA) 2.7 0.9 1.0
!assign (resid 20 and name HB*) (resid 20 and name HD*) 2.7 0.9 2.0
!assign (resid 20 and name HB*) (resid 20 and name HG*) 2.7 0.9 2.0
assign (resid 29 and name HD*) (resid 29 and name HG*) 2.7 0.9 2.0
!rem stereo 10/28
!assign (resid 29 and name HD*) (resid 29 and name HB2) 2.7 0.9 1.0
!assign (resid 29 and name HD*) (resid 29 and name HB1) 2.7 0.9 1.0
!loosen to M 11/29 rem 12/13 ol 20 b-d
!assign (resid 29 and name HD*) (resid 29 and name HB*) 3.3 1.5 2.0
!assign (resid 59 and name HB1) (resid 59 and name HA) 5.0 3.2 0.0
!assign (resid 59 and name HB1) (resid 59 and name HB2) 2.7 0.9 0.0
assign (resid 26 and name HA) (resid 26 and name HB*) 2.7 0.9 1.0
!c13_seq_1014.tbl
assign (resid 3 and name HA) (resid 4 and name HD*) 2.7 0.9 1.0
assign (resid 4 and name HD*) (resid 3 and name HG2#) 2.7 0.9 2.5
assign (resid 5 and name HA) (resid 6 and name HD*) 2.7 0.9 1.0
assign (resid 17 and name HD*) (resid 16 and name HA) 2.7 0.9 1.0
!assign (resid 17 and name HD*) (resid 16 and name HB) 5.0 3.2 1.0
!changed 11/09 from HD to HG2# based on 4d
assign (resid 17 and name HD*) (resid 16 and name HG2#) 2.7 0.9 2.5
!rem 10/19 dup
!assign (resid 18 and name HA) (resid 17 and name HA) 3.3 1.5 0.0
!rem 10/20
!assign (resid 18 and name HA) (resid 17 and name HD*) 2.7 0.9 1.0
assign (resid 23 and name HB*) (resid 22 and name HB) 3.3 1.5 1.0
!switched to M 10/22
assign (resid 23 and name HB*) (resid 22 and name HG2#) 3.3 1.5 2.5
!switched to M 10/26
assign (resid 23 and name HB*) (resid 22 and name HG1#) 3.3 1.5 2.5
assign (resid 30 and name HB*) (resid 31 and name HG2#) 3.3 1.5 2.5
!removed 11/05 back 11/08 rem again 11/22
!assign (resid 34 and name HG*) (resid 35 and name HA) 3.3 1.5 1.0
assign (resid 38 and name HA) (resid 37 and name HG1#) 5.0 3.2 1.5
assign (resid 40 and name HG2#) (resid 41 and name HA) 3.3 1.5 1.5
assign (resid 15 and name HA) (resid 16 and name HD#) 5.0 3.2 1.5
!rem 10/20 back 11/09 as W- looks W from spectra
assign (resid 17 and name HA) (resid 18 and name HA) 5.0 3.2 0.0
assign (resid 57 and name HA) (resid 56 and name HG1#) 3.3 1.5 1.5
assign (resid 3 and name HG2#) (resid 2 and name HA) 2.7 0.9 1.5
!changed from S to M 10/29
assign (resid 38 and name HD#) (resid 37 and name HG2#) 3.3 1.5 3.0
!c13_short_1014.tbl
assign (resid 21 and name HB) (resid 18 and name HA) 2.7 0.9 0.0
assign (resid 39 and name HA) (resid 37 and name HG1#) 5.0 3.2 1.5
assign (resid 44 and name HA*) (resid 40 and name HG2#) 2.7 0.9 2.5
assign (resid 53 and name HB*) (resid 56 and name HG2#) 2.7 0.9 2.5
assign (resid 54 and name HA) (resid 57 and name HB*) 2.7 0.9 0.0
assign (resid 55 and name HA) (resid 58 and name HB*) 2.7 0.9 1.0
!rem stereo 10/28
!assign (resid 56 and name HA) (resid 59 and name HB2) 2.7 0.9 0.0
!assign (resid 56 and name HA) (resid 59 and name HB1) 2.7 0.9 0.0
assign (resid 56 and name HA) (resid 59 and name HB*) 2.7 0.9 1.0
!rem stereo 10/28
!assign (resid 57 and name HA) (resid 60 and name HB2) 3.3 1.5 0.0
!assign (resid 57 and name HA) (resid 60 and name HB*) 3.3 1.5 1.0
assign (resid 59 and name HA) (resid 62 and name HB*) 2.7 0.9 1.0
!assign (resid 60 and name HB*) (resid 57 and name HA) 5.0 3.2 1.0
!assign (resid 60 and name HB1) (resid 57 and name HA) 5.0 3.2 0.0
assign (resid 62 and name HA) (resid 65 and name HB#) 2.7 0.9 1.5
!assign (resid 63 and name HD1#) (resid 60 and name HA) 5.0 3.2 1.5
!rem 11/02 do not see on 4d
!assign (resid 60 and name HE#) (resid 57 and name HA) 2.7 0.9 1.5
!removed 10/26 is 63d1 added 63 d1 10/26
!assign (resid 23 and name HA) (resid 21 and name HG1#) 2.7 0.9 1.5
!removed 10/26 is 63d1 added 63 d1 10/26
!assign (resid 24 and name HA) (resid 21 and name HG1#) 5.0 3.2 1.5
assign (resid 60 and name HE#) (resid 56 and name HG2#) 5.0 3.2 3.0
assign (resid 60 and name HE#) (resid 56 and name HG1#) 2.7 0.9 3.0
!removed 10/19 not sure I believe assignment back in 11/09 based on 4d
assign (resid 18 and name HA) (resid 21 and name HG2#) 2.7 0.9 1.5
assign (resid 53 and name HA) (resid 56 and name HG2#) 5.0 3.2 1.5
assign (resid 6 and name HD*) (resid 4 and name HD*) 2.7 0.9 2.0
assign (resid 12 and name HG**) (resid 16 and name HD#) 2.7 0.9 4.0
!loosened to M 12/08
assign (resid 55 and name HA) (resid 58 and name HG*) 3.3 1.5 1.0
assign (resid 55 and name HA) (resid 58 and name HD*) 2.7 0.9 1.0
!rem stereo 10/28
!assign (resid 63 and name HB2) (resid 60 and name HA) 3.3 1.5 0.0
!assign (resid 60 and name HA) (resid 63 and name HB1) 3.3 1.5 0.0
!assign (resid 60 and name HA) (resid 63 and name HB*) 3.3 1.5 1.0
assign (resid 61 and name HA) (resid 64 and name HB*) 2.7 0.9 1.0
assign (resid 65 and name HA) (resid 68 and name HB*) 5.0 3.2 1.0
!c13_long_1014.tbl
!set to W 10/19 from looking at spectrum
!rem 11/08 dont see on 4d
!assign (resid 21 and name HA) (resid 39 and name HA) 5.0 3.2 0.0
assign (resid 21 and name HA) (resid 41 and name HA) 2.7 0.9 0.0
assign (resid 24 and name HA) (resid 37 and name HG1#) 3.3 1.5 1.5
assign (resid 24 and name HA) (resid 39 and name HA) 2.7 0.9 0.0
!assign (resid 24 and name HB*) (resid 37 and name HG1#) 2.7 0.9 2.5
assign (resid 26 and name HA) (resid 37 and name HA) 2.7 0.9 0.0
assign (resid 26 and name HD2#) (resid 37 and name HG1#) 3.3 1.5 3.0
assign (resid 26 and name HD2#) (resid 37 and name HG2#) 2.7 0.9 3.0
assign (resid 37 and name HB) (resid 56 and name HG2#) 3.3 1.5 1.5
assign (resid 37 and name HB) (resid 56 and name HG1#) 2.7 0.9 1.5
assign (resid 39 and name HA) (resid 21 and name HG1#) 3.3 1.5 1.5
!assign (resid 39 and name HA) (resid 24 and name HB*) 2.7 0.9 1.0
assign (resid 40 and name HB) (resid 22 and name HG2#) 2.7 0.9 1.5
assign (resid 40 and name HB) (resid 22 and name HG1#) 5.0 3.2 1.5
assign (resid 40 and name HG2#) (resid 22 and name HG2#) 2.7 0.9 3.0
assign (resid 40 and name HG2#) (resid 46 and name HA) 3.3 1.5 1.5
assign (resid 41 and name HG2#) (resid 45 and name HB*) 2.7 0.9 2.5
assign (resid 42 and name HA) (resid 22 and name HG2#) 2.7 0.9 1.5
assign (resid 42 and name HA) (resid 22 and name HG1#) 2.7 0.9 1.5
assign (resid 46 and name HA) (resid 40 and name HA) 2.7 0.9 0.0
assign (resid 48 and name HA) (resid 38 and name HA) 2.7 0.9 0.0
assign (resid 49 and name HA*) (resid 56 and name HG2#) 2.7 0.9 2.5
assign (resid 49 and name HA*) (resid 56 and name HG1#) 5.0 3.2 2.5
!assign (resid 56 and name HB) (resid 51 and name HA) 2.7 0.9 0.0
!assign (resid 60 and name HG*) (resid 37 and name HG1#) 5.0 3.2 2.5
assign (resid 12 and name HG1#) (resid 47 and name HB*) 2.7 0.9 2.5
assign (resid 47 and name HB*) (resid 16 and name HD#) 2.7 0.9 2.5
!changed to M 10/22 
assign (resid 41 and name HA) (resid 22 and name HG2#) 3.3 1.5 1.5
!changed to M 10/22 
assign (resid 41 and name HA) (resid 22 and name HG1#) 3.3 1.5 1.5
assign (resid 51 and name HA) (resid 37 and name HG2#) 2.7 0.9 1.5
assign (resid 51 and name HA) (resid 56 and name HG2#) 3.3 1.5 1.5
assign (resid 51 and name HA) (resid 56 and name HG1#) 2.7 0.9 1.5
assign (resid 60 and name HE#) (resid 37 and name HG1#) 3.3 1.5 3.0
assign (resid 60 and name HE#) (resid 37 and name HG2#) 2.7 0.9 3.0
assign (resid 37 and name HG1#) (resid 56 and name HG1#) 2.7 0.9 3.0
assign (resid 37 and name HG2#) (resid 26 and name HG) 2.7 0.9 1.5
assign (resid 37 and name HG2#) (resid 56 and name HG1#) 2.7 0.9 3.0
!changed to M 10/22 
assign (resid 41 and name HA) (resid 21 and name HG1#) 3.3 1.5 1.5
assign (resid 49 and name HA*) (resid 12 and name HG**) 2.7 0.9 3.5
assign (resid 51 and name HB*) (resid 37 and name HG2#) 2.7 0.9 2.5
!assign (resid 39 and name HB*) (resid 16 and name HD#) 2.7 0.9 2.5
!assign (resid 39 and name HB*) (resid 21 and name HG1#) 3.3 1.5 2.5
assign (resid 21 and name HA) (resid 41 and name HG2#) 2.7 0.9 1.5
assign (resid 46 and name HB*) (resid 38 and name HG2#) 2.7 0.9 2.5
assign (resid 48 and name HA) (resid 38 and name HG2#) 2.7 0.9 1.5
assign (resid 38 and name HD#) (resid 27 and name HB*) 2.7 0.9 2.5
!removed 11/05 back 11/08
assign (resid 28 and name HA) (resid 35 and name HB#) 3.3 1.5 1.5
assign (resid 51 and name HA) (resid 56 and name HB) 2.7 0.9 0.0
assign (resid 26 and name HA) (resid 37 and name HG1#) 5.0 3.2 1.5
assign (resid 26 and name HA) (resid 37 and name HG2#) 2.7 0.9 1.5
assign (resid 38 and name HD#) (resid 48 and name HA) 5.0 3.2 1.5
!assign (resid 48 and name HA) (resid 38 and name HG2#) 2.7 0.9 1.5
assign (resid 11 and name HA) (resid 48 and name HB*) 3.3 1.5 1.0
!c13_from4d_1014.tbl
!removed for now- was removed in original file 10/14
!assign (resid 22 and name HG2#) (resid 42 and name HG*) 2.7 0.9 2.5
assign (resid 23 and name HA) (resid 63 and name HD2#) 2.7 0.9 1.5
assign (resid 47 and name HA) (resid 12 and name HG1#) 3.3 1.5 1.5
assign (resid 58 and name HB*) (resid 58 and name HD*) 2.7 0.9 2.0
!assign (resid 67 and name HG*) (resid 67 and name HB*) 2.7 0.9 2.0
assign (resid 72 and name HA) (resid 72 and name HB*) 2.7 0.9 1.0
assign (resid 72 and name HA) (resid 72 and name HG*) 2.7 0.9 1.0
assign (resid 72 and name HD*) (resid 72 and name HG*) 2.7 0.9 2.0
!
!
!added from 3d nulls 10/21
assign (resid 2 and name HG**) (resid 2 and name HA) 2.7 0.9 2.5
assign (resid 3 and name HB) (resid 3 and name HG2#) 2.7 0.9 1.5
assign (resid 3 and name HB) (resid 3 and name HG1*) 2.7 0.9 1.0
!assign (resid 3 and name HG2#) (resid 3 and name HB) 2.7 0.9 1.5
assign (resid 3 and name HG2#) (resid 3 and name HG1*) 2.7 0.9 2.5
assign (resid 9 and name HG*) (resid 10 and name HD*) 3.3 1.5 2.0
assign (resid 13 and name HA) (resid 12 and name HG**) 5.0 3.2 2.5
assign (resid 13 and name HB*) (resid 12 and name HG**) 5.0 3.2 3.5
!loosened to M 10/29
assign (resid 14 and name HA) (resid 12 and name HG**) 3.3 1.5 2.5
assign (resid 14 and name HA) (resid 14 and name HB*) 2.7 0.9 2.5
!assign (resid 15 and name HA) (resid 55 and name HZ2) 3.3 1.5 0.0
assign (resid 15 and name HA) (resid 12 and name HG**) 5.0 3.2 2.5
!added from nulls 10/22
assign (resid 16 and name HB) (resid 17 and name HD*) 2.7 0.9 1.0
!is S looks W add in as M
assign (resid 16 and name HG1*) (resid 59 and name HE*) 3.3 1.5 2.0
assign (resid 18 and name HB*) (resid 59 and name HE*) 3.3 1.5 2.0
assign (resid 18 and name HG*) (resid 59 and name HE*) 3.3 1.5 2.0
!added stereo 12/13
!assign (resid 20 and name HB*) (resid 41 and name HG2#) 3.3 1.5 2.5
!is S looks M
!assign (resid 20 and name HB*) (resid 16 and name HG2#) 3.3 1.5 2.5
!added fr0m 3d and nulls 10/26
assign (resid 22 and name HA) (resid 21 and name HG1#) 3.3 1.5 1.5
assign (resid 23 and name HA) (resid 63 and name HD1#) 2.7 0.9 1.5
assign (resid 24 and name HA) (resid 63 and name HD1#) 5.0 3.2 1.5
assign (resid 25 and name HB*) (resid 25 and name HA) 2.7 0.9 1.0
assign (resid 31 and name HB) (resid 31 and name HG2#) 2.7 0.9 1.5
!removed 11/05 back 11/08
assign (resid 35 and name HA) (resid 35 and name HB#) 2.7 0.9 1.5
assign (resid 36 and name HA*) (resid 51 and name HD*) 2.7 0.9 2.0
assign (resid 36 and name HA*) (resid 51 and name HG*) 3.3 1.5 2.0
assign (resid 36 and name HA*) (resid 37 and name HG2#) 3.3 1.5 2.5
!added from 3d 10/29
assign (resid 37 and name HG1#) (resid 60 and name HG*) 3.3 1.5 2.5
assign (resid 39 and name HA) (resid 38 and name HG2#) 3.3 1.5 1.5
!added from 3d 10/31
assign (resid 7 and name HA) (resid 38 and name HD#) 3.3 1.5 1.5
assign (resid 8 and name HB*) (resid 38 and name HD#) 5.0 3.2 2.5
assign (resid 49 and name HA*) (resid 39 and name HE*) 3.3 1.5 2.0
!assign (resid 46 and name HB*) (resid 38 and name HG2#) 2.7 0.9 2.5
assign (resid 51 and name HG*) (resid 37 and name HG2#) 2.7 0.9 2.5
!removed 11/05 back 11/08
assign (resid 51 and name HG*) (resid 35 and name HB#) 3.3 1.5 2.5
assign (resid 52 and name HA) (resid 52 and name HG*) 2.7 0.9 1.0
!added 11/02
assign (resid 66 and name HA) (resid 66 and name HG*) 3.3 1.5 1.0
assign (resid 66 and name HA) (resid 66 and name HD*) 3.3 1.5 1.0
assign (resid 59 and name HA) (resid 63 and name HD1#) 5.0 3.2 1.5
assign (resid 59 and name HB*) (resid 63 and name HD1#) 5.0 3.2 2.5
assign (resid 60 and name HA) (resid 63 and name HD1#) 3.3 1.5 1.5
!added 11/08 changed from 51a to 28b 11/0- rem 11/10
! is 27B* from structure 11/18
assign (resid 7 and name HA) (resid 27 and name HB*) 3.3 1.5 1.0
!loosened to W 11/10
assign (resid 15 and name HA) (resid 14 and name HB*) 5.0 3.2 1.0
!loosened to M 11/10 removed 11/11
!assign (resid 5 and name HA) (resid 4 and name HG*) 3.3 1.5 1.0
!added back from removed list 11/09
assign (resid 37 and name HA) (resid 26 and name HD2#) 2.7 0.9 0.5
assign (resid 27 and name HA) (resid 38 and name HD#) 5.0 3.2 0.5
!added 11/10
assign (resid 28 and name HB*) (resid 35 and name HB#) 3.3 1.5 2.5
assign (resid 28 and name HA) (resid 35 and name HA) 5.0 3.2 0.0
assign (resid 50 and name HA) (resid 11 and name HD*) 3.3 1.5 2.0
assign (resid 50 and name HA) (resid 11 and name HE*) 3.3 1.5 2.0
assign (resid 12 and name HB) (resid 55 and name HZ2) 5.0 3.2 1.0
!added 11/11
assign (resid 36 and name HA*) (resid 11 and name HE*) 2.7 0.9 3.0
assign (resid 35 and name HB*) (resid 11 and name HE*) 5.0 3.2 3.0
!added 11/12 loosened to W 11/18
assign (resid 41 and name HB) (resid 22 and name HG1#) 5.0 3.2 1.5
assign (resid 64 and name HA) (resid 67 and name HB*) 5.0 3.2 1.0
assign (resid 63 and name HA) (resid 66 and name HB*) 3.3 1.5 1.0
!added 11/22
assign (resid 71 and name HA) (resid 72 and name HD*) 2.7 0.9 1.0
!added 11/29
assign (resid 29 and name HD*) (resid 29 and name HA) 3.3 1.5 1.0
!added 11/30
assign (resid 6 and name HB*) (resid 38 and name HD#) 5.0 3.2 2.5
assign (resid 6 and name HG*) (resid 38 and name HD#) 3.3 1.5 2.5
assign (resid 11 and name HB*) (resid 50 and name HB*) 3.3 1.5 2.0
assign (resid 17 and name HD*) (resid 20 and name HD*) 3.3 1.5 2.0
assign (resid 17 and name HD*) (resid 20 and name HG*) 3.3 1.5 2.0
!loosened to W 12/01
assign (resid 30 and name HA) (resid 29 and name HA) 5.0 3.2 0.0
assign (resid 32 and name HA) (resid 33 and name HB*) 5.0 3.2 1.0
assign (resid 38 and name HG1*) (resid 27 and name HB*) 5.0 3.2 2.0
assign (resid 55 and name HA) (resid 59 and name HD*) 3.3 1.5 1.0
!assign (resid 55 and name HB*) (resid 59 and name HD*) 5.0 3.2 2.0
assign (resid 58 and name HB*) (resid 59 and name HD*) 3.3 1.5 2.0
assign (resid 58 and name HD*) (resid 59 and name HD*) 3.3 1.5 2.0
assign (resid 60 and name HG*) (resid 39 and name HE*) 3.3 1.5 2.0
assign (resid 60 and name HG*) (resid 39 and name HZ) 3.3 1.5 1.0
!added 12/06
assign (resid 3 and name HG2#) (resid 24 and name HD*) 3.3 1.5 3.5
assign (resid 51 and name HD*) (resid 11 and name HE*) 2.7 0.9 3.0
!added 12/07
! rem 12/09 dup
!assign (resid 16 and name HA) (resid 17 and name HD*) 2.7 0.9 1.0
assign (resid 3 and name HD#) (resid 38 and name HD#) 2.7 0.9 3.0
!loosen to W 12/13
assign (resid 4 and name HA) (resid 3 and name HG2#) 5.0 3.2 1.5
!rem 12/08 making 15 bad
!assign (resid 12 and name HG1#) (resid 16 and name HG1*) 2.7 0.9 2.5
!added 12/08
assign (resid 50 and name HB*) (resid 53 and name HB*) 3.3 1.5 2.0
assign (resid 22 and name HA) (resid 21 and name HA) 5.0 3.2 0.0
!rem 12/09 dup
!assign (resid 60 and name HG*) (resid 37 and name HG1#) 3.3 1.5 2.5
assign (resid 60 and name HG*) (resid 37 and name HG2#) 3.3 1.5 2.5
assign (resid 41 and name HB) (resid 45 and name HB*) 2.7 0.9 1.0
assign (resid 41 and name HA) (resid 20 and name HB*) 3.3 1.5 1.0
assign (resid 41 and name HA) (resid 42 and name HB*) 5.0 3.2 1.0
assign (resid 41 and name HG2#) (resid 16 and name HG2#) 2.7 0.9 3.0
assign (resid 50 and name HA) (resid 51 and name HG*) 3.3 1.5 1.0
assign (resid 52 and name HA) (resid 53 and name HA) 5.0 3.2 0.0
assign (resid 54 and name HA) (resid 53 and name HA) 5.0 3.2 0.0
!rem 1209 dup
!assign (resid 55 and name HD1) (resid 53 and name HB*) 3.3 1.5 1.0
!added 12/13 stereos
assign (resid 10 and name HA) (resid 10 and name HB1) 3.3 1.5 0.0
assign (resid 10 and name HA) (resid 10 and name HB2) 2.7 0.9 0.0
assign (resid 10 and name HB1) (resid 10 and name HD*) 2.7 0.9 2.0
assign (resid 10 and name HB2) (resid 10 and name HD*) 2.7 0.9 2.0
assign (resid 20 and name HB1) (resid 20 and name HA) 2.7 0.9 0.0
assign (resid 20 and name HB1) (resid 20 and name HD*) 2.7 0.9 1.0
assign (resid 20 and name HB1) (resid 20 and name HG*) 2.7 0.9 1.0
assign (resid 20 and name HB2) (resid 20 and name HA) 3.3 1.5 0.0
assign (resid 20 and name HB2) (resid 20 and name HD*) 2.7 0.9 1.0
assign (resid 20 and name HB2) (resid 20 and name HG*) 2.7 0.9 1.0
assign (resid 20 and name HB1) (resid 41 and name HG2#) 3.3 1.5 1.5
assign (resid 20 and name HB2) (resid 41 and name HG2#) 3.3 1.5 1.5
assign (resid 20 and name HB1) (resid 16 and name HG2#) 3.3 1.5 1.5
assign (resid 20 and name HB2) (resid 16 and name HG2#) 3.3 1.5 1.5
assign (resid 24 and name HA) (resid 24 and name HB1) 2.7 0.9 0.0
assign (resid 24 and name HA) (resid 24 and name HB2) 2.7 0.9 0.0
assign (resid 24 and name HB1) (resid 37 and name HG1#) 2.7 0.9 1.5
assign (resid 24 and name HB2) (resid 37 and name HG1#) 3.3 1.5 1.5
assign (resid 39 and name HA) (resid 24 and name HB1) 3.3 1.5 0.0
assign (resid 39 and name HA) (resid 24 and name HB2) 3.3 1.5 0.0
assign (resid 55 and name HA) (resid 55 and name HB1) 2.7 0.9 0.0
assign (resid 55 and name HA) (resid 55 and name HB2) 2.7 0.9 0.0
assign (resid 55 and name HB1) (resid 59 and name HD*) 5.0 3.2 1.0
assign (resid 55 and name HB2) (resid 59 and name HD*) 5.0 3.2 1.0
assign (resid 55 and name HD1) (resid 55 and name HB1) 5.0 3.2 0.0
assign (resid 55 and name HD1) (resid 55 and name HB2) 5.0 3.2 0.0
assign (resid 55 and name HE3) (resid 55 and name HB1) 5.0 3.2 0.0
assign (resid 55 and name HE3) (resid 55 and name HB2) 5.0 3.2 0.0
assign (resid 39 and name HA) (resid 39 and name HB1) 2.7 0.9 0.0
assign (resid 39 and name HB1) (resid 39 and name HD*) 3.3 1.5 2.0
assign (resid 39 and name HB1) (resid 16 and name HD#) 3.3 1.5 1.5
assign (resid 39 and name HB1) (resid 21 and name HG1#) 3.3 1.5 1.5
assign (resid 39 and name HB1) (resid 39 and name HE*) 3.3 1.5 2.0
assign (resid 39 and name HA) (resid 39 and name HB2) 3.3 1.5 0.0
assign (resid 39 and name HB2) (resid 39 and name HD*) 2.7 0.9 2.0
assign (resid 39 and name HB2) (resid 16 and name HD#) 2.7 0.9 1.5
assign (resid 39 and name HB2) (resid 21 and name HG1#) 3.3 1.5 1.5
assign (resid 39 and name HB2) (resid 39 and name HE*) 3.3 1.5 2.0
assign (resid 63 and name HB2) (resid 63 and name HD2#) 2.7 0.9 1.5
assign (resid 63 and name HB2) (resid 63 and name HD1#) 2.7 0.9 1.5
assign (resid 63 and name HB2) (resid 63 and name HG) 2.7 0.9 0.0
assign (resid 63 and name HB2) (resid 63 and name HA) 3.3 1.5 0.0
assign (resid 63 and name HB1) (resid 63 and name HD2#) 2.7 0.9 1.5
assign (resid 63 and name HB1) (resid 63 and name HD1#) 2.7 0.9 1.5
assign (resid 63 and name HB1) (resid 63 and name HG) 3.3 1.5 0.0
assign (resid 63 and name HB1) (resid 63 and name HB2) 2.7 0.9 0.0
assign (resid 63 and name HB1) (resid 63 and name HA) 3.3 1.5 0.0
assign (resid 63 and name HB2) (resid 60 and name HA) 3.3 1.5 0.0
assign (resid 60 and name HA) (resid 63 and name HB1) 3.3 1.5 0.0
assign (resid 60 and name HA) (resid 60 and name HB1) 2.7 0.9 0.0
!loosen to M 12/17
assign (resid 60 and name HA) (resid 60 and name HB2) 3.3 1.5 0.0
assign (resid 60 and name HB2) (resid 60 and name HG*) 2.7 0.9 1.0
assign (resid 60 and name HG*) (resid 60 and name HB1) 2.7 0.9 1.0
assign (resid 60 and name HB1) (resid 60 and name HE#) 2.7 0.9 1.5
assign (resid 60 and name HB2) (resid 60 and name HE#) 2.7 0.9 1.5
assign (resid 57 and name HA) (resid 60 and name HB1) 3.3 1.5 0.0
assign (resid 60 and name HB2) (resid 57 and name HA) 5.0 3.2 0.0
!new_aro_3d_1012.tbl
assign (resid 55 and name HZ2) (resid 55 and name HH2) 2.7 0.9 0.0
!assign (resid 55 and name HZ2) (resid 12 and name HG**) 2.7 0.9 2.5
assign (resid 55 and name HZ2) (resid 15 and name HA) 3.3 1.5 0.0
!assign (resid 55 and name HZ2) (resid 16 and name HD#) 3.3 1.5 1.5
!rem 10/20 do not see on 4d
!assign (resid 55 and name HZ2) (resid 56 and name HG1#) 3.3 1.5 1.5
!assign (resid 55 and name HZ2) (resid 56 and name HG2#) 2.7 0.9 1.5
!assign (resid 59 and name HE*) (resid 21 and name HG1#) 2.7 0.9 3.5
assign (resid 59 and name HE*) (resid 16 and name HB) 2.7 0.9 2.0
assign (resid 59 and name HE*) (resid 18 and name HA) 2.7 0.9 2.0
assign (resid 55 and name HZ3) (resid 16 and name HD#) 3.3 1.5 1.5
assign (resid 55 and name HZ3) (resid 55 and name HE3) 2.7 0.9 0.0
!assign (resid 55 and name HZ3) (resid 55 and name HH2) 2.7 0.9 0.0
!assign (resid 55 and name HE3) (resid 55 and name HZ3) 2.7 0.9 0.0
!set to W 10/13 was S insight says can't be <4.3 anyway and 15/15 viols
assign (resid 55 and name HE3) (resid 55 and name HH2) 5.0 3.2 0.0
!assign (resid 55 and name HH2) (resid 56 and name HG2#) 3.3 1.5 1.5
!assign (resid 55 and name HH2) (resid 16 and name HD#) 3.3 1.5 1.5
!assign (resid 55 and name HH2) (resid 12 and name HG**) 2.7 0.9 2.5
assign (resid 55 and name HH2) (resid 55 and name HZ3) 2.7 0.9 0.0
!assign (resid 55 and name HH2) (resid 55 and name HZ2) 2.7 0.9 0.0
!assign (resid 24 and name HD*) (resid 37 and name HG1#) 2.7 0.9 2.5
!assign (resid 24 and name HD*) (resid 26 and name HD2#) 2.7 0.9 2.5
!assign (resid 24 and name HD*) (resid 63 and name HD1#) 2.7 0.9 2.5
!rem stereo 10/28
assign (resid 24 and name HD*) (resid 63 and name HB*) 2.7 0.9 3.0
!assign (resid 24 and name HD*) (resid 63 and name HB1) 2.7 0.9 2.0
!set to W from S 10/22
assign (resid 24 and name HD*) (resid 63 and name HG) 5.0 3.2 2.0
assign (resid 24 and name HD*) (resid 24 and name HB*) 2.7 0.9 3.0
assign (resid 24 and name HD*) (resid 24 and name HE*) 2.7 0.9 3.0
!assign (resid 39 and name HD*) (resid 16 and name HD#) 2.7 0.9 3.5
!assign (resid 39 and name HD*) (resid 63 and name HD1#) 2.7 0.9 3.5
assign (resid 39 and name HD*) (resid 24 and name HB*) 3.3 1.5 3.0
!assign (resid 39 and name HD*) (resid 39 and name HB*) 2.7 0.9 3.0
!assign (resid 39 and name HD*) (resid 39 and name HA) 3.3 1.5 2.0
!assign (resid 39 and name HD*) (resid 39 and name HE*) 2.7 0.9 3.0
!assign (resid 59 and name HD*) (resid 21 and name HG1#) 2.7 0.9 3.5
!assign (resid 59 and name HD*) (resid 21 and name HG2#) 2.7 0.9 3.5
!assign (resid 39 and name HE*) (resid 56 and name HG2#) 3.3 1.5 3.5
!assign (resid 39 and name HE*) (resid 37 and name HG1#) 3.3 1.5 3.5
!assign (resid 39 and name HE*) (resid 56 and name HG1#) 2.7 0.9 3.5
!assign (resid 39 and name HE*) (resid 16 and name HD#) 3.3 1.5 3.5
assign (resid 39 and name HE*) (resid 56 and name HA) 3.3 1.5 2.0
assign (resid 39 and name HE*) (resid 39 and name HD*) 2.7 0.9 3.0
!assign (resid 39 and name HZ) (resid 37 and name HG1#) 3.3 1.5 1.5
!assign (resid 39 and name HZ) (resid 56 and name HG1#) 3.3 1.5 1.5
assign (resid 39 and name HZ) (resid 56 and name HA) 5.0 3.2 0.0
!
!c13_f10f11_1014.tbl
assign (resid 9 and name HB*) (resid 10 and name HD*) 5.0 3.2 3.0
assign (resid 12 and name HA) (resid 10 and name HD*) 3.3 1.5 2.0
assign (resid 11 and name HA) (resid 11 and name HD*) 2.7 0.9 2.0
!removed 11/04 as a test- sees weak 11/06 prob OK 
assign (resid 50 and name HB*) (resid 11 and name HD*) 3.3 1.5 3.0
assign (resid 9 and name HB*) (resid 10 and name HE*) 5.0 3.2 3.0
assign (resid 12 and name HA) (resid 10 and name HE*) 3.3 1.5 2.0
!set to M 10/20
assign (resid 11 and name HA) (resid 11 and name HE*) 3.3 1.5 2.0
!rem 11/08 back in 11/10 as E* -not yet
!assign (resid 36 and name HA*) (resid 11 and name HE*) 2.7 0.9 3.0
!c13_aro_1014.tbl
assign (resid 24 and name HD*) (resid 60 and name HA) 5.0 3.2 2.0
assign (resid 63 and name HG) (resid 24 and name HE*) 5.0 3.2 2.0
assign (resid 39 and name HD*) (resid 39 and name HA) 3.3 1.5 2.0
assign (resid 39 and name HD*) (resid 24 and name HA) 3.3 1.5 2.0
assign (resid 49 and name HA*) (resid 39 and name HD*) 5.0 3.2 3.0
!loosen to W 10/21
assign (resid 55 and name HA) (resid 55 and name HD1) 5.0 3.2 0.0
!assign (resid 55 and name HD1) (resid 55 and name HB*) 5.0 3.2 1.0
assign (resid 53 and name HB*) (resid 55 and name HD1) 3.3 1.5 1.0
!assign (resid 56 and name HG2#) (resid 55 and name HH2) 5.0 3.2 1.5
assign (resid 16 and name HB) (resid 55 and name HZ3) 5.0 3.2 0.0
assign (resid 56 and name HA) (resid 55 and name HZ3) 5.0 3.2 0.0
assign (resid 56 and name HA) (resid 55 and name HE3) 3.3 1.5 0.0
!assign (resid 55 and name HE3) (resid 55 and name HB*) 5.0 3.2 1.0
assign (resid 55 and name HA) (resid 55 and name HE3) 5.0 3.2 0.0
assign (resid 59 and name HE*) (resid 55 and name HE3) 3.3 1.5 2.0
assign (resid 59 and name HE*) (resid 55 and name HZ3) 3.3 1.5 2.0
!assign (resid 26 and name HD2#) (resid 24 and name HE*) 2.7 0.9 2.5
assign (resid 24 and name HA) (resid 24 and name HD*) 3.3 1.5 2.0
assign (resid 60 and name HE#) (resid 24 and name HE*) 2.7 0.9 3.5
assign (resid 24 and name HA) (resid 39 and name HE*) 3.3 1.5 2.0
assign (resid 37 and name HB) (resid 39 and name HE*) 3.3 1.5 2.0
!assign (resid 39 and name HB*) (resid 39 and name HE*) 3.3 1.5 3.0
!rem stereo 10/28
!assign (resid 59 and name HB1) (resid 39 and name HE*) 2.7 0.9 1.0
!assign (resid 59 and name HB2) (resid 39 and name HE*) 2.7 0.9 1.0
!assign (resid 59 and name HB2) (resid 39 and name HZ) 3.3 1.5 0.0
!assign (resid 59 and name HB1) (resid 39 and name HZ) 2.7 0.9 0.0
!assign (resid 59 and name HB2) (resid 59 and name HD*) 2.7 0.9 1.0
!assign (resid 59 and name HB1) (resid 59 and name HD*) 2.7 0.9 1.0
assign (resid 59 and name HB*) (resid 39 and name HE*) 2.7 0.9 3.0
assign (resid 59 and name HB*) (resid 39 and name HZ) 2.7 0.9 1.0
assign (resid 59 and name HB*) (resid 59 and name HD*) 2.7 0.9 3.0
!1201_aro_4d_noe.tbl
assign (resid 26 and name HD1#) (resid 24 and name HD*) 2.7 0.9 3.5
assign (resid 26 and name HD2#) (resid 24 and name HD*) 2.7 0.9 3.5
assign (resid 63 and name HD2#) (resid 24 and name HD*) 2.7 0.9 3.5
assign (resid 37 and name HG1#) (resid 24 and name HD*) 2.7 0.9 3.5
assign (resid 37 and name HG2#) (resid 24 and name HD*) 2.7 0.9 3.5
assign (resid 63 and name HD1#) (resid 24 and name HD*) 2.7 0.9 3.5
assign (resid 26 and name HD1#) (resid 24 and name HE*) 2.7 0.9 3.5
assign (resid 26 and name HD2#) (resid 24 and name HE*) 2.7 0.9 3.5
assign (resid 63 and name HD2#) (resid 24 and name HE*) 2.7 0.9 3.5
assign (resid 37 and name HG1#) (resid 24 and name HE*) 2.7 0.9 3.5
!loosened to M 12/04
assign (resid 37 and name HG2#) (resid 24 and name HE*) 3.3 1.5 3.5
assign (resid 16 and name HD#) (resid 39 and name HD*) 2.7 0.9 3.5
assign (resid 21 and name HG1#) (resid 39 and name HD*) 2.7 0.9 3.5
!loosened to M 12/04
assign (resid 21 and name HG2#) (resid 39 and name HD*) 3.3 1.5 3.5
!loosened to M 12/04
assign (resid 37 and name HG1#) (resid 39 and name HD*) 3.3 1.5 3.5
!loosened to M 12/04
assign (resid 56 and name HG2#) (resid 39 and name HD*) 3.3 1.5 3.5
assign (resid 63 and name HD1#) (resid 39 and name HD*) 2.7 0.9 3.5
assign (resid 16 and name HD#) (resid 39 and name HE*) 2.7 0.9 3.5
assign (resid 21 and name HG1#) (resid 39 and name HE*) 2.7 0.9 3.5
assign (resid 37 and name HG1#) (resid 39 and name HE*) 2.7 0.9 3.5
assign (resid 56 and name HG1#) (resid 39 and name HE*) 2.7 0.9 3.5
assign (resid 56 and name HG2#) (resid 39 and name HE*) 2.7 0.9 3.5
assign (resid 63 and name HD1#) (resid 39 and name HE*) 2.7 0.9 3.5
assign (resid 37 and name HG1#) (resid 39 and name HZ) 2.7 0.9 1.5
assign (resid 56 and name HG1#) (resid 39 and name HZ) 2.7 0.9 1.5
!removed 12/03- had been removed 10/13 for always violating
!assign (resid 38 and name HG2#) (resid 55 and name HE3) 2.7 0.9 1.5
assign (resid 56 and name HG2#) (resid 55 and name HE3) 2.7 0.9 1.5
assign (resid 12 and name HG1#) (resid 55 and name HH2) 2.7 0.9 1.5
assign (resid 12 and name HG2#) (resid 55 and name HH2) 2.7 0.9 1.5
assign (resid 16 and name HD#) (resid 55 and name HH2) 2.7 0.9 1.5
assign (resid 56 and name HG2#) (resid 55 and name HH2) 2.7 0.9 1.5
assign (resid 12 and name HG1#) (resid 55 and name HZ2) 2.7 0.9 1.5
assign (resid 12 and name HG2#) (resid 55 and name HZ2) 2.7 0.9 1.5
!loosened to M 12/04
assign (resid 16 and name HD#) (resid 55 and name HZ2) 3.3 1.5 1.5
assign (resid 56 and name HG2#) (resid 55 and name HZ2) 2.7 0.9 1.5
assign (resid 21 and name HG1#) (resid 59 and name HD*) 2.7 0.9 3.5
assign (resid 21 and name HG2#) (resid 59 and name HD*) 2.7 0.9 3.5
assign (resid 16 and name HG2#) (resid 59 and name HE*) 2.7 0.9 3.5
assign (resid 16 and name HD#) (resid 59 and name HE*) 2.7 0.9 3.5
assign (resid 21 and name HG1#) (resid 59 and name HE*) 2.7 0.9 3.5
assign (resid 21 and name HG2#) (resid 59 and name HE*) 2.7 0.9 3.5
assign (resid 12 and name HG2#) (resid 11 and name HE*) 2.7 0.9 3.5
assign (resid 12 and name HG1#) (resid 10 and name HE*) 2.7 0.9 3.5
!15N restraints
assign (resid 2 and name HN) (resid 2 and name HA) 5.0 3.2 0.2
assign (resid 2 and name HN) (resid 2 and name HB) 3.3 1.5 0.2
assign (resid 3 and name HN) (resid 3 and name HA) 5.0 3.2 0.2
assign (resid 3 and name HN) (resid 3 and name HB) 2.7 0.9 0.2
assign (resid 3 and name HN) (resid 3 and name HD#) 3.3 1.5 1.7
!loosened to W 9/17
assign (resid 3 and name HN) (resid 3 and name HG1*) 5.0 3.2 1.2
!removed 9/8 dup
!assign (resid 3 and name HN) (resid 3 and name HG1*) 5.0 3.2 1.2
assign (resid 8 and name HN) (resid 8 and name HA) 3.3 1.5 0.2
!assign (resid 8 and name HN) (resid 8 and name HB*) 3.3 1.5 1.2
assign (resid 9 and name HN) (resid 9 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 9 and name HN) (resid 9 and name HB*) 3.3 1.5 1.2
assign (resid 9 and name HN) (resid 9 and name HG*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 9 and name HN) (resid 9 and name HG*) 3.3 1.5 1.2
!assign (resid 10 and name HN) (resid 10 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 10 and name HN) (resid 10 and name HB*) 5.0 3.2 1.2
assign (resid 11 and name HN) (resid 11 and name HA) 5.0 3.2 0.2
assign (resid 12 and name HN) (resid 12 and name HA) 3.3 1.5 0.2
assign (resid 12 and name HN) (resid 12 and name HB) 3.3 1.5 0.2
assign (resid 12 and name HN) (resid 12 and name HG**) 2.7 0.9 2.7
assign (resid 13 and name HN) (resid 13 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 13 and name HN) (resid 13 and name HB*) 3.3 1.5 1.2
assign (resid 14 and name HN) (resid 14 and name HA) 3.3 1.5 0.2
assign (resid 14 and name HN) (resid 14 and name HB*) 2.7 0.9 1.2
assign (resid 15 and name HN) (resid 15 and name HA) 3.3 1.5 0.2
!rem stereo 10/28
!assign (resid 15 and name HN) (resid 15 and name HB1) 2.7 0.9 0.2
assign (resid 15 and name HN) (resid 15 and name HB*) 2.7 0.9 1.2
assign (resid 15 and name HN) (resid 15 and name HG*) 3.3 1.5 1.2
assign (resid 16 and name HN) (resid 16 and name HA) 5.0 3.2 0.2
assign (resid 16 and name HN) (resid 16 and name HB) 5.0 3.2 0.2
assign (resid 16 and name HN) (resid 16 and name HD#) 5.0 3.2 1.7
assign (resid 16 and name HN) (resid 16 and name HG11) 5.0 3.2 0.2
assign (resid 16 and name HN) (resid 16 and name HG12) 5.0 3.2 0.2
assign (resid 18 and name HN) (resid 18 and name HA) 3.3 1.5 0.2
assign (resid 18 and name HN) (resid 18 and name HG*) 3.3 1.5 1.2
assign (resid 19 and name HN) (resid 19 and name HA) 2.7 0.9 0.2
assign (resid 19 and name HN) (resid 19 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 19 and name HN) (resid 19 and name HB*) 3.3 1.5 1.2
!assign (resid 20 and name HN) (resid 20 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 20 and name HN) (resid 20 and name HB*) 3.3 1.5 1.2
assign (resid 20 and name HN) (resid 20 and name HG*) 2.7 0.9 1.2
assign (resid 21 and name HN) (resid 21 and name HA) 3.3 1.5 0.2
assign (resid 21 and name HN) (resid 21 and name HG2#) 2.7 0.9 1.7
assign (resid 21 and name HN) (resid 21 and name HG1#) 3.3 1.5 1.7
assign (resid 22 and name HN) (resid 22 and name HA) 3.3 1.5 0.2
assign (resid 22 and name HN) (resid 22 and name HB) 3.3 1.5 0.2
assign (resid 23 and name HN) (resid 23 and name HB*) 2.7 0.9 1.2
assign (resid 24 and name HN) (resid 24 and name HA) 3.3 1.5 0.2
!assign (resid 24 and name HN) (resid 24 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 24 and name HN) (resid 24 and name HB*) 5.0 3.2 1.2
assign (resid 25 and name HN) (resid 25 and name HA) 3.3 1.5 0.2
assign (resid 25 and name HN) (resid 25 and name HB*) 2.7 0.9 1.2
assign (resid 26 and name HN) (resid 26 and name HA) 3.3 1.5 0.2
assign (resid 26 and name HN) (resid 26 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 26 and name HN) (resid 26 and name HB*) 2.7 0.9 1.2
assign (resid 27 and name HN) (resid 27 and name HA) 2.7 0.9 0.2
assign (resid 27 and name HN) (resid 27 and name HB*) 2.7 0.9 1.2
assign (resid 28 and name HN) (resid 28 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 28 and name HN) (resid 28 and name HB*) 3.3 1.5 1.2
assign (resid 29 and name HN) (resid 29 and name HA) 5.0 3.2 0.2
!rem stereo 10/28
!assign (resid 29 and name HN) (resid 29 and name HB2) 3.3 1.5 0.2
!assign (resid 29 and name HN) (resid 29 and name HB1) 3.3 1.5 0.2
assign (resid 29 and name HN) (resid 29 and name HB*) 3.3 1.5 1.2
assign (resid 29 and name HN) (resid 29 and name HG*) 3.3 1.5 1.2
assign (resid 30 and name HN) (resid 30 and name HA) 3.3 1.5 0.2
assign (resid 30 and name HN) (resid 30 and name HB*) 3.3 1.5 1.2
assign (resid 31 and name HN) (resid 31 and name HG2#) 3.3 1.5 1.7
assign (resid 32 and name HN) (resid 32 and name HA) 3.3 1.5 0.2
assign (resid 32 and name HN) (resid 32 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 32 and name HN) (resid 32 and name HB*) 3.3 1.5 1.2
assign (resid 32 and name HN) (resid 33 and name HN) 5.0 3.2 0.4
assign (resid 33 and name HN) (resid 32 and name HA) 2.7 0.9 0.2
!removed 9/8 dup
!assign (resid 33 and name HN) (resid 32 and name HB*) 5.0 3.2 1.2
assign (resid 33 and name HN) (resid 32 and name HB*) 3.3 1.5 1.2
assign (resid 33 and name HN) (resid 33 and name HA) 2.7 0.9 0.2
assign (resid 33 and name HN) (resid 33 and name HD**) 3.3 1.5 2.7
assign (resid 34 and name HN) (resid 34 and name HA) 5.0 3.2 0.2
assign (resid 34 and name HN) (resid 34 and name HG*) 5.0 3.2 1.2
!rem 11/05 back 11/08
assign (resid 35 and name HN) (resid 35 and name HB#) 2.7 0.9 1.7
assign (resid 36 and name HN) (resid 36 and name HA1) 3.3 1.5 0.2
assign (resid 36 and name HN) (resid 36 and name HA2) 3.3 1.5 0.2
!changed 9/3 from 2.7 0.9 0.2 to M kept being viol
assign (resid 37 and name HN) (resid 37 and name HB) 3.3 1.5 0.2
assign (resid 37 and name HN) (resid 37 and name HG1#) 3.3 1.5 1.7
assign (resid 37 and name HN) (resid 37 and name HG2#) 2.7 0.9 1.7
assign (resid 38 and name HN) (resid 38 and name HA) 5.0 3.2 0.2
assign (resid 38 and name HN) (resid 38 and name HB) 2.7 0.9 0.2
assign (resid 39 and name HN) (resid 39 and name HA) 3.3 1.5 0.2
assign (resid 39 and name HN) (resid 39 and name HB*) 2.7 0.9 1.2
assign (resid 40 and name HN) (resid 40 and name HA) 2.7 0.9 0.2
assign (resid 41 and name HN) (resid 41 and name HA) 2.7 0.9 0.2
assign (resid 41 and name HN) (resid 41 and name HB) 2.7 0.9 0.2
assign (resid 44 and name HN) (resid 44 and name HA1) 2.7 0.9 0.2
assign (resid 44 and name HN) (resid 44 and name HA2) 2.7 0.9 0.2
assign (resid 45 and name HN) (resid 45 and name HA) 3.3 1.5 0.2
assign (resid 45 and name HN) (resid 45 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 45 and name HN) (resid 45 and name HB*) 3.3 1.5 1.2
assign (resid 45 and name HN) (resid 45 and name HG*) 3.3 1.5 1.2
assign (resid 47 and name HN) (resid 47 and name HA) 3.3 1.5 0.2
assign (resid 47 and name HN) (resid 47 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 47 and name HN) (resid 47 and name HB*) 5.0 3.2 1.2
assign (resid 48 and name HN) (resid 48 and name HA) 3.3 1.5 0.2
assign (resid 48 and name HN) (resid 48 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 48 and name HN) (resid 48 and name HB*) 2.7 0.9 1.2
assign (resid 49 and name HN) (resid 49 and name HA1) 2.7 0.9 0.2
assign (resid 49 and name HN) (resid 49 and name HA2) 3.3 1.5 0.2
assign (resid 50 and name HN) (resid 50 and name HA) 3.3 1.5 0.2
assign (resid 50 and name HN) (resid 50 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 50 and name HN) (resid 50 and name HB*) 2.7 0.9 1.2
assign (resid 52 and name HN) (resid 52 and name HA) 2.7 0.9 0.2
assign (resid 53 and name HN) (resid 53 and name HA) 3.3 1.5 0.2
assign (resid 53 and name HN) (resid 53 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 53 and name HN) (resid 53 and name HB*) 2.7 0.9 1.2
assign (resid 53 and name HN) (resid 53 and name HG*) 2.7 0.9 1.2
assign (resid 54 and name HN) (resid 54 and name HA) 3.3 1.5 0.2
assign (resid 54 and name HN) (resid 54 and name HB*) 2.7 0.9 1.2
assign (resid 54 and name HN) (resid 54 and name HG*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 54 and name HN) (resid 54 and name HG*) 5.0 3.2 1.2
assign (resid 55 and name HN) (resid 55 and name HA) 3.3 1.5 0.2
!assign (resid 55 and name HN) (resid 55 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 55 and name HN) (resid 55 and name HB*) 2.7 0.9 1.2
assign (resid 55 and name HN) (resid 55 and name HD1) 2.7 0.9 0.2
assign (resid 55 and name HN) (resid 55 and name HE1) 5.0 3.2 0.2
assign (resid 56 and name HN) (resid 56 and name HA) 3.3 1.5 0.2
assign (resid 56 and name HN) (resid 56 and name HB) 2.7 0.9 0.2
assign (resid 56 and name HN) (resid 56 and name HG2#) 2.7 0.9 1.7
assign (resid 56 and name HN) (resid 56 and name HG1#) 3.3 1.5 1.7
assign (resid 56 and name HN) (resid 57 and name HA) 5.0 3.2 0.2
assign (resid 57 and name HN) (resid 56 and name HA) 5.0 3.2 0.2
assign (resid 57 and name HN) (resid 56 and name HB) 2.7 0.9 0.2
assign (resid 57 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
assign (resid 57 and name HN) (resid 56 and name HG1#) 3.3 1.5 1.7
assign (resid 57 and name HN) (resid 57 and name HA) 2.7 0.9 0.2
assign (resid 57 and name HN) (resid 57 and name HB*) 2.7 0.9 1.2
assign (resid 57 and name HN) (resid 57 and name HG*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 57 and name HN) (resid 57 and name HG*) 2.7 0.9 1.2
assign (resid 58 and name HN) (resid 58 and name HA) 2.7 0.9 0.2
!loosen to M 12/06
assign (resid 58 and name HN) (resid 58 and name HG*) 3.3 1.5 1.2
assign (resid 59 and name HN) (resid 59 and name HA) 3.3 1.5 0.2
assign (resid 59 and name HN) (resid 59 and name HB*) 2.7 0.9 1.2
!assign (resid 59 and name HN) (resid 59 and name HB2) 2.7 0.9 0.2
!assign (resid 59 and name HN) (resid 59 and name HB1) 2.7 0.9 0.2
assign (resid 60 and name HN) (resid 60 and name HA) 3.3 1.5 0.2
!assign (resid 60 and name HN) (resid 60 and name HB*) 2.7 0.9 1.2
!assign (resid 60 and name HN) (resid 60 and name HB2) 2.7 0.9 0.2
assign (resid 60 and name HN) (resid 60 and name HG*) 2.7 0.9 1.2
assign (resid 61 and name HN) (resid 61 and name HA) 2.7 0.9 0.2
assign (resid 62 and name HN) (resid 62 and name HA) 2.7 0.9 0.2
!removed 9/8 dup
!assign (resid 62 and name HN) (resid 62 and name HB*) 3.3 1.5 1.2
assign (resid 62 and name HN) (resid 62 and name HB*) 2.7 0.9 1.2
assign (resid 63 and name HN) (resid 63 and name HA) 3.3 1.5 0.2
!removed 9/8 dup
!assign (resid 63 and name HN) (resid 63 and name HB*) 3.3 1.5 1.2
!assign (resid 63 and name HN) (resid 63 and name HB*) 2.7 0.9 1.2
assign (resid 63 and name HN) (resid 63 and name HD2#) 3.3 1.5 1.7
assign (resid 63 and name HN) (resid 63 and name HD1#) 3.3 1.5 1.7
assign (resid 63 and name HN) (resid 63 and name HG) 2.7 0.9 0.2
assign (resid 64 and name HN) (resid 64 and name HA) 3.3 1.5 0.2
assign (resid 64 and name HN) (resid 64 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 64 and name HN) (resid 64 and name HB*) 2.7 0.9 1.2
assign (resid 65 and name HN) (resid 65 and name HA) 3.3 1.5 0.2
assign (resid 65 and name HN) (resid 65 and name HB#) 2.7 0.9 1.7
assign (resid 66 and name HN) (resid 66 and name HB*) 2.7 0.9 1.2
!very OL loosened to M 11/18
assign (resid 66 and name HN) (resid 66 and name HG*) 5.0 3.2 1.2
assign (resid 67 and name HN) (resid 67 and name HB*) 2.7 0.9 1.2
assign (resid 67 and name HN) (resid 67 and name HG*) 5.0 3.2 1.2
assign (resid 68 and name HN) (resid 68 and name HB*) 2.7 0.9 1.2
assign (resid 68 and name HN) (resid 68 and name HG*) 3.3 1.5 1.2
assign (resid 69 and name HN) (resid 69 and name HB*) 2.7 0.9 1.2
assign (resid 69 and name HN) (resid 69 and name HG*) 3.3 1.5 1.2
assign (resid 70 and name HN) (resid 70 and name HB#) 2.7 0.9 1.7
!
!
!added 10/4 from 3d h20 15n nulls
assign (resid 22 and name HN) (resid 22 and name HG2#) 2.7 0.9 1.7
assign (resid 2 and name HN) (resid 2 and name HG*) 3.3 1.5 1.2
assign (resid 26 and name HN) (resid 26 and name HD2#) 3.3 1.5 1.7
assign (resid 38 and name HN) (resid 38 and name HG1*) 3.3 1.5 1.2
!loosen to M 11/29
assign (resid 8 and name HN) (resid 8 and name HB*) 3.3 1.5 1.2
assign (resid 11 and name HN) (resid 11 and name HB*) 2.7 0.9 1.2
assign (resid 14 and name HN) (resid 14 and name HG*) 2.7 0.9 1.2
assign (resid 18 and name HN) (resid 18 and name HB*) 2.7 0.9 1.2
!
!15n restraints
assign (resid 2 and name HN) (resid 1 and name HA) 2.7 0.9 0.2
assign (resid 3 and name HN) (resid 2 and name HA) 2.7 0.9 0.2
assign (resid 5 and name HN) (resid 4 and name HA) 3.3 1.5 0.2
!rem both 11/29
!assign (resid 7 and name HN) (resid 6 and name HA) 2.7 0.9 0.2
!assign (resid 7 and name HN) (resid 6 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 7 and name HN) (resid 6 and name HB*) 5.0 3.2 1.2
assign (resid 8 and name HN) (resid 7 and name HA) 2.7 0.9 0.2
assign (resid 8 and name HN) (resid 7 and name HB*) 3.3 1.5 1.2
assign (resid 9 and name HN) (resid 10 and name HN) 3.3 1.5 0.4
!rem 11/29
!assign (resid 9 and name HN) (resid 8 and name HA) 2.7 0.9 0.2
assign (resid 10 and name HN) (resid 9 and name HB*) 5.0 3.2 1.2
assign (resid 10 and name HN) (resid 9 and name HG*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 10 and name HN) (resid 9 and name HG*) 5.0 3.2 12
assign (resid 11 and name HN) (resid 10 and name HA) 2.7 0.9 0.2
assign (resid 11 and name HN) (resid 10 and name HN) 5.0 3.2 0.4
assign (resid 11 and name HN) (resid 12 and name HN) 5.0 3.2 0.4
assign (resid 12 and name HN) (resid 11 and name HA) 2.7 0.9 0.2
assign (resid 12 and name HN) (resid 11 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 12 and name HN) (resid 11 and name HB*) 3.3 1.5 1.2
assign (resid 13 and name HN) (resid 12 and name HA) 2.7 0.9 0.2
assign (resid 13 and name HN) (resid 12 and name HB) 3.3 1.5 0.2
assign (resid 13 and name HN) (resid 12 and name HG**) 3.3 1.5 2.7
assign (resid 13 and name HN) (resid 14 and name HN) 2.7 0.9 0.4
assign (resid 14 and name HN) (resid 13 and name HA) 3.3 1.5 0.2
assign (resid 14 and name HN) (resid 13 and name HB*) 3.3 1.5 1.2
assign (resid 15 and name HN) (resid 14 and name HA) 2.7 0.9 0.2
assign (resid 15 and name HN) (resid 14 and name HB*) 2.7 0.9 1.2
assign (resid 15 and name HN) (resid 14 and name HN) 5.0 3.2 0.4
assign (resid 16 and name HN) (resid 15 and name HA) 2.7 0.9 0.2
assign (resid 18 and name HN) (resid 17 and name HA) 2.7 0.9 0.2
assign (resid 18 and name HN) (resid 17 and name HB*) 3.3 1.5 1.2
assign (resid 18 and name HN) (resid 19 and name HN) 3.3 1.5 0.4
assign (resid 19 and name HN) (resid 18 and name HA) 5.0 3.2 0.2
assign (resid 19 and name HN) (resid 18 and name HB*) 2.7 0.9 1.2
assign (resid 19 and name HN) (resid 20 and name HN) 2.7 0.9 0.4
assign (resid 20 and name HN) (resid 21 and name HN) 2.7 0.9 0.4
assign (resid 21 and name HN) (resid 20 and name HA) 3.3 1.5 0.2
!assign (resid 21 and name HN) (resid 20 and name HB*) 3.3 1.5 1.2
!loosened to W 12/15
assign (resid 21 and name HN) (resid 20 and name HG*) 3.3 1.5 1.2
assign (resid 22 and name HN) (resid 21 and name HA) 2.7 0.9 0.2
assign (resid 22 and name HN) (resid 21 and name HG1#) 3.3 1.5 1.7
assign (resid 22 and name HN) (resid 23 and name HN) 2.7 0.9 0.4
assign (resid 23 and name HN) (resid 22 and name HA) 5.0 3.2 0.2
assign (resid 23 and name HN) (resid 22 and name HB) 3.3 1.5 0.2
assign (resid 24 and name HN) (resid 23 and name HA) 3.3 1.5 0.2
assign (resid 24 and name HN) (resid 23 and name HB*) 2.7 0.9 1.2
!removed 9/3 c.b. 24HN to 40 HN
!assign (resid 24 and name HN) (resid 25 and name HN) 2.7 0.9 0.4
!removed 9/3 cb 40 HN
!assign (resid 25 and name HN) (resid 24 and name HA) 2.7 0.9 0.2
assign (resid 26 and name HN) (resid 25 and name HA) 2.7 0.9 0.2
assign (resid 27 and name HN) (resid 26 and name HA) 2.7 0.9 0.2
assign (resid 27 and name HN) (resid 26 and name HB*) 3.3 1.5 1.2
assign (resid 27 and name HN) (resid 26 and name HN) 5.0 3.2 0.4
assign (resid 28 and name HN) (resid 27 and name HA) 2.7 0.9 0.2
assign (resid 29 and name HN) (resid 28 and name HA) 2.7 0.9 0.2
assign (resid 30 and name HN) (resid 29 and name HA) 3.3 1.5 0.2
assign (resid 30 and name HN) (resid 31 and name HN) 5.0 3.2 0.4
assign (resid 31 and name HN) (resid 30 and name HB*) 5.0 3.2 1.2
assign (resid 32 and name HN) (resid 31 and name HA) 3.3 1.5 0.2
assign (resid 32 and name HN) (resid 31 and name HG2#) 5.0 3.2 1.7
assign (resid 32 and name HN) (resid 31 and name HN) 2.7 0.9 0.4
assign (resid 34 and name HN) (resid 33 and name HA) 3.3 1.5 0.2
!OL loosened to M 11/22
assign (resid 34 and name HN) (resid 33 and name HB*) 3.3 1.5 1.2
!rem 11/05 back 11/08
assign (resid 35 and name HN) (resid 34 and name HN) 5.0 3.2 0.4
assign (resid 36 and name HN) (resid 35 and name HA) 2.7 0.9 0.2
assign (resid 36 and name HN) (resid 35 and name HB#) 3.3 1.5 1.7
assign (resid 37 and name HN) (resid 36 and name HA1) 2.7 0.9 0.2
assign (resid 37 and name HN) (resid 36 and name HA2) 2.7 0.9 0.2
assign (resid 38 and name HN) (resid 37 and name HG1#) 3.3 1.5 1.7
assign (resid 38 and name HN) (resid 37 and name HA) 2.7 0.9 0.2
assign (resid 38 and name HN) (resid 39 and name HN) 5.0 3.2 0.4
assign (resid 39 and name HN) (resid 38 and name HA) 2.7 0.9 0.2
!removed 9/3 cb 25HN
!assign (resid 40 and name HN) (resid 39 and name HA) 2.7 0.9 0.2
assign (resid 41 and name HN) (resid 40 and name HA) 2.7 0.9 0.2
assign (resid 41 and name HN) (resid 40 and name HB) 5.0 3.2 0.2
assign (resid 44 and name HN) (resid 43 and name HA) 3.3 1.5 0.2
!removed stereo 10/21
assign (resid 44 and name HN) (resid 43 and name HB*) 3.3 1.5 1.2
!assign (resid 44 and name HN) (resid 43 and name HB2) 3.3 1.5 0.2
!assign (resid 44 and name HN) (resid 43 and name HB1) 3.3 1.5 0.2
assign (resid 44 and name HN) (resid 45 and name HN) 3.3 1.5 0.4
!changed 9/16 from Ha1 and Ha2 to HA*
assign (resid 45 and name HN) (resid 44 and name HA*) 3.3 1.5 1.2
!assign (resid 45 and name HN) (resid 44 and name HA2) 3.3 1.5 0.2
assign (resid 45 and name HN) (resid 46 and name HN) 5.0 3.2 0.4
assign (resid 47 and name HN) (resid 46 and name HA) 2.7 0.9 0.2
assign (resid 47 and name HN) (resid 46 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 47 and name HN) (resid 46 and name HB*) 3.3 1.5 1.2
assign (resid 47 and name HN) (resid 46 and name HN) 3.3 1.5 0.4
assign (resid 48 and name HN) (resid 47 and name HA) 2.7 0.9 0.2
assign (resid 48 and name HN) (resid 47 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 48 and name HN) (resid 47 and name HB*) 3.3 1.5 1.2
assign (resid 48 and name HN) (resid 47 and name HN) 5.0 3.2 0.4
assign (resid 49 and name HN) (resid 48 and name HA) 2.7 0.9 0.2
!removed 9/8 dup
!assign (resid 49 and name HN) (resid 48 and name HB*) 5.0 3.2 1.2
assign (resid 49 and name HN) (resid 48 and name HB*) 3.3 1.5 1.2
assign (resid 50 and name HN) (resid 49 and name HA1) 2.7 0.9 0.2
assign (resid 50 and name HN) (resid 49 and name HA2) 2.7 0.9 0.2
assign (resid 50 and name HN) (resid 49 and name HN) 5.0 3.2 0.4
assign (resid 53 and name HN) (resid 52 and name HA) 3.3 1.5 0.2
assign (resid 53 and name HN) (resid 52 and name HN) 2.7 0.9 0.4
assign (resid 54 and name HN) (resid 53 and name HA) 2.7 0.9 0.2
assign (resid 54 and name HN) (resid 53 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 54 and name HN) (resid 53 and name HB*) 3.3 1.5 1.2
assign (resid 54 and name HN) (resid 53 and name HN) 5.0 3.2 0.4
assign (resid 54 and name HN) (resid 55 and name HN) 3.3 1.5 0.4
assign (resid 55 and name HN) (resid 54 and name HA) 5.0 3.2 0.2
assign (resid 55 and name HN) (resid 54 and name HB*) 2.7 0.9 1.2
assign (resid 55 and name HN) (resid 54 and name HG*) 5.0 3.2 1.2
!removed 9/8 dup
!assign (resid 55 and name HN) (resid 54 and name HG*) 5.0 3.2 1.2
assign (resid 55 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
!removed 9/8 dup
!assign (resid 55 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
assign (resid 58 and name HN) (resid 57 and name HA) 5.0 3.2 0.2
assign (resid 58 and name HN) (resid 57 and name HN) 3.3 1.5 0.4
assign (resid 59 and name HN) (resid 58 and name HA) 5.0 3.2 0.2
assign (resid 59 and name HN) (resid 58 and name HG*) 3.3 1.5 1.2
assign (resid 59 and name HN) (resid 58 and name HN) 3.3 1.5 0.4
assign (resid 59 and name HN) (resid 60 and name HN) 3.3 1.5 0.4
assign (resid 60 and name HN) (resid 59 and name HA) 3.3 1.5 0.2
assign (resid 60 and name HN) (resid 59 and name HB*) 3.3 1.5 1.2
!assign (resid 60 and name HN) (resid 59 and name HB2) 3.3 1.5 0.2
!assign (resid 60 and name HN) (resid 59 and name HB1) 3.3 1.5 0.2
assign (resid 60 and name HN) (resid 61 and name HN) 3.3 1.5 0.4
assign (resid 61 and name HN) (resid 60 and name HA) 5.0 3.2 0.2
assign (resid 62 and name HN) (resid 61 and name HA) 5.0 3.2 0.2
assign (resid 62 and name HN) (resid 61 and name HB*) 2.7 0.9 1.2
assign (resid 62 and name HN) (resid 61 and name HN) 3.3 1.5 0.4
assign (resid 63 and name HN) (resid 62 and name HA) 5.0 3.2 0.2
assign (resid 63 and name HN) (resid 62 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 63 and name HN) (resid 62 and name HB*) 3.3 1.5 1.2
assign (resid 63 and name HN) (resid 64 and name HN) 2.7 0.9 0.4
assign (resid 64 and name HN) (resid 63 and name HA) 3.3 1.5 0.2
!rem stereo 10/28
!assign (resid 64 and name HN) (resid 63 and name HB1) 3.3 1.5 0.2
!assign (resid 64 and name HN) (resid 63 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup added back 9/17 as stereo assigns
!assign (resid 64 and name HN) (resid 63 and name HB2) 3.3 1.5 0.2
assign (resid 64 and name HN) (resid 63 and name HD2#) 5.0 3.2 1.7
assign (resid 64 and name HN) (resid 63 and name HD1#) 5.0 3.2 1.7
assign (resid 64 and name HN) (resid 63 and name HG) 5.0 3.2 0.2
assign (resid 64 and name HN) (resid 65 and name HN) 3.3 1.5 0.4
assign (resid 65 and name HN) (resid 64 and name HB*) 3.3 1.5 1.2
!removed 9/8 dup
!assign (resid 65 and name HN) (resid 64 and name HB*) 3.3 1.5 1.2
assign (resid 65 and name HN) (resid 66 and name HN) 2.7 0.9 0.4
!9/13 changed from S to M
assign (resid 67 and name HN) (resid 66 and name HA) 3.3 1.5 0.2
assign (resid 67 and name HN) (resid 66 and name HB*) 2.7 0.9 1.2
assign (resid 67 and name HN) (resid 66 and name HG*) 3.3 1.5 1.2
assign (resid 67 and name HN) (resid 66 and name HN) 2.7 0.9 0.4
assign (resid 68 and name HN) (resid 67 and name HB*) 3.3 1.5 1.2
assign (resid 68 and name HN) (resid 67 and name HN) 3.3 1.5 0.4
assign (resid 70 and name HN) (resid 69 and name HA) 2.7 0.9 0.2
assign (resid 71 and name HN) (resid 70 and name HA) 3.3 1.5 0.2
assign (resid 71 and name HN) (resid 70 and name HB#) 5.0 3.2 1.7
assign (resid 73 and name HN) (resid 72 and name HA) 5.0 3.2 0.2
!added back 9/13
!added 6/15
assign (resid 57 and name HN) (resid 56 and name HN) 2.7 0.9 0.4
assign (resid 55 and name HN) (resid 56 and name HN) 3.3 1.5 0.4
!added 6/18
assign (resid 33 and name HN) (resid 34 and name HN) 3.3 1.5 0.4
!
!
!added 10/04
assign (resid 15 and name HN) (resid 14 and name HG*) 5.0 3.2 1.2
assign (resid 20 and name HN) (resid 21 and name HG2#) 3.3 1.5 1.7
assign (resid 23 and name HN) (resid 22 and name HG2#) 2.7 0.9 1.7
assign (resid 27 and name HN) (resid 26 and name HD2#) 3.3 1.5 1.7
!
!15N restraints
assign (resid 14 and name HN) (resid 12 and name HB) 3.3 1.5 0.2
assign (resid 19 and name HN) (resid 17 and name HB*) 5.0 3.2 1.2
assign (resid 20 and name HN) (resid 18 and name HA) 5.0 3.2 0.2
assign (resid 21 and name HN) (resid 18 and name HA) 5.0 3.2 0.2
assign (resid 34 and name HN) (resid 32 and name HB*) 5.0 3.2 1.2
!removed 9/8 dup
!assign (resid 34 and name HN) (resid 32 and name HB*) 5.0 3.2 1.2
assign (resid 41 and name HN) (resid 45 and name HN) 5.0 3.2 0.4
!removed 11/14 loosen to M 11/15
assign (resid 41 and name HN) (resid 46 and name HA) 3.3 1.5 0.2
assign (resid 44 and name HN) (resid 42 and name HA) 5.0 3.2 0.2
assign (resid 52 and name HN) (resid 56 and name HG1#) 5.0 3.2 1.7
assign (resid 53 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
assign (resid 53 and name HN) (resid 56 and name HG1#) 5.0 3.2 1.7
assign (resid 54 and name HN) (resid 56 and name HG2#) 5.0 3.2 1.7
assign (resid 55 and name HN) (resid 53 and name HB*) 2.7 0.9 1.2
!removed 9/8 dup
!assign (resid 55 and name HN) (resid 53 and name HB*) 3.3 1.5 1.2
assign (resid 58 and name HN) (resid 56 and name HG2#) 5.0 3.2 1.7
assign (resid 59 and name HN) (resid 56 and name HA) 5.0 3.2 0.2
!changed 7/14 from 3.3 1.5 0.7 to 5.0 3.2 0.7
assign (resid 59 and name HN) (resid 56 and name HG2#) 5.0 3.2 1.7
assign (resid 59 and name HN) (resid 56 and name HG1#) 5.0 3.2 1.7
assign (resid 59 and name HN) (resid 57 and name HN) 5.0 3.2 0.4
assign (resid 60 and name HN) (resid 56 and name HA) 5.0 3.2 0.2
assign (resid 60 and name HN) (resid 57 and name HA) 5.0 3.2 0.2
assign (resid 60 and name HN) (resid 58 and name HN) 5.0 3.2 0.4
assign (resid 61 and name HN) (resid 59 and name HN) 5.0 3.2 0.4
!very OL loosened to M 11/18
assign (resid 62 and name HN) (resid 59 and name HA) 3.3 1.5 0.2
assign (resid 62 and name HN) (resid 64 and name HN) 5.0 3.2 0.4
assign (resid 63 and name HN) (resid 60 and name HA) 5.0 3.2 0.2
assign (resid 64 and name HN) (resid 61 and name HA) 5.0 3.2 0.2
assign (resid 65 and name HN) (resid 62 and name HA) 3.3 1.5 0.2
!
!added back 9/13
!added 6/18
!rem 11/05 back 11/08 rem again 11/22
!assign (resid 35 and name HN) (resid 33 and name HN) 2.7 0.9 0.4
!added 6/24
assign (resid 61 and name HN) (resid 58 and name HG*) 5.0 3.2 1.2
!switched to M- 7/12 was OL with 23HB1
!rem 10/29  is 40 B- added 10/29
!assign (resid 23 and name HN) (resid 21 and name HA) 3.3 1.5 0.2
!
!
!added 10/4
assign (resid 23 and name HN) (resid 21 and name HG1#) 2.7 0.9 1.7
assign (resid 39 and name HN) (resid 37 and name HG1#) 5.0 3.2 1.7
assign (resid 43 and name HN) (resid 41 and name HG2#) 5.0 3.2 1.7
assign (resid 45 and name HN) (resid 41 and name HG2#) 3.3 1.5 1.7
!rem 10/28 is 46N not 42N I added 42N 10/20
!assign (resid 42 and name HN) (resid 45 and name HB*) 2.7 0.9 1.2
!loosened to W 10/29
!rem 11/05
!assign (resid 35 and name HN) (resid 33 and name HB*) 5.0 3.2 1.2
!
!15n restraints
assign (resid 22 and name HN) (resid 41 and name HA) 3.3 1.5 0.2
assign (resid 23 and name HN) (resid 41 and name HA) 5.0 3.2 0.2
assign (resid 24 and name HN) (resid 37 and name HG1#) 5.0 3.2 1.7
!changed 9/7 from W to VW 
assign (resid 24 and name HN) (resid 56 and name HG1#) 6.0 4.2 1.7
assign (resid 27 and name HN) (resid 36 and name HN) 5.0 3.2 0.4
assign (resid 27 and name HN) (resid 37 and name HA) 5.0 3.2 0.2
assign (resid 27 and name HN) (resid 37 and name HG1#) 3.3 1.5 1.7
assign (resid 36 and name HN) (resid 27 and name HB*) 3.3 1.5 1.2
assign (resid 37 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
assign (resid 37 and name HN) (resid 56 and name HG1#) 5.0 3.2 1.7
assign (resid 38 and name HN) (resid 25 and name HN) 3.3 1.5 0.4
assign (resid 38 and name HN) (resid 26 and name HA) 5.0 3.2 0.2
assign (resid 39 and name HN) (resid 47 and name HN) 3.3 1.5 0.4
assign (resid 39 and name HN) (resid 48 and name HA) 3.3 1.5 0.2
assign (resid 40 and name HN) (resid 23 and name HN) 3.3 1.5 0.4
assign (resid 47 and name HN) (resid 40 and name HA) 3.3 1.5 0.2
assign (resid 49 and name HN) (resid 37 and name HB) 3.3 1.5 0.2
assign (resid 49 and name HN) (resid 37 and name HG1#) 5.0 3.2 1.7
assign (resid 49 and name HN) (resid 37 and name HN) 3.3 1.5 0.4
assign (resid 49 and name HN) (resid 38 and name HA) 3.3 1.5 0.2
assign (resid 49 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
assign (resid 49 and name HN) (resid 56 and name HG1#) 5.0 3.2 1.7
assign (resid 50 and name HN) (resid 56 and name HG2#) 3.3 1.5 1.7
assign (resid 50 and name HN) (resid 56 and name HG1#) 5.0 3.2 1.7
!
!
!added in 10/4 from nulls based on 3d H2O NOESY and structure 
assign (resid 23 and name HN) (resid 63 and name HD1#) 5.0 3.2 1.7
!rem 11/05
!assign (resid 27 and name HN) (resid 35 and name HB#) 5.0 3.2 1.7
assign (resid 41 and name HN) (resid 16 and name HD#) 5.0 3.2 1.7
!changed to 12HG** 11/04
assign (resid 48 and name HN) (resid 12 and name HG**) 3.3 1.5 2.7
!assign (resid 48 and name HN) (resid 12 and name HG2#) 3.3 1.5 1.7
!
!added 6/18
assign (resid 60 and name HN) (resid 39 and name HE*) 5.0 3.2 1.2
!added 6/18
assign (resid 60 and name HN) (resid 39 and name HZ) 5.0 3.2 0.2
assign (resid 55 and name HE1) (resid 12 and name HG2#) 3.3 1.5 1.5
assign (resid 54 and name HN) (resid 55 and name HD1) 5.0 3.2 0.2
assign (resid 56 and name HN) (resid 55 and name HD1) 5.0 3.2 0.2
!removed 8/30 dup
!assign (resid 56 and name HN) (resid 55 and name HD1) 5.0 3.2 0.2
!55HE1
assign (resid 55 and name HE1) (resid 55 and name HD1) 2.7 0.9 0.0
assign (resid 55 and name HE1) (resid 55 and name HZ2) 2.7 0.9 0.0
!
!added 10/20
assign (resid 43 and name HN) (resid 42 and name HA) 3.3 1.5 0.2
assign (resid 42 and name HN) (resid 22 and name HG2#) 3.3 1.5 1.7
assign (resid 42 and name HN) (resid 22 and name HG1#) 3.3 1.5 1.7
assign (resid 42 and name HN) (resid 41 and name HG2#) 3.3 1.5 1.7
assign (resid 42 and name HN) (resid 42 and name HG*) 2.7 0.9 1.2
assign (resid 42 and name HN) (resid 42 and name HA) 2.7 0.9 0.2
assign (resid 42 and name HN) (resid 41 and name HA) 2.7 0.9 0.2
assign (resid 70 and name HN) (resid 69 and name HB*) 5.0 3.2 1.2
assign (resid 28 and name HN) (resid 38 and name HD#) 5.0 3.2 1.7
!
!added 10/29 was assigned as 21a but simul noesy says 40b
assign (resid 23 and name HN) (resid 40 and name HB) 3.3 1.5 0.2
!added 11/12
assign (resid 43 and name HN) (resid 42 and name HN) 3.3 1.5 0.4
assign (resid 43 and name HN) (resid 41 and name HA) 5.0 3.2 0.2
assign (resid 42 and name HN) (resid 22 and name HN) 5.0 3.2 0.4
!rem 11/14 for now loosen to W 11/15
assign (resid 42 and name HN) (resid 41 and name HN) 5.0 3.2 0.4
assign (resid 41 and name HN) (resid 22 and name HN) 5.0 3.2 0.4
assign (resid 44 and name HN) (resid 43 and name HG*) 5.0 3.2 1.2
assign (resid 44 and name HN) (resid 40 and name HG2#) 5.0 3.2 1.7
assign (resid 44 and name HN) (resid 41 and name HG2#) 5.0 3.2 1.7
assign (resid 23 and name HN) (resid 40 and name HG2#) 5.0 3.2 1.7
assign (resid 8 and name HN) (resid 38 and name HD#) 5.0 3.2 1.7
assign (resid 27 and name HN) (resid 38 and name HD#) 3.3 1.5 1.7
assign (resid 39 and name HN) (resid 38 and name HG1*) 5.0 3.2 1.2
assign (resid 41 and name HN) (resid 22 and name HG2#) 3.3 1.5 1.7
assign (resid 32 and name HN) (resid 29 and name HG*) 5.0 3.2 1.2
assign (resid 37 and name HN) (resid 11 and name HE*) 5.0 3.2 2.2
!added back from removed list 11/09
assign (resid 12 and name HN) (resid 49 and name HA*) 5.0 3.2 0.2
assign (resid 47 and name HN) (resid 39 and name HB*) 5.0 3.2 0.2
!added 11/18
assign (resid 8 and name HN) (resid 27 and name HB*) 5.0 3.2 1.2
!switched from 26g to 26b 12/08 by spectrum and changedto M
assign (resid 27 and name HN) (resid 26 and name HB*) 3.3 1.5 1.2
assign (resid 41 and name HN) (resid 21 and name HG1#) 5.0 3.2 1.7
assign (resid 50 and name HN) (resid 12 and name HG**) 5.0 3.2 2.7
assign (resid 52 and name HN) (resid 52 and name HG*) 2.7 0.9 1.2
assign (resid 53 and name HN) (resid 52 and name HG*) 5.0 3.2 1.2
!added 11/29
assign (resid 29 and name HN) (resid 35 and name HB#) 5.0 3.2 1.7
assign (resid 31 and name HN) (resid 29 and name HB*) 5.0 3.2 1.2
assign (resid 31 and name HN) (resid 29 and name HG*) 5.0 3.2 1.2
assign (resid 32 and name HN) (resid 29 and name HB*) 5.0 3.2 1.2
!added 11/30
assign (resid 48 and name HN) (resid 38 and name HG2#) 5.0 3.2 1.7
!added 12/06
assign (resid 11 and name HN) (resid 11 and name HD*) 5.0 3.2 2.2
assign (resid 12 and name HN) (resid 11 and name HD*) 3.3 1.5 2.2
assign (resid 34 and name HN) (resid 34 and name HB*) 2.7 0.9 1.2
!added 12/07
assign (resid 34 and name HN) (resid 33 and name HD**) 5.0 3.2 2.7
!added 12/08 were s.b. added 1203b
assign (resid 24 and name HN) (resid 63 and name HD1#) 3.3 1.5 1.7
assign (resid 18 and name HN) (resid 21 and name HG2#) 3.3 1.5 1.7
assign (resid 37 and name HN) (resid 51 and name HA) 5.0 3.2 0.2
assign (resid 41 and name HN) (resid 46 and name HB*) 5.0 3.2 1.2
assign (resid 38 and name HN) (resid 26 and name HD2#) 3.3 1.5 1.7
!added 12/13
assign (resid 55 and name HE1) (resid 15 and name HA) 3.3 1.5 0.2
assign (resid 55 and name HE1) (resid 15 and name HB*) 3.3 1.5 1.2
assign (resid 55 and name HE1) (resid 53 and name HB*) 3.3 1.5 1.2
assign (resid 55 and name HE1) (resid 53 and name HG*) 3.3 1.5 1.2
assign (resid 10 and name HN) (resid 10 and name HB1) 3.3 1.5 0.2
assign (resid 10 and name HN) (resid 10 and name HB2) 5.0 3.2 0.2
!loosen to M 12/15
assign (resid 20 and name HN) (resid 20 and name HB1) 3.3 1.5 0.2
assign (resid 20 and name HN) (resid 20 and name HB2) 2.7 0.9 0.2
assign (resid 21 and name HN) (resid 20 and name HB2) 3.3 1.5 0.2
assign (resid 24 and name HN) (resid 24 and name HB1) 5.0 3.2 0.2
assign (resid 24 and name HN) (resid 24 and name HB2) 3.3 1.5 0.2
assign (resid 55 and name HN) (resid 55 and name HB1) 2.7 0.9 0.2
assign (resid 55 and name HN) (resid 55 and name HB2) 3.3 1.5 0.2
!loosen to W 12/16
assign (resid 60 and name HN) (resid 60 and name HB1) 3.3 1.5 0.2
assign (resid 64 and name HN) (resid 63 and name HB1) 3.3 1.5 0.2
assign (resid 64 and name HN) (resid 63 and name HB2) 3.3 1.5 0.2
assign (resid 63 and name HN) (resid 63 and name HB1) 3.3 1.5 0.2
assign (resid 63 and name HN) (resid 63 and name HB2) 3.3 1.5 0.2
assign (resid 22 and name HN) (resid 40 and name O) 2.3 0.6 0.0
assign (resid 39 and name HN) (resid 47 and name O) 2.3 0.6 0.0
assign (resid 53 and name HN) (resid 50 and name O) 2.3 0.6 0.0
assign (resid 59 and name HN) (resid 55 and name O) 2.3 0.6 0.0
assign (resid 60 and name HN) (resid 56 and name O) 2.3 0.6 0.0
assign (resid 63 and name HN) (resid 59 and name O) 2.3 0.6 0.0
assign (resid 64 and name HN) (resid 60 and name O) 2.3 0.6 0.0
!added 11/06
!assign (resid 21 and name HN) (resid 17 and name O) 2.3 0.6 0.0
assign (resid 38 and name HN) (resid 25 and name O) 2.3 0.6 0.0
!rem 11/21- don't see
!assign (resid 65 and name HN) (resid 62 and name O) 2.3 0.6 0.0
!added 11/11
assign (resid 12 and name HN) (resid 48 and name O) 2.3 0.6 0.0
!added 11/22
assign (resid 37 and name HN) (resid 49 and name O) 2.3 0.6 0.0
assign (resid 58 and name HN) (resid 54 and name O) 2.3 0.6 0.0
assign (resid 61 and name HN) (resid 57 and name O) 2.3 0.6 0.0
!
assign (resid 22 and name N) (resid 40 and name O) 3.3 0.9 0.0
assign (resid 39 and name N) (resid 47 and name O) 3.3 0.9 0.0
assign (resid 53 and name N) (resid 50 and name O) 3.3 0.9 0.0
assign (resid 59 and name N) (resid 55 and name O) 3.3 0.9 0.0
assign (resid 60 and name N) (resid 56 and name O) 3.3 0.9 0.0
assign (resid 63 and name N) (resid 59 and name O) 3.3 0.9 0.0
assign (resid 64 and name N) (resid 60 and name O) 3.3 0.9 0.0
!added 11/06
!assign (resid 21 and name N) (resid 17 and name O) 3.3 0.9 0.0
assign (resid 38 and name N) (resid 25 and name O) 3.3 0.9 0.0
!rem 11/21- don't see
!assign (resid 65 and name N) (resid 62 and name O) 3.3 0.9 0.0
!added 11/11
assign (resid 12 and name N) (resid 48 and name O) 3.3 0.9 0.0
!added 11/22
assign (resid 37 and name N) (resid 49 and name O) 3.3 0.9 0.0
assign (resid 58 and name N) (resid 54 and name O) 3.3 0.9 0.0
assign (resid 61 and name N) (resid 57 and name O) 3.3 0.9 0.0
set message=on echo=on end
  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    VAL   1          HT1       VAL   1  -8.432  11.372   4.981
    2   2H    VAL   1          HT2       VAL   1  -8.052  12.053   6.490
    3   3H    VAL   1          HT3       VAL   1  -9.136  10.749   6.393
    4    HA   VAL   1           HA       VAL   1  -6.891  10.077   7.175
    5    HB   VAL   1           HB       VAL   1  -7.969   9.072   4.519
    6   1HG1  VAL   1          HG1       VAL   1  -5.603   8.330   5.939
    7   2HG1  VAL   1          HG1       VAL   1  -6.293   7.571   4.505
    8   3HG1  VAL   1          HG1       VAL   1  -6.771   7.019   6.110
    9   1HG2  VAL   1          HG2       VAL   1  -8.663   8.656   7.400
   10   2HG2  VAL   1          HG2       VAL   1  -8.799   7.274   6.313
   11   3HG2  VAL   1          HG2       VAL   1  -9.724   8.741   5.993
   12    H    VAL   2           HN       VAL   2  -4.821  10.855   7.011
   13    HA   VAL   2           HA       VAL   2  -3.722  11.380   4.271
   14    HB   VAL   2           HB       VAL   2  -4.400  13.502   5.263
   15   1HG1  VAL   2          HG1       VAL   2  -3.304  12.230   7.686
   16   2HG1  VAL   2          HG1       VAL   2  -4.562  13.456   7.529
   17   3HG1  VAL   2          HG1       VAL   2  -2.862  13.927   7.499
   18   1HG2  VAL   2          HG2       VAL   2  -1.956  13.038   4.255
   19   2HG2  VAL   2          HG2       VAL   2  -1.480  13.531   5.880
   20   3HG2  VAL   2          HG2       VAL   2  -2.425  14.623   4.868
   21    H    ILE   3           HN       ILE   3  -1.641  10.712   3.997
   22    HA   ILE   3           HA       ILE   3  -0.239   9.514   6.355
   23    HB   ILE   3           HB       ILE   3  -1.209   7.886   4.840
   24   1HG1  ILE   3          HG1       ILE   3   1.173   7.552   5.737
   25   2HG1  ILE   3          HG1       ILE   3   0.702   6.557   4.369
   26   1HG2  ILE   3          HG2       ILE   3  -0.414   7.865   2.419
   27   2HG2  ILE   3          HG2       ILE   3   0.154   9.510   2.698
   28   3HG2  ILE   3          HG2       ILE   3  -1.560   9.131   2.861
   29   1HD1  ILE   3          HD1       ILE   3   2.478   7.330   3.227
   30   2HD1  ILE   3          HD1       ILE   3   2.898   8.398   4.564
   31   3HD1  ILE   3          HD1       ILE   3   1.808   8.957   3.300
   32    HA   PRO   4           HA       PRO   4   2.958  12.362   5.182
   33   1HB   PRO   4          HB2       PRO   4   5.009  11.285   6.646
   34   2HB   PRO   4          HB1       PRO   4   3.713  12.263   7.363
   35   1HG   PRO   4          HG2       PRO   4   4.060   9.309   7.332
   36   2HG   PRO   4          HG1       PRO   4   3.430  10.361   8.609
   37   1HD   PRO   4          HD2       PRO   4   1.850   8.856   6.965
   38   2HD   PRO   4          HD1       PRO   4   1.314  10.356   7.748
   39    H    SER   5           HN       SER   5   5.037   9.560   5.681
   40    HA   SER   5           HA       SER   5   5.071   8.546   3.003
   41   1HB   SER   5          HB2       SER   5   5.859  10.634   2.243
   42   2HB   SER   5          HB1       SER   5   6.831  10.897   3.688
   43    HG   SER   5           HG       SER   5   8.175  10.293   1.997
   44    HA   PRO   6           HA       PRO   6   7.584   6.377   6.257
   45   1HB   PRO   6          HB2       PRO   6   6.351   3.953   6.001
   46   2HB   PRO   6          HB1       PRO   6   5.773   5.224   7.099
   47   1HG   PRO   6          HG2       PRO   6   4.789   4.466   4.398
   48   2HG   PRO   6          HG1       PRO   6   3.879   4.944   5.840
   49   1HD   PRO   6          HD2       PRO   6   4.360   6.624   3.755
   50   2HD   PRO   6          HD1       PRO   6   4.153   7.183   5.431
   51    H    CYS   7           HN       CYS   7   9.486   5.384   5.605
   52    HA   CYS   7           HA       CYS   7   9.603   4.380   2.789
   53   1HB   CYS   7          HB2       CYS   7  11.663   5.436   4.747
   54   2HB   CYS   7          HB1       CYS   7  12.071   4.802   3.152
   55    H    CYS   8           HN       CYS   8  11.261   2.556   2.499
   56    HA   CYS   8           HA       CYS   8  11.332   0.705   4.848
   57   1HB   CYS   8          HB2       CYS   8  10.621  -1.104   3.275
   58   2HB   CYS   8          HB1       CYS   8   9.397   0.152   3.445
   59    H    MET   9           HN       MET   9  12.537  -1.445   3.419
   60    HA   MET   9           HA       MET   9  15.045  -0.225   2.325
   61   1HB   MET   9          HB2       MET   9  16.314  -1.775   3.762
   62   2HB   MET   9          HB1       MET   9  15.261  -0.751   4.738
   63   1HG   MET   9          HG2       MET   9  14.123  -2.534   5.512
   64   2HG   MET   9          HG1       MET   9  13.861  -3.141   3.878
   65   1HE   MET   9          HE1       MET   9  13.862  -4.722   6.070
   66   2HE   MET   9          HE2       MET   9  15.296  -4.776   7.093
   67   3HE   MET   9          HE3       MET   9  15.004  -6.065   5.927
   68    H    PHE  10           HN       PHE  10  12.558  -2.005   1.412
   69    HA   PHE  10           HA       PHE  10  14.002  -3.449  -0.627
   70   1HB   PHE  10          HB2       PHE  10  13.827  -5.676   0.208
   71   2HB   PHE  10          HB1       PHE  10  14.427  -4.728   1.564
   72    HD1  PHE  10           HD1      PHE  10  12.270  -3.509   2.873
   73    HD2  PHE  10           HD2      PHE  10  12.254  -7.271   0.800
   74    HE1  PHE  10           HE1      PHE  10  10.337  -4.248   4.232
   75    HE2  PHE  10           HE2      PHE  10  10.316  -8.009   2.160
   76    HZ   PHE  10           HZ       PHE  10   9.358  -6.497   3.876
   77    H    PHE  11           HN       PHE  11  12.578  -3.850  -2.308
   78    HA   PHE  11           HA       PHE  11   9.792  -3.042  -2.012
   79   1HB   PHE  11          HB2       PHE  11  11.744  -3.578  -4.081
   80   2HB   PHE  11          HB1       PHE  11  10.220  -4.377  -4.468
   81    HD1  PHE  11           HD1      PHE  11   8.208  -2.613  -3.316
   82    HD2  PHE  11           HD2      PHE  11  11.843  -1.630  -5.382
   83    HE1  PHE  11           HE1      PHE  11   7.233  -0.439  -3.993
   84    HE2  PHE  11           HE2      PHE  11  10.867   0.545  -6.060
   85    HZ   PHE  11           HZ       PHE  11   8.563   1.144  -5.366
   86    H    VAL  12           HN       VAL  12   7.955  -4.418  -2.190
   87    HA   VAL  12           HA       VAL  12   7.957  -6.905  -0.898
   88    HB   VAL  12           HB       VAL  12   5.768  -7.197  -2.189
   89   1HG1  VAL  12          HG1       VAL  12   6.571  -4.983  -0.417
   90   2HG1  VAL  12          HG1       VAL  12   5.238  -6.128  -0.260
   91   3HG1  VAL  12          HG1       VAL  12   5.067  -4.711  -1.297
   92   1HG2  VAL  12          HG2       VAL  12   7.050  -5.362  -3.924
   93   2HG2  VAL  12          HG2       VAL  12   5.717  -4.481  -3.179
   94   3HG2  VAL  12          HG2       VAL  12   5.403  -5.980  -4.054
   95    H    SER  13           HN       SER  13   8.501  -8.978  -1.536
   96    HA   SER  13           HA       SER  13   9.966  -9.507  -3.924
   97   1HB   SER  13          HB2       SER  13   9.181 -11.935  -3.237
   98   2HB   SER  13          HB1       SER  13  10.242 -11.030  -2.161
   99    HG   SER  13           HG       SER  13   8.409 -11.925  -1.087
  100    H    LYS  14           HN       LYS  14   6.545  -9.434  -3.231
  101    HA   LYS  14           HA       LYS  14   5.891  -9.638  -6.081
  102   1HB   LYS  14          HB2       LYS  14   5.398 -11.816  -4.062
  103   2HB   LYS  14          HB1       LYS  14   4.258 -11.592  -5.390
  104   1HG   LYS  14          HG2       LYS  14   6.650 -11.482  -6.717
  105   2HG   LYS  14          HG1       LYS  14   7.016 -12.641  -5.438
  106   1HD   LYS  14          HD2       LYS  14   6.013 -14.184  -6.753
  107   2HD   LYS  14          HD1       LYS  14   4.493 -13.417  -6.292
  108   1HE   LYS  14          HE2       LYS  14   4.273 -12.329  -8.316
  109   2HE   LYS  14          HE1       LYS  14   6.027 -12.157  -8.528
  110   1HZ   LYS  14          HZ1       LYS  14   6.237 -14.447  -9.030
  111   2HZ   LYS  14          HZ2       LYS  14   4.953 -13.875  -9.984
  112   3HZ   LYS  14          HZ3       LYS  14   4.636 -14.776  -8.579
  113    H    ARG  15           HN       ARG  15   3.261  -9.743  -6.121
  114    HA   ARG  15           HA       ARG  15   2.341  -7.352  -4.850
  115   1HB   ARG  15          HB2       ARG  15   0.160  -8.102  -5.743
  116   2HB   ARG  15          HB1       ARG  15   1.441  -8.364  -6.927
  117   1HG   ARG  15          HG2       ARG  15   0.629 -10.482  -7.022
  118   2HG   ARG  15          HG1       ARG  15   1.518 -10.709  -5.516
  119   1HD   ARG  15          HD2       ARG  15  -0.405 -10.950  -4.338
  120   2HD   ARG  15          HD1       ARG  15  -1.086  -9.472  -5.045
  121    HE   ARG  15           HE       ARG  15  -2.168 -10.813  -6.661
  122   1HH1  ARG  15          HH2       ARG  15  -0.937 -12.898  -4.429
  123   2HH1  ARG  15          HH2       ARG  15  -0.690 -14.232  -5.507
  124   1HH2  ARG  15          HH1       ARG  15  -1.273 -12.370  -8.373
  125   2HH2  ARG  15          HH1       ARG  15  -0.879 -13.932  -7.738
  126    H    ILE  16           HN       ILE  16  -0.216  -8.210  -3.843
  127    HA   ILE  16           HA       ILE  16   0.445  -9.912  -1.477
  128    HB   ILE  16           HB       ILE  16  -1.134  -7.434  -0.950
  129   1HG1  ILE  16          HG1       ILE  16   1.853  -7.330  -1.506
  130   2HG1  ILE  16          HG1       ILE  16   0.593  -6.454  -2.371
  131   1HG2  ILE  16          HG2       ILE  16   0.483  -9.380   0.458
  132   2HG2  ILE  16          HG2       ILE  16  -0.690  -8.232   1.101
  133   3HG2  ILE  16          HG2       ILE  16   0.986  -7.744   0.868
  134   1HD1  ILE  16          HD1       ILE  16   1.840  -5.081  -0.641
  135   2HD1  ILE  16          HD1       ILE  16   1.114  -6.106   0.596
  136   3HD1  ILE  16          HD1       ILE  16   0.089  -5.110  -0.436
  137    HA   PRO  17           HA       PRO  17  -3.783 -11.026  -2.186
  138   1HB   PRO  17          HB2       PRO  17  -4.382 -12.202   0.207
  139   2HB   PRO  17          HB1       PRO  17  -3.304 -12.937  -0.994
  140   1HG   PRO  17          HG2       PRO  17  -2.662 -11.780   1.589
  141   2HG   PRO  17          HG1       PRO  17  -1.682 -12.809   0.542
  142   1HD   PRO  17          HD2       PRO  17  -1.564  -9.943   0.889
  143   2HD   PRO  17          HD1       PRO  17  -0.464 -10.999  -0.026
  144    H    GLU  18           HN       GLU  18  -5.346  -9.428  -2.293
  145    HA   GLU  18           HA       GLU  18  -5.726  -7.226  -0.648
  146   1HB   GLU  18          HB2       GLU  18  -6.827  -7.969  -2.870
  147   2HB   GLU  18          HB1       GLU  18  -8.029  -8.763  -1.851
  148   1HG   GLU  18          HG2       GLU  18  -8.051  -6.396  -0.636
  149   2HG   GLU  18          HG1       GLU  18  -7.479  -5.844  -2.211
  150    H    ASN  19           HN       ASN  19  -6.824 -10.530  -0.044
  151    HA   ASN  19           HA       ASN  19  -8.688  -9.919   2.064
  152   1HB   ASN  19          HB2       ASN  19  -7.837 -12.114   0.613
  153   2HB   ASN  19          HB1       ASN  19  -7.227 -12.463   2.231
  154   1HD2  ASN  19          HD2       ASN  19  -9.439 -13.897   0.952
  155   2HD2  ASN  19          HD2       ASN  19 -10.823 -13.615   1.894
  156    H    ARG  20           HN       ARG  20  -5.275  -9.669   1.966
  157    HA   ARG  20           HA       ARG  20  -5.078  -9.932   4.939
  158   1HB   ARG  20          HB2       ARG  20  -3.138 -10.217   2.637
  159   2HB   ARG  20          HB1       ARG  20  -2.611 -10.169   4.315
  160   1HG   ARG  20          HG2       ARG  20  -4.607 -12.007   4.482
  161   2HG   ARG  20          HG1       ARG  20  -4.028 -12.309   2.844
  162   1HD   ARG  20          HD2       ARG  20  -1.925 -12.997   3.568
  163   2HD   ARG  20          HD1       ARG  20  -2.010 -12.029   5.055
  164    HE   ARG  20           HE       ARG  20  -3.628 -14.513   4.611
  165   1HH1  ARG  20          HH2       ARG  20  -3.574 -12.012   6.739
  166   2HH1  ARG  20          HH2       ARG  20  -3.176 -12.940   8.146
  167   1HH2  ARG  20          HH1       ARG  20  -2.430 -15.818   6.362
  168   2HH2  ARG  20          HH1       ARG  20  -2.528 -15.095   7.933
  169    H    VAL  21           HN       VAL  21  -4.386  -7.868   2.160
  170    HA   VAL  21           HA       VAL  21  -2.901  -5.850   3.596
  171    HB   VAL  21           HB       VAL  21  -4.575  -5.639   1.074
  172   1HG1  VAL  21          HG1       VAL  21  -2.049  -4.147   1.352
  173   2HG1  VAL  21          HG1       VAL  21  -3.303  -3.656   2.490
  174   3HG1  VAL  21          HG1       VAL  21  -3.616  -3.603   0.755
  175   1HG2  VAL  21          HG2       VAL  21  -2.326  -7.286   1.625
  176   2HG2  VAL  21          HG2       VAL  21  -1.744  -5.950   0.632
  177   3HG2  VAL  21          HG2       VAL  21  -3.064  -6.968   0.055
  178    H    VAL  22           HN       VAL  22  -3.655  -3.828   4.403
  179    HA   VAL  22           HA       VAL  22  -6.610  -3.664   4.812
  180    HB   VAL  22           HB       VAL  22  -5.830  -2.395   6.927
  181   1HG1  VAL  22          HG1       VAL  22  -5.544  -5.338   6.434
  182   2HG1  VAL  22          HG1       VAL  22  -6.824  -4.476   7.289
  183   3HG1  VAL  22          HG1       VAL  22  -5.236  -4.665   8.035
  184   1HG2  VAL  22          HG2       VAL  22  -3.288  -3.946   6.394
  185   2HG2  VAL  22          HG2       VAL  22  -3.615  -2.865   7.747
  186   3HG2  VAL  22          HG2       VAL  22  -3.435  -2.211   6.121
  187    H    SER  23           HN       SER  23  -3.615  -1.854   4.260
  188    HA   SER  23           HA       SER  23  -4.942   0.202   2.726
  189   1HB   SER  23          HB2       SER  23  -5.834   0.748   4.935
  190   2HB   SER  23          HB1       SER  23  -4.215   0.731   5.625
  191    HG   SER  23           HG       SER  23  -5.176   2.483   3.599
  192    H    TYR  24           HN       TYR  24  -3.354   1.669   1.826
  193    HA   TYR  24           HA       TYR  24  -0.557   0.803   2.308
  194   1HB   TYR  24          HB2       TYR  24  -0.215   1.578   0.044
  195   2HB   TYR  24          HB1       TYR  24  -1.680   0.611   0.072
  196    HD1  TYR  24           HD1      TYR  24  -3.870   1.616  -0.253
  197    HD2  TYR  24           HD2      TYR  24  -0.323   4.039  -0.148
  198    HE1  TYR  24           HE1      TYR  24  -5.157   3.539  -1.143
  199    HE2  TYR  24           HE2      TYR  24  -1.611   5.961  -1.038
  200    HH   TYR  24           HH       TYR  24  -4.276   6.590  -0.936
  201    H    GLN  25           HN       GLN  25   1.105   2.543   2.052
  202    HA   GLN  25           HA       GLN  25   0.206   5.227   3.036
  203   1HB   GLN  25          HB2       GLN  25   2.361   3.339   4.008
  204   2HB   GLN  25          HB1       GLN  25   2.458   5.069   4.338
  205   1HG   GLN  25          HG2       GLN  25   0.588   5.052   5.716
  206   2HG   GLN  25          HG1       GLN  25  -0.098   3.624   4.940
  207   1HE2  GLN  25          HE2       GLN  25   0.694   4.239   7.878
  208   2HE2  GLN  25          HE2       GLN  25   1.646   2.905   8.320
  209    H    LEU  26           HN       LEU  26   0.668   6.496   1.237
  210    HA   LEU  26           HA       LEU  26   2.697   5.810  -0.687
  211   1HB   LEU  26          HB2       LEU  26   0.744   7.976  -0.154
  212   2HB   LEU  26          HB1       LEU  26   2.111   8.411  -1.181
  213    HG   LEU  26           HG       LEU  26   0.253   6.054  -1.621
  214   1HD1  LEU  26          HD1       LEU  26  -0.095   8.775  -2.221
  215   2HD1  LEU  26          HD1       LEU  26  -1.004   7.423  -2.896
  216   3HD1  LEU  26          HD1       LEU  26   0.421   8.035  -3.737
  217   1HD2  LEU  26          HD2       LEU  26   2.762   7.023  -2.980
  218   2HD2  LEU  26          HD2       LEU  26   1.537   6.150  -3.901
  219   3HD2  LEU  26          HD2       LEU  26   2.317   5.381  -2.520
  220    H    SER  27           HN       SER  27   4.776   6.472  -0.881
  221    HA   SER  27           HA       SER  27   5.840   8.464   1.079
  222   1HB   SER  27          HB2       SER  27   6.343   6.050   1.599
  223   2HB   SER  27          HB1       SER  27   7.182   5.943   0.054
  224    HG   SER  27           HG       SER  27   7.778   7.795   2.127
  225    H    SER  28           HN       SER  28   7.150  10.040   0.116
  226    HA   SER  28           HA       SER  28   8.121   9.530  -2.668
  227   1HB   SER  28          HB2       SER  28   7.324  11.956  -3.084
  228   2HB   SER  28          HB1       SER  28   6.088  10.703  -2.996
  229    HG   SER  28           HG       SER  28   5.635  12.578  -1.704
  230    H    ARG  29           HN       ARG  29  10.295   9.881  -2.624
  231    HA   ARG  29           HA       ARG  29  11.497  12.344  -1.799
  232   1HB   ARG  29          HB2       ARG  29  10.931  10.376   0.256
  233   2HB   ARG  29          HB1       ARG  29  12.669  10.659   0.138
  234   1HG   ARG  29          HG2       ARG  29  12.482  12.904   0.694
  235   2HG   ARG  29          HG1       ARG  29  10.823  13.018   0.106
  236   1HD   ARG  29          HD2       ARG  29  10.304  12.933   2.342
  237   2HD   ARG  29          HD1       ARG  29  10.538  11.186   2.129
  238    HE   ARG  29           HE       ARG  29  13.030  12.640   2.608
  239   1HH1  ARG  29          HH1       ARG  29  11.098  13.148   4.923
  240   2HH1  ARG  29          HH1       ARG  29  11.533  11.864   6.002
  241   1HH2  ARG  29          HH2       ARG  29  13.259  10.067   3.589
  242   2HH2  ARG  29          HH2       ARG  29  12.756  10.118   5.246
  243    H    SER  30           HN       SER  30  13.815  12.312  -2.187
  244    HA   SER  30           HA       SER  30  14.658  10.083  -3.955
  245   1HB   SER  30          HB2       SER  30  14.877  12.830  -4.012
  246   2HB   SER  30          HB1       SER  30  16.473  12.348  -3.442
  247    HG   SER  30           HG       SER  30  15.117  11.449  -5.772
  248    H    THR  31           HN       THR  31  14.571   9.991  -0.861
  249    HA   THR  31           HA       THR  31  17.461   9.288  -0.448
  250    HB   THR  31           HB       THR  31  16.850   9.790   1.985
  251    HG1  THR  31           HG1      THR  31  14.961  11.155   2.126
  252   1HG2  THR  31          HG2       THR  31  17.673  11.865   1.630
  253   2HG2  THR  31          HG2       THR  31  16.305  12.321   0.614
  254   3HG2  THR  31          HG2       THR  31  17.664  11.437  -0.081
  255    H    CYS  32           HN       CYS  32  14.179   8.157  -0.374
  256    HA   CYS  32           HA       CYS  32  14.833   5.804   1.306
  257   1HB   CYS  32          HB2       CYS  32  12.322   6.716  -0.137
  258   2HB   CYS  32          HB1       CYS  32  12.404   5.367   0.996
  259    H    LEU  33           HN       LEU  33  13.219   3.894   0.009
  260    HA   LEU  33           HA       LEU  33  15.023   2.934  -2.060
  261   1HB   LEU  33          HB2       LEU  33  13.285   1.837  -0.254
  262   2HB   LEU  33          HB1       LEU  33  12.337   1.726  -1.738
  263    HG   LEU  33           HG       LEU  33  15.023   0.961  -2.349
  264   1HD1  LEU  33          HD1       LEU  33  15.667   0.145  -0.315
  265   2HD1  LEU  33          HD1       LEU  33  14.643  -1.218  -0.767
  266   3HD1  LEU  33          HD1       LEU  33  14.010   0.050   0.283
  267   1HD2  LEU  33          HD2       LEU  33  12.859   0.270  -3.446
  268   2HD2  LEU  33          HD2       LEU  33  12.545  -0.762  -2.051
  269   3HD2  LEU  33          HD2       LEU  33  13.938  -1.077  -3.084
  270    H    LYS  34           HN       LYS  34  14.518   5.128  -3.281
  271    HA   LYS  34           HA       LYS  34  13.638   6.093  -5.251
  272   1HB   LYS  34          HB2       LYS  34  13.546   3.262  -5.496
  273   2HB   LYS  34          HB1       LYS  34  12.025   3.877  -6.145
  274   1HG   LYS  34          HG2       LYS  34  13.285   5.464  -7.568
  275   2HG   LYS  34          HG1       LYS  34  14.799   4.810  -6.942
  276   1HD   LYS  34          HD2       LYS  34  14.352   2.646  -7.895
  277   2HD   LYS  34          HD1       LYS  34  12.705   3.113  -8.321
  278   1HE   LYS  34          HE2       LYS  34  13.444   3.895 -10.312
  279   2HE   LYS  34          HE1       LYS  34  14.524   5.025  -9.470
  280   1HZ   LYS  34          HZ1       LYS  34  16.003   3.045  -9.072
  281   2HZ   LYS  34          HZ2       LYS  34  15.923   3.583 -10.682
  282   3HZ   LYS  34          HZ3       LYS  34  15.059   2.201 -10.200
  283    H    ALA  35           HN       ALA  35  11.074   5.579  -6.438
  284    HA   ALA  35           HA       ALA  35   9.309   6.678  -4.285
  285   1HB   ALA  35          HB1       ALA  35   8.079   7.624  -6.242
  286   2HB   ALA  35          HB2       ALA  35   9.245   6.849  -7.314
  287   3HB   ALA  35          HB3       ALA  35   9.771   8.120  -6.211
  288    H    GLY  36           HN       GLY  36   7.914   5.157  -3.476
  289   1HA   GLY  36          HA2       GLY  36   6.296   3.566  -5.337
  290   2HA   GLY  36          HA1       GLY  36   7.337   2.613  -4.276
  291    H    VAL  37           HN       VAL  37   4.891   1.951  -3.681
  292    HA   VAL  37           HA       VAL  37   3.901   3.870  -1.596
  293    HB   VAL  37           HB       VAL  37   2.511   1.494  -2.869
  294   1HG1  VAL  37          HG1       VAL  37   1.409   2.112  -0.857
  295   2HG1  VAL  37          HG1       VAL  37   0.494   2.918  -2.131
  296   3HG1  VAL  37          HG1       VAL  37   1.649   3.832  -1.160
  297   1HG2  VAL  37          HG2       VAL  37   3.201   4.033  -4.023
  298   2HG2  VAL  37          HG2       VAL  37   1.455   3.982  -3.780
  299   3HG2  VAL  37          HG2       VAL  37   2.249   2.732  -4.737
  300    H    ILE  38           HN       ILE  38   2.861   2.627   0.327
  301    HA   ILE  38           HA       ILE  38   4.531   0.236   1.032
  302    HB   ILE  38           HB       ILE  38   3.693   2.652   2.667
  303   1HG1  ILE  38          HG1       ILE  38   6.366   2.458   2.944
  304   2HG1  ILE  38          HG1       ILE  38   6.198   1.712   1.354
  305   1HG2  ILE  38          HG2       ILE  38   5.544   0.928   4.025
  306   2HG2  ILE  38          HG2       ILE  38   4.145  -0.024   3.529
  307   3HG2  ILE  38          HG2       ILE  38   3.924   1.412   4.529
  308   1HD1  ILE  38          HD1       ILE  38   5.105   4.431   2.143
  309   2HD1  ILE  38          HD1       ILE  38   4.947   3.685   0.554
  310   3HD1  ILE  38          HD1       ILE  38   6.537   4.152   1.153
  311    H    PHE  39           HN       PHE  39   3.166  -1.514   1.354
  312    HA   PHE  39           HA       PHE  39   0.357  -0.899   2.168
  313   1HB   PHE  39          HB2       PHE  39   1.689  -3.028   0.522
  314   2HB   PHE  39          HB1       PHE  39   0.111  -3.341   1.244
  315    HD1  PHE  39           HD1      PHE  39  -1.791  -2.706   0.073
  316    HD2  PHE  39           HD2      PHE  39   1.909  -0.662  -0.671
  317    HE1  PHE  39           HE1      PHE  39  -2.882  -1.366  -1.692
  318    HE2  PHE  39           HE2      PHE  39   0.811   0.677  -2.447
  319    HZ   PHE  39           HZ       PHE  39  -1.589   0.324  -2.959
  320    H    THR  40           HN       THR  40  -0.432  -1.714   4.052
  321    HA   THR  40           HA       THR  40   1.394  -3.387   5.702
  322    HB   THR  40           HB       THR  40  -0.942  -1.567   6.348
  323    HG1  THR  40           HG1      THR  40   1.153  -0.672   5.762
  324   1HG2  THR  40          HG2       THR  40  -0.888  -2.239   8.536
  325   2HG2  THR  40          HG2       THR  40   0.840  -2.588   8.493
  326   3HG2  THR  40          HG2       THR  40  -0.308  -3.745   7.830
  327    H    THR  41           HN       THR  41   0.626  -5.316   6.587
  328    HA   THR  41           HA       THR  41  -1.782  -6.441   5.311
  329    HB   THR  41           HB       THR  41  -0.135  -7.989   7.239
  330    HG1  THR  41           HG1      THR  41   0.854  -6.850   4.851
  331   1HG2  THR  41          HG2       THR  41  -1.993  -8.678   5.445
  332   2HG2  THR  41          HG2       THR  41  -0.653  -9.748   5.856
  333   3HG2  THR  41          HG2       THR  41  -0.577  -8.760   4.397
  334    H    LYS  42           HN       LYS  42  -3.026  -8.004   6.952
  335    HA   LYS  42           HA       LYS  42  -4.186  -6.292   8.997
  336   1HB   LYS  42          HB2       LYS  42  -4.737  -8.738   7.572
  337   2HB   LYS  42          HB1       LYS  42  -4.996  -8.994   9.297
  338   1HG   LYS  42          HG2       LYS  42  -6.085  -6.445   8.677
  339   2HG   LYS  42          HG1       LYS  42  -6.649  -7.556   7.430
  340   1HD   LYS  42          HD2       LYS  42  -8.109  -8.473   8.872
  341   2HD   LYS  42          HD1       LYS  42  -6.796  -8.876   9.977
  342   1HE   LYS  42          HE2       LYS  42  -7.460  -7.245  11.398
  343   2HE   LYS  42          HE1       LYS  42  -7.333  -6.035  10.106
  344   1HZ   LYS  42          HZ1       LYS  42  -9.642  -6.443  11.030
  345   2HZ   LYS  42          HZ2       LYS  42  -9.583  -7.956  10.258
  346   3HZ   LYS  42          HZ3       LYS  42  -9.481  -6.527   9.344
  347    H    LYS  43           HN       LYS  43  -1.954  -9.036   8.971
  348    HA   LYS  43           HA       LYS  43  -1.943  -9.623  11.764
  349   1HB   LYS  43          HB2       LYS  43  -0.377 -10.155   9.347
  350   2HB   LYS  43          HB1       LYS  43   0.624 -10.102  10.798
  351   1HG   LYS  43          HG2       LYS  43  -0.910 -11.711  11.899
  352   2HG   LYS  43          HG1       LYS  43  -1.862 -11.795  10.415
  353   1HD   LYS  43          HD2       LYS  43   0.221 -12.529   9.206
  354   2HD   LYS  43          HD1       LYS  43   1.032 -12.620  10.770
  355   1HE   LYS  43          HE2       LYS  43  -1.523 -14.009  10.861
  356   2HE   LYS  43          HE1       LYS  43  -0.482 -14.661   9.578
  357   1HZ   LYS  43          HZ1       LYS  43   1.272 -14.993  11.074
  358   2HZ   LYS  43          HZ2       LYS  43  -0.098 -15.556  11.908
  359   3HZ   LYS  43          HZ3       LYS  43   0.559 -14.033  12.277
  360    H    GLY  44           HN       GLY  44  -0.603  -6.954   9.979
  361   1HA   GLY  44          HA2       GLY  44  -0.023  -4.942  11.325
  362   2HA   GLY  44          HA1       GLY  44   0.763  -6.034  12.463
  363    H    GLN  45           HN       GLN  45   1.074  -6.624   9.048
  364    HA   GLN  45           HA       GLN  45   3.993  -6.121   9.258
  365   1HB   GLN  45          HB2       GLN  45   2.212  -7.941   7.932
  366   2HB   GLN  45          HB1       GLN  45   3.175  -7.110   6.710
  367   1HG   GLN  45          HG2       GLN  45   4.403  -8.344   9.184
  368   2HG   GLN  45          HG1       GLN  45   4.208  -9.236   7.675
  369   1HE2  GLN  45          HE2       GLN  45   5.923  -6.522   9.189
  370   2HE2  GLN  45          HE2       GLN  45   7.069  -6.332   7.953
  371    H    GLN  46           HN       GLN  46   5.013  -5.094   7.243
  372    HA   GLN  46           HA       GLN  46   3.277  -3.111   5.869
  373   1HB   GLN  46          HB2       GLN  46   4.006  -2.078   7.983
  374   2HB   GLN  46          HB1       GLN  46   5.686  -2.448   7.593
  375   1HG   GLN  46          HG2       GLN  46   4.816  -1.123   5.327
  376   2HG   GLN  46          HG1       GLN  46   3.987  -0.262   6.625
  377   1HE2  GLN  46          HE2       GLN  46   5.990  -0.615   8.680
  378   2HE2  GLN  46          HE2       GLN  46   7.358   0.285   8.232
  379    H    SER  47           HN       SER  47   3.825  -4.136   3.874
  380    HA   SER  47           HA       SER  47   6.725  -4.288   3.181
  381   1HB   SER  47          HB2       SER  47   6.026  -5.898   1.573
  382   2HB   SER  47          HB1       SER  47   5.030  -6.218   2.989
  383    HG   SER  47           HG       SER  47   3.319  -5.516   1.949
  384    H    CYS  48           HN       CYS  48   7.542  -3.135   1.408
  385    HA   CYS  48           HA       CYS  48   6.132  -0.728   0.595
  386   1HB   CYS  48          HB2       CYS  48   8.761  -1.986   0.394
  387   2HB   CYS  48          HB1       CYS  48   8.317  -1.154  -1.095
  388    H    GLY  49           HN       GLY  49   4.588  -0.684  -1.026
  389   1HA   GLY  49          HA2       GLY  49   4.474  -2.953  -2.919
  390   2HA   GLY  49          HA1       GLY  49   3.227  -1.728  -2.713
  391    H    ASP  50           HN       ASP  50   4.801  -2.721  -5.099
  392    HA   ASP  50           HA       ASP  50   6.261  -0.300  -5.957
  393   1HB   ASP  50          HB2       ASP  50   7.211  -2.457  -6.467
  394   2HB   ASP  50          HB1       ASP  50   5.688  -3.030  -7.146
  395    HA   PRO  51           HA       PRO  51   2.468   1.285  -7.712
  396   1HB   PRO  51          HB2       PRO  51   3.586   3.368  -9.107
  397   2HB   PRO  51          HB1       PRO  51   3.294   3.414  -7.356
  398   1HG   PRO  51          HG2       PRO  51   5.819   2.832  -8.837
  399   2HG   PRO  51          HG1       PRO  51   5.565   3.815  -7.384
  400   1HD   PRO  51          HD2       PRO  51   6.538   1.302  -7.260
  401   2HD   PRO  51          HD1       PRO  51   5.495   1.977  -5.988
  402    H    LYS  52           HN       LYS  52   5.380   0.541  -9.567
  403    HA   LYS  52           HA       LYS  52   4.247   0.628 -12.195
  404   1HB   LYS  52          HB2       LYS  52   6.466  -1.022 -10.939
  405   2HB   LYS  52          HB1       LYS  52   6.188  -0.908 -12.678
  406   1HG   LYS  52          HG2       LYS  52   6.191   1.748 -11.708
  407   2HG   LYS  52          HG1       LYS  52   7.566   0.945 -10.948
  408   1HD   LYS  52          HD2       LYS  52   7.906   0.002 -13.424
  409   2HD   LYS  52          HD1       LYS  52   7.047   1.487 -13.838
  410   1HE   LYS  52          HE2       LYS  52   8.887   2.336 -11.930
  411   2HE   LYS  52          HE1       LYS  52   9.797   1.157 -12.895
  412   1HZ   LYS  52          HZ1       LYS  52   8.045   3.183 -14.152
  413   2HZ   LYS  52          HZ2       LYS  52   9.277   2.261 -14.873
  414   3HZ   LYS  52          HZ3       LYS  52   9.670   3.518 -13.798
  415    H    GLN  53           HN       GLN  53   3.966  -1.657  -9.568
  416    HA   GLN  53           HA       GLN  53   3.026  -3.899 -11.185
  417   1HB   GLN  53          HB2       GLN  53   2.983  -3.192  -8.234
  418   2HB   GLN  53          HB1       GLN  53   2.411  -4.738  -8.863
  419   1HG   GLN  53          HG2       GLN  53   5.163  -3.701  -9.539
  420   2HG   GLN  53          HG1       GLN  53   4.869  -4.613  -8.058
  421   1HE2  GLN  53          HE2       GLN  53   5.370  -4.897 -11.471
  422   2HE2  GLN  53          HE2       GLN  53   5.089  -6.567 -11.590
  423    H    GLU  54           HN       GLU  54   0.750  -4.706 -11.021
  424    HA   GLU  54           HA       GLU  54  -1.151  -2.448 -11.199
  425   1HB   GLU  54          HB2       GLU  54  -0.767  -5.053 -12.349
  426   2HB   GLU  54          HB1       GLU  54  -2.382  -4.972 -11.642
  427   1HG   GLU  54          HG2       GLU  54  -2.897  -2.962 -12.895
  428   2HG   GLU  54          HG1       GLU  54  -1.239  -2.858 -13.488
  429    H    TRP  55           HN       TRP  55  -0.250  -4.752  -8.768
  430    HA   TRP  55           HA       TRP  55  -2.930  -4.894  -7.580
  431   1HB   TRP  55          HB2       TRP  55  -1.808  -6.204  -5.885
  432   2HB   TRP  55          HB1       TRP  55  -1.200  -6.695  -7.457
  433    HD1  TRP  55           HD1      TRP  55   1.315  -6.262  -7.996
  434    HE1  TRP  55           HE1      TRP  55   3.320  -5.535  -6.539
  435    HE3  TRP  55           HE3      TRP  55  -1.143  -4.599  -3.838
  436    HZ2  TRP  55           HZ2      TRP  55   3.811  -4.433  -3.991
  437    HZ3  TRP  55           HZ3      TRP  55   0.128  -3.712  -1.904
  438    HH2  TRP  55           HH2      TRP  55   2.607  -3.620  -1.974
  439    H    VAL  56           HN       VAL  56   0.037  -2.960  -7.058
  440    HA   VAL  56           HA       VAL  56  -0.933  -1.670  -4.648
  441    HB   VAL  56           HB       VAL  56   0.936  -0.646  -6.831
  442   1HG1  VAL  56          HG1       VAL  56   0.679   1.265  -5.610
  443   2HG1  VAL  56          HG1       VAL  56   1.722   0.456  -4.439
  444   3HG1  VAL  56          HG1       VAL  56  -0.028   0.398  -4.251
  445   1HG2  VAL  56          HG2       VAL  56   2.184  -2.422  -6.070
  446   2HG2  VAL  56          HG2       VAL  56   1.287  -2.528  -4.557
  447   3HG2  VAL  56          HG2       VAL  56   2.545  -1.308  -4.751
  448    H    GLN  57           HN       GLN  57  -1.086  -0.998  -8.118
  449    HA   GLN  57           HA       GLN  57  -2.621   1.444  -7.959
  450   1HB   GLN  57          HB2       GLN  57  -1.472  -0.377  -9.905
  451   2HB   GLN  57          HB1       GLN  57  -3.104   0.075 -10.397
  452   1HG   GLN  57          HG2       GLN  57  -2.574   2.328 -10.585
  453   2HG   GLN  57          HG1       GLN  57  -1.260   2.221  -9.413
  454   1HE2  GLN  57          HE2       GLN  57  -1.493   3.023 -12.473
  455   2HE2  GLN  57          HE2       GLN  57  -0.164   2.219 -13.158
  456    H    ARG  58           HN       ARG  58  -3.549  -1.906  -8.843
  457    HA   ARG  58           HA       ARG  58  -6.343  -1.590  -9.016
  458   1HB   ARG  58          HB2       ARG  58  -5.198  -3.635  -9.635
  459   2HB   ARG  58          HB1       ARG  58  -4.570  -3.838  -8.001
  460   1HG   ARG  58          HG2       ARG  58  -6.953  -4.030  -7.198
  461   2HG   ARG  58          HG1       ARG  58  -7.455  -4.059  -8.888
  462   1HD   ARG  58          HD2       ARG  58  -5.294  -5.944  -8.466
  463   2HD   ARG  58          HD1       ARG  58  -6.635  -6.273  -7.351
  464    HE   ARG  58           HE       ARG  58  -7.812  -5.712  -9.847
  465   1HH1  ARG  58          HH2       ARG  58  -5.402  -7.176 -10.889
  466   2HH1  ARG  58          HH2       ARG  58  -5.952  -8.818 -10.886
  467   1HH2  ARG  58          HH1       ARG  58  -8.642  -8.192  -8.790
  468   2HH2  ARG  58          HH1       ARG  58  -7.787  -9.394  -9.698
  469    H    TYR  59           HN       TYR  59  -4.253  -2.015  -6.201
  470    HA   TYR  59           HA       TYR  59  -6.364  -2.246  -4.237
  471   1HB   TYR  59          HB2       TYR  59  -3.411  -1.646  -4.272
  472   2HB   TYR  59          HB1       TYR  59  -4.328  -1.545  -2.776
  473    HD1  TYR  59           HD1      TYR  59  -2.963  -3.350  -1.802
  474    HD2  TYR  59           HD2      TYR  59  -5.352  -4.009  -5.316
  475    HE1  TYR  59           HE1      TYR  59  -2.762  -5.800  -1.476
  476    HE2  TYR  59           HE2      TYR  59  -5.147  -6.457  -4.982
  477    HH   TYR  59           HH       TYR  59  -3.955  -8.064  -3.883
  478    H    MET  60           HN       MET  60  -4.088   0.410  -4.973
  479    HA   MET  60           HA       MET  60  -5.124   2.427  -3.359
  480   1HB   MET  60          HB2       MET  60  -3.347   2.136  -5.512
  481   2HB   MET  60          HB1       MET  60  -4.453   3.422  -5.972
  482   1HG   MET  60          HG2       MET  60  -3.864   4.770  -4.156
  483   2HG   MET  60          HG1       MET  60  -3.289   3.398  -3.210
  484   1HE   MET  60          HE1       MET  60  -1.310   1.764  -4.785
  485   2HE   MET  60          HE2       MET  60  -1.370   2.412  -3.150
  486   3HE   MET  60          HE3       MET  60   0.080   2.627  -4.123
  487    H    LYS  61           HN       LYS  61  -6.486   1.084  -6.294
  488    HA   LYS  61           HA       LYS  61  -8.368   3.206  -6.861
  489   1HB   LYS  61          HB2       LYS  61  -7.702   0.473  -7.727
  490   2HB   LYS  61          HB1       LYS  61  -9.420   0.852  -7.863
  491   1HG   LYS  61          HG2       LYS  61  -8.529   3.098  -8.926
  492   2HG   LYS  61          HG1       LYS  61  -7.084   2.135  -9.238
  493   1HD   LYS  61          HD2       LYS  61  -8.702   0.373 -10.216
  494   2HD   LYS  61          HD1       LYS  61  -9.893   1.675 -10.239
  495   1HE   LYS  61          HE2       LYS  61  -8.659   2.944 -11.802
  496   2HE   LYS  61          HE1       LYS  61  -7.156   2.063 -11.463
  497   1HZ   LYS  61          HZ1       LYS  61  -8.237   1.298 -13.522
  498   2HZ   LYS  61          HZ2       LYS  61  -9.610   0.853 -12.626
  499   3HZ   LYS  61          HZ3       LYS  61  -8.128   0.066 -12.361
  500    H    ASN  62           HN       ASN  62  -8.869  -0.054  -5.428
  501    HA   ASN  62           HA       ASN  62 -11.557   0.494  -4.548
  502   1HB   ASN  62          HB2       ASN  62 -10.271  -1.725  -4.937
  503   2HB   ASN  62          HB1       ASN  62  -9.631  -1.481  -3.311
  504   1HD2  ASN  62          HD2       ASN  62 -11.197  -1.486  -1.503
  505   2HD2  ASN  62          HD2       ASN  62 -12.731  -2.188  -1.695
  506    H    LEU  63           HN       LEU  63  -8.404   1.165  -3.213
  507    HA   LEU  63           HA       LEU  63  -9.278   1.592  -0.467
  508   1HB   LEU  63          HB2       LEU  63  -6.839   2.001  -2.162
  509   2HB   LEU  63          HB1       LEU  63  -6.917   2.806  -0.591
  510    HG   LEU  63           HG       LEU  63  -7.725  -0.045  -0.629
  511   1HD1  LEU  63          HD1       LEU  63  -4.903  -0.035  -0.305
  512   2HD1  LEU  63          HD1       LEU  63  -5.248   0.798  -1.820
  513   3HD1  LEU  63          HD1       LEU  63  -5.840  -0.843  -1.562
  514   1HD2  LEU  63          HD2       LEU  63  -6.927   0.014   1.560
  515   2HD2  LEU  63          HD2       LEU  63  -7.400   1.698   1.335
  516   3HD2  LEU  63          HD2       LEU  63  -5.706   1.230   1.189
  517    H    ASP  64           HN       ASP  64  -8.925   3.569  -3.361
  518    HA   ASP  64           HA       ASP  64  -9.255   6.113  -1.939
  519   1HB   ASP  64          HB2       ASP  64  -8.750   5.085  -4.665
  520   2HB   ASP  64          HB1       ASP  64  -9.663   6.594  -4.607
  521    H    ALA  65           HN       ALA  65 -11.320   3.721  -3.421
  522    HA   ALA  65           HA       ALA  65 -13.607   5.414  -3.926
  523   1HB   ALA  65          HB1       ALA  65 -13.236   3.229  -4.981
  524   2HB   ALA  65          HB2       ALA  65 -14.750   3.202  -4.077
  525   3HB   ALA  65          HB3       ALA  65 -13.309   2.438  -3.406
  526    H    LYS  66           HN       LYS  66 -12.238   4.109  -1.028
  527    HA   LYS  66           HA       LYS  66 -14.487   3.708   0.632
  528   1HB   LYS  66          HB2       LYS  66 -12.107   3.234   1.173
  529   2HB   LYS  66          HB1       LYS  66 -11.798   4.967   1.276
  530   1HG   LYS  66          HG2       LYS  66 -12.781   5.149   3.320
  531   2HG   LYS  66          HG1       LYS  66 -14.076   4.027   2.903
  532   1HD   LYS  66          HD2       LYS  66 -12.866   2.829   4.519
  533   2HD   LYS  66          HD1       LYS  66 -12.205   2.209   3.005
  534   1HE   LYS  66          HE2       LYS  66 -10.142   2.945   3.576
  535   2HE   LYS  66          HE1       LYS  66 -10.764   4.594   3.788
  536   1HZ   LYS  66          HZ1       LYS  66 -10.058   3.930   5.914
  537   2HZ   LYS  66          HZ2       LYS  66 -10.740   2.382   5.759
  538   3HZ   LYS  66          HZ3       LYS  66 -11.743   3.741   5.942
  539    H    GLN  67           HN       GLN  67 -13.201   6.654  -0.710
  540    HA   GLN  67           HA       GLN  67 -14.025   8.641   1.087
  541   1HB   GLN  67          HB2       GLN  67 -12.773   8.879  -1.077
  542   2HB   GLN  67          HB1       GLN  67 -14.295   8.637  -1.936
  543   1HG   GLN  67          HG2       GLN  67 -14.991  10.751  -1.522
  544   2HG   GLN  67          HG1       GLN  67 -14.468  10.681   0.161
  545   1HE2  GLN  67          HE2       GLN  67 -13.481  12.849  -0.047
  546   2HE2  GLN  67          HE2       GLN  67 -12.018  13.052  -0.882
  547    H    LYS  68           HN       LYS  68 -15.985   7.138  -1.516
  548    HA   LYS  68           HA       LYS  68 -18.424   8.448  -0.458
  549   1HB   LYS  68          HB2       LYS  68 -19.404   7.571  -2.533
  550   2HB   LYS  68          HB1       LYS  68 -17.868   8.363  -2.885
  551   1HG   LYS  68          HG2       LYS  68 -17.136   6.457  -3.827
  552   2HG   LYS  68          HG1       LYS  68 -17.266   5.661  -2.258
  553   1HD   LYS  68          HD2       LYS  68 -18.607   4.429  -3.875
  554   2HD   LYS  68          HD1       LYS  68 -19.686   5.231  -2.733
  555   1HE   LYS  68          HE2       LYS  68 -20.392   6.815  -4.304
  556   2HE   LYS  68          HE1       LYS  68 -18.924   6.637  -5.286
  557   1HZ   LYS  68          HZ1       LYS  68 -20.811   4.397  -4.852
  558   2HZ   LYS  68          HZ2       LYS  68 -19.589   4.529  -6.025
  559   3HZ   LYS  68          HZ3       LYS  68 -20.993   5.478  -6.145
  560    H    LYS  69           HN       LYS  69 -16.750   5.528   0.057
  561    HA   LYS  69           HA       LYS  69 -19.263   4.050   0.724
  562   1HB   LYS  69          HB2       LYS  69 -16.947   3.380  -0.661
  563   2HB   LYS  69          HB1       LYS  69 -16.705   2.636   0.920
  564   1HG   LYS  69          HG2       LYS  69 -18.003   0.952   0.142
  565   2HG   LYS  69          HG1       LYS  69 -19.354   2.060   0.379
  566   1HD   LYS  69          HD2       LYS  69 -18.712   2.953  -1.992
  567   2HD   LYS  69          HD1       LYS  69 -17.869   1.412  -2.156
  568   1HE   LYS  69          HE2       LYS  69 -19.827   0.190  -2.190
  569   2HE   LYS  69          HE1       LYS  69 -20.675   1.328  -1.124
  570   1HZ   LYS  69          HZ1       LYS  69 -19.830   1.961  -3.899
  571   2HZ   LYS  69          HZ2       LYS  69 -20.781   2.928  -2.875
  572   3HZ   LYS  69          HZ3       LYS  69 -21.397   1.464  -3.480
  573    H    ALA  70           HN       ALA  70 -19.659   3.443   2.852
  574    HA   ALA  70           HA       ALA  70 -17.563   4.111   4.893
  575   1HB   ALA  70          HB1       ALA  70 -19.973   4.540   6.145
  576   2HB   ALA  70          HB2       ALA  70 -20.338   5.040   4.494
  577   3HB   ALA  70          HB3       ALA  70 -19.015   5.805   5.375
  578    H    SER  71           HN       SER  71 -17.193   1.679   4.606
  579    HA   SER  71           HA       SER  71 -19.206   0.113   6.192
  580   1HB   SER  71          HB2       SER  71 -18.249  -0.211   3.566
  581   2HB   SER  71          HB1       SER  71 -17.425  -1.449   4.510
  582    HG   SER  71           HG       SER  71 -19.334  -2.356   3.989
  583    HA   PRO  72           HA       PRO  72 -15.446   0.018   8.743
  584   1HB   PRO  72          HB2       PRO  72 -16.716  -0.739  11.039
  585   2HB   PRO  72          HB1       PRO  72 -16.639   0.946  10.483
  586   1HG   PRO  72          HG2       PRO  72 -18.847  -1.030  10.229
  587   2HG   PRO  72          HG1       PRO  72 -18.917   0.699  10.602
  588   1HD   PRO  72          HD2       PRO  72 -19.478  -0.307   8.144
  589   2HD   PRO  72          HD1       PRO  72 -18.796   1.317   8.396
  590    H    ARG  73           HN       ARG  73 -17.980  -2.415   8.392
  591    HA   ARG  73           HA       ARG  73 -15.942  -4.545   8.287
  592   1HB   ARG  73          HB2       ARG  73 -16.669  -3.985  10.730
  593   2HB   ARG  73          HB1       ARG  73 -18.179  -4.788  10.296
  594   1HG   ARG  73          HG2       ARG  73 -16.496  -6.644   9.375
  595   2HG   ARG  73          HG1       ARG  73 -15.439  -5.938  10.598
  596   1HD   ARG  73          HD2       ARG  73 -17.950  -6.199  11.857
  597   2HD   ARG  73          HD1       ARG  73 -17.691  -7.719  10.977
  598    HE   ARG  73           HE       ARG  73 -15.321  -7.617  12.054
  599   1HH1  ARG  73          HH2       ARG  73 -17.365  -8.818  13.849
  600   2HH1  ARG  73          HH2       ARG  73 -17.190  -7.883  15.297
  601   1HH2  ARG  73          HH1       ARG  73 -15.443  -5.320  13.746
  602   2HH2  ARG  73          HH1       ARG  73 -16.104  -5.902  15.238
  Start of MODEL    2
    1   1H    VAL   1          HT1       VAL   1  -4.695  -0.893  12.573
    2   2H    VAL   1          HT2       VAL   1  -3.994  -0.565  11.062
    3   3H    VAL   1          HT3       VAL   1  -5.556   0.001  11.417
    4    HA   VAL   1           HA       VAL   1  -4.772   1.609  12.924
    5    HB   VAL   1           HB       VAL   1  -3.299   0.035  14.083
    6   1HG1  VAL   1          HG1       VAL   1  -1.923   0.051  11.440
    7   2HG1  VAL   1          HG1       VAL   1  -2.169  -1.279  12.571
    8   3HG1  VAL   1          HG1       VAL   1  -0.904  -0.088  12.873
    9   1HG2  VAL   1          HG2       VAL   1  -2.856   2.680  13.869
   10   2HG2  VAL   1          HG2       VAL   1  -1.333   2.092  13.197
   11   3HG2  VAL   1          HG2       VAL   1  -1.815   1.628  14.828
   12    H    VAL   2           HN       VAL   2  -3.933   3.621  12.185
   13    HA   VAL   2           HA       VAL   2  -3.422   3.811   9.316
   14    HB   VAL   2           HB       VAL   2  -4.717   5.480  10.560
   15   1HG1  VAL   2          HG1       VAL   2  -2.582   6.819  11.949
   16   2HG1  VAL   2          HG1       VAL   2  -2.649   5.138  12.471
   17   3HG1  VAL   2          HG1       VAL   2  -4.078   6.161  12.608
   18   1HG2  VAL   2          HG2       VAL   2  -2.936   6.046   8.647
   19   2HG2  VAL   2          HG2       VAL   2  -2.203   6.979   9.954
   20   3HG2  VAL   2          HG2       VAL   2  -3.858   7.317   9.449
   21    H    ILE   3           HN       ILE   3  -1.503   3.322   8.504
   22    HA   ILE   3           HA       ILE   3   0.956   3.187   9.988
   23    HB   ILE   3           HB       ILE   3   0.518   1.808   8.050
   24   1HG1  ILE   3          HG1       ILE   3   2.592   3.914   7.357
   25   2HG1  ILE   3          HG1       ILE   3   2.867   2.496   8.367
   26   1HG2  ILE   3          HG2       ILE   3  -0.898   2.793   6.560
   27   2HG2  ILE   3          HG2       ILE   3   0.589   3.337   5.785
   28   3HG2  ILE   3          HG2       ILE   3  -0.276   4.409   6.884
   29   1HD1  ILE   3          HD1       ILE   3   3.039   1.118   6.582
   30   2HD1  ILE   3          HD1       ILE   3   3.247   2.592   5.636
   31   3HD1  ILE   3          HD1       ILE   3   1.652   1.852   5.778
   32    HA   PRO   4           HA       PRO   4   2.106   7.477   9.762
   33   1HB   PRO   4          HB2       PRO   4   4.777   7.188  10.333
   34   2HB   PRO   4          HB1       PRO   4   3.508   7.054  11.561
   35   1HG   PRO   4          HG2       PRO   4   4.993   4.909  10.129
   36   2HG   PRO   4          HG1       PRO   4   4.500   5.001  11.827
   37   1HD   PRO   4          HD2       PRO   4   3.174   3.525   9.970
   38   2HD   PRO   4          HD1       PRO   4   2.384   4.240  11.392
   39    H    SER   5           HN       SER   5   4.781   8.227   8.797
   40    HA   SER   5           HA       SER   5   4.474   7.446   5.919
   41   1HB   SER   5          HB2       SER   5   4.210   9.886   7.076
   42   2HB   SER   5          HB1       SER   5   5.931   9.909   6.705
   43    HG   SER   5           HG       SER   5   5.488   9.897   4.624
   44    HA   PRO   6           HA       PRO   6   8.747   6.212   7.475
   45   1HB   PRO   6          HB2       PRO   6   8.569   3.539   6.971
   46   2HB   PRO   6          HB1       PRO   6   8.089   4.261   8.521
   47   1HG   PRO   6          HG2       PRO   6   6.400   3.409   6.228
   48   2HG   PRO   6          HG1       PRO   6   6.111   3.247   7.966
   49   1HD   PRO   6          HD2       PRO   6   4.935   5.158   6.425
   50   2HD   PRO   6          HD1       PRO   6   5.276   5.362   8.159
   51    H    CYS   7           HN       CYS   7  10.128   4.378   5.981
   52    HA   CYS   7           HA       CYS   7   9.647   5.211   3.135
   53   1HB   CYS   7          HB2       CYS   7  11.730   5.900   4.804
   54   2HB   CYS   7          HB1       CYS   7  12.387   4.499   3.964
   55    H    CYS   8           HN       CYS   8  11.721   3.519   2.093
   56    HA   CYS   8           HA       CYS   8  10.981   0.766   2.952
   57   1HB   CYS   8          HB2       CYS   8  10.206   2.192   0.455
   58   2HB   CYS   8          HB1       CYS   8  10.700   0.510   0.277
   59    H    MET   9           HN       MET   9  12.577  -0.774   2.399
   60    HA   MET   9           HA       MET   9  15.100   0.362   1.240
   61   1HB   MET   9          HB2       MET   9  15.190  -0.381   3.587
   62   2HB   MET   9          HB1       MET   9  14.575  -1.967   3.120
   63   1HG   MET   9          HG2       MET   9  17.003  -2.084   3.348
   64   2HG   MET   9          HG1       MET   9  16.567  -2.266   1.649
   65   1HE   MET   9          HE1       MET   9  18.678  -1.261   3.904
   66   2HE   MET   9          HE2       MET   9  18.524   0.470   4.195
   67   3HE   MET   9          HE3       MET   9  19.772  -0.124   3.102
   68    H    PHE  10           HN       PHE  10  12.869  -2.399   1.184
   69    HA   PHE  10           HA       PHE  10  14.089  -3.225  -1.426
   70   1HB   PHE  10          HB2       PHE  10  13.888  -5.541  -0.698
   71   2HB   PHE  10          HB1       PHE  10  14.760  -4.645   0.546
   72    HD1  PHE  10           HD1      PHE  10  13.458  -3.787   2.571
   73    HD2  PHE  10           HD2      PHE  10  11.841  -6.636  -0.208
   74    HE1  PHE  10           HE1      PHE  10  11.746  -4.443   4.240
   75    HE2  PHE  10           HE2      PHE  10  10.131  -7.293   1.462
   76    HZ   PHE  10           HZ       PHE  10  10.082  -6.196   3.686
   77    H    PHE  11           HN       PHE  11  12.516  -4.445  -2.803
   78    HA   PHE  11           HA       PHE  11   9.763  -3.392  -2.418
   79   1HB   PHE  11          HB2       PHE  11  11.555  -3.972  -4.613
   80   2HB   PHE  11          HB1       PHE  11  10.040  -4.840  -4.843
   81    HD1  PHE  11           HD1      PHE  11  11.422  -2.175  -6.135
   82    HD2  PHE  11           HD2      PHE  11   8.113  -2.999  -3.522
   83    HE1  PHE  11           HE1      PHE  11  10.321  -0.075  -6.860
   84    HE2  PHE  11           HE2      PHE  11   7.022  -0.899  -4.246
   85    HZ   PHE  11           HZ       PHE  11   8.121   0.566  -5.915
   86    H    VAL  12           HN       VAL  12   7.973  -4.792  -2.242
   87    HA   VAL  12           HA       VAL  12   8.144  -7.212  -0.884
   88    HB   VAL  12           HB       VAL  12   5.851  -7.613  -1.952
   89   1HG1  VAL  12          HG1       VAL  12   5.183  -5.103  -1.097
   90   2HG1  VAL  12          HG1       VAL  12   6.763  -5.324  -0.345
   91   3HG1  VAL  12          HG1       VAL  12   5.468  -6.478  -0.032
   92   1HG2  VAL  12          HG2       VAL  12   5.526  -4.990  -3.034
   93   2HG2  VAL  12          HG2       VAL  12   5.357  -6.536  -3.869
   94   3HG2  VAL  12          HG2       VAL  12   6.921  -5.723  -3.827
   95    H    SER  13           HN       SER  13   8.483  -9.365  -1.467
   96    HA   SER  13           HA       SER  13   9.846 -10.038  -3.878
   97   1HB   SER  13          HB2       SER  13   8.575 -11.391  -1.567
   98   2HB   SER  13          HB1       SER  13   8.727 -12.384  -3.015
   99    HG   SER  13           HG       SER  13  10.598 -11.764  -1.261
  100    H    LYS  14           HN       LYS  14   6.451  -9.720  -3.125
  101    HA   LYS  14           HA       LYS  14   5.735 -10.053  -5.944
  102   1HB   LYS  14          HB2       LYS  14   4.263 -11.985  -5.531
  103   2HB   LYS  14          HB1       LYS  14   5.919 -12.379  -5.073
  104   1HG   LYS  14          HG2       LYS  14   5.171 -11.501  -2.707
  105   2HG   LYS  14          HG1       LYS  14   3.547 -11.841  -3.313
  106   1HD   LYS  14          HD2       LYS  14   3.861 -14.010  -2.808
  107   2HD   LYS  14          HD1       LYS  14   5.136 -14.069  -4.026
  108   1HE   LYS  14          HE2       LYS  14   6.808 -13.392  -2.365
  109   2HE   LYS  14          HE1       LYS  14   5.540 -13.235  -1.130
  110   1HZ   LYS  14          HZ1       LYS  14   6.557 -15.419  -1.003
  111   2HZ   LYS  14          HZ2       LYS  14   6.209 -15.707  -2.642
  112   3HZ   LYS  14          HZ3       LYS  14   4.946 -15.557  -1.516
  113    H    ARG  15           HN       ARG  15   3.004 -10.343  -5.694
  114    HA   ARG  15           HA       ARG  15   2.206  -7.738  -4.661
  115   1HB   ARG  15          HB2       ARG  15   0.033  -8.419  -5.591
  116   2HB   ARG  15          HB1       ARG  15   1.325  -8.830  -6.716
  117   1HG   ARG  15          HG2       ARG  15   0.899 -10.992  -4.838
  118   2HG   ARG  15          HG1       ARG  15  -0.605 -10.581  -5.665
  119   1HD   ARG  15          HD2       ARG  15   0.863 -10.578  -7.831
  120   2HD   ARG  15          HD1       ARG  15   1.996 -11.530  -6.851
  121    HE   ARG  15           HE       ARG  15  -0.808 -12.421  -6.728
  122   1HH1  ARG  15          HH2       ARG  15   1.374 -14.291  -6.114
  123   2HH1  ARG  15          HH2       ARG  15   1.536 -15.206  -7.576
  124   1HH2  ARG  15          HH1       ARG  15  -0.207 -12.918  -9.513
  125   2HH2  ARG  15          HH1       ARG  15   0.640 -14.428  -9.500
  126    H    ILE  16           HN       ILE  16  -0.435  -8.580  -3.725
  127    HA   ILE  16           HA       ILE  16   0.153 -10.119  -1.232
  128    HB   ILE  16           HB       ILE  16  -1.418  -7.600  -0.922
  129   1HG1  ILE  16          HG1       ILE  16   1.588  -7.585  -1.372
  130   2HG1  ILE  16          HG1       ILE  16   0.376  -6.707  -2.299
  131   1HG2  ILE  16          HG2       ILE  16   0.101  -9.487   0.666
  132   2HG2  ILE  16          HG2       ILE  16  -1.108  -8.314   1.179
  133   3HG2  ILE  16          HG2       ILE  16   0.581  -7.833   1.028
  134   1HD1  ILE  16          HD1       ILE  16   1.613  -5.300  -0.596
  135   2HD1  ILE  16          HD1       ILE  16   0.847  -6.262   0.666
  136   3HD1  ILE  16          HD1       ILE  16  -0.141  -5.282  -0.418
  137    HA   PRO  17           HA       PRO  17  -4.055 -11.273  -2.006
  138   1HB   PRO  17          HB2       PRO  17  -4.677 -12.425   0.388
  139   2HB   PRO  17          HB1       PRO  17  -3.594 -13.182  -0.794
  140   1HG   PRO  17          HG2       PRO  17  -2.970 -11.948   1.773
  141   2HG   PRO  17          HG1       PRO  17  -2.020 -13.076   0.799
  142   1HD   PRO  17          HD2       PRO  17  -1.710 -10.241   1.036
  143   2HD   PRO  17          HD1       PRO  17  -0.732 -11.373   0.081
  144    H    GLU  18           HN       GLU  18  -5.492  -9.549  -2.143
  145    HA   GLU  18           HA       GLU  18  -5.857  -7.373  -0.484
  146   1HB   GLU  18          HB2       GLU  18  -8.234  -7.412  -1.393
  147   2HB   GLU  18          HB1       GLU  18  -6.961  -7.554  -2.604
  148   1HG   GLU  18          HG2       GLU  18  -7.400  -9.795  -3.006
  149   2HG   GLU  18          HG1       GLU  18  -8.080 -10.057  -1.399
  150    H    ASN  19           HN       ASN  19  -6.969 -10.650   0.171
  151    HA   ASN  19           HA       ASN  19  -8.891  -9.968   2.216
  152   1HB   ASN  19          HB2       ASN  19  -8.856 -12.121   1.064
  153   2HB   ASN  19          HB1       ASN  19  -7.232 -12.450   1.669
  154   1HD2  ASN  19          HD2       ASN  19  -8.177 -14.415   2.745
  155   2HD2  ASN  19          HD2       ASN  19  -9.024 -14.237   4.206
  156    H    ARG  20           HN       ARG  20  -5.495  -9.694   2.170
  157    HA   ARG  20           HA       ARG  20  -5.328  -9.898   5.147
  158   1HB   ARG  20          HB2       ARG  20  -3.330 -10.208   2.894
  159   2HB   ARG  20          HB1       ARG  20  -2.874 -10.192   4.591
  160   1HG   ARG  20          HG2       ARG  20  -4.677 -12.053   4.857
  161   2HG   ARG  20          HG1       ARG  20  -4.522 -12.222   3.108
  162   1HD   ARG  20          HD2       ARG  20  -1.929 -12.284   3.646
  163   2HD   ARG  20          HD1       ARG  20  -2.496 -12.801   5.246
  164    HE   ARG  20           HE       ARG  20  -3.471 -14.160   2.765
  165   1HH1  ARG  20          HH2       ARG  20  -0.844 -14.869   4.369
  166   2HH1  ARG  20          HH2       ARG  20  -1.409 -16.266   5.224
  167   1HH2  ARG  20          HH1       ARG  20  -4.753 -15.660   4.533
  168   2HH2  ARG  20          HH1       ARG  20  -3.624 -16.713   5.317
  169    H    VAL  21           HN       VAL  21  -4.600  -7.909   2.320
  170    HA   VAL  21           HA       VAL  21  -3.107  -5.861   3.697
  171    HB   VAL  21           HB       VAL  21  -4.792  -5.718   1.175
  172   1HG1  VAL  21          HG1       VAL  21  -2.265  -4.184   1.731
  173   2HG1  VAL  21          HG1       VAL  21  -3.804  -3.596   2.355
  174   3HG1  VAL  21          HG1       VAL  21  -3.576  -3.796   0.617
  175   1HG2  VAL  21          HG2       VAL  21  -3.263  -7.566   0.948
  176   2HG2  VAL  21          HG2       VAL  21  -1.947  -6.637   1.666
  177   3HG2  VAL  21          HG2       VAL  21  -2.560  -6.208   0.068
  178    H    VAL  22           HN       VAL  22  -3.851  -3.793   4.420
  179    HA   VAL  22           HA       VAL  22  -6.804  -3.572   4.819
  180    HB   VAL  22           HB       VAL  22  -6.126  -2.440   6.963
  181   1HG1  VAL  22          HG1       VAL  22  -6.837  -4.712   7.106
  182   2HG1  VAL  22          HG1       VAL  22  -5.364  -4.590   8.067
  183   3HG1  VAL  22          HG1       VAL  22  -5.308  -5.292   6.450
  184   1HG2  VAL  22          HG2       VAL  22  -3.397  -3.541   6.257
  185   2HG2  VAL  22          HG2       VAL  22  -3.837  -2.785   7.783
  186   3HG2  VAL  22          HG2       VAL  22  -3.823  -1.832   6.303
  187    H    SER  23           HN       SER  23  -3.741  -1.856   4.391
  188    HA   SER  23           HA       SER  23  -4.961   0.262   2.829
  189   1HB   SER  23          HB2       SER  23  -5.780   0.742   5.117
  190   2HB   SER  23          HB1       SER  23  -4.118   0.778   5.699
  191    HG   SER  23           HG       SER  23  -4.012   2.758   5.023
  192    H    TYR  24           HN       TYR  24  -3.286   1.594   1.890
  193    HA   TYR  24           HA       TYR  24  -0.551   0.555   2.377
  194   1HB   TYR  24          HB2       TYR  24  -0.167   1.287   0.101
  195   2HB   TYR  24          HB1       TYR  24  -1.697   0.419   0.146
  196    HD1  TYR  24           HD1      TYR  24  -3.776   1.525  -0.321
  197    HD2  TYR  24           HD2      TYR  24  -0.149   3.792   0.070
  198    HE1  TYR  24           HE1      TYR  24  -4.936   3.538  -1.185
  199    HE2  TYR  24           HE2      TYR  24  -1.311   5.804  -0.792
  200    HH   TYR  24           HH       TYR  24  -3.225   6.418  -2.058
  201    H    GLN  25           HN       GLN  25   1.076   2.392   1.523
  202    HA   GLN  25           HA       GLN  25   0.456   5.059   2.683
  203   1HB   GLN  25          HB2       GLN  25   1.708   3.119   4.167
  204   2HB   GLN  25          HB1       GLN  25   3.088   3.907   3.402
  205   1HG   GLN  25          HG2       GLN  25   0.915   5.311   4.978
  206   2HG   GLN  25          HG1       GLN  25   2.550   4.982   5.546
  207   1HE2  GLN  25          HE2       GLN  25   4.280   5.783   3.719
  208   2HE2  GLN  25          HE2       GLN  25   4.002   7.363   3.164
  209    H    LEU  26           HN       LEU  26   1.216   6.552   1.184
  210    HA   LEU  26           HA       LEU  26   3.059   5.564  -0.914
  211   1HB   LEU  26          HB2       LEU  26   1.066   7.754  -0.559
  212   2HB   LEU  26          HB1       LEU  26   2.365   8.022  -1.723
  213    HG   LEU  26           HG       LEU  26   0.489   5.639  -1.693
  214   1HD1  LEU  26          HD1       LEU  26   0.547   7.330  -4.070
  215   2HD1  LEU  26          HD1       LEU  26   0.053   8.226  -2.635
  216   3HD1  LEU  26          HD1       LEU  26  -0.835   6.781  -3.123
  217   1HD2  LEU  26          HD2       LEU  26   2.519   4.847  -2.592
  218   2HD2  LEU  26          HD2       LEU  26   2.886   6.388  -3.363
  219   3HD2  LEU  26          HD2       LEU  26   1.618   5.354  -4.019
  220    H    SER  27           HN       SER  27   5.183   5.949  -0.755
  221    HA   SER  27           HA       SER  27   6.184   8.065   1.066
  222   1HB   SER  27          HB2       SER  27   8.364   6.863   0.559
  223   2HB   SER  27          HB1       SER  27   7.125   5.849   1.290
  224    HG   SER  27           HG       SER  27   7.879   4.737  -0.452
  225    H    SER  28           HN       SER  28   8.636   8.605  -0.243
  226    HA   SER  28           HA       SER  28   8.219   9.378  -3.017
  227   1HB   SER  28          HB2       SER  28   7.911  11.740  -2.665
  228   2HB   SER  28          HB1       SER  28   6.736  10.917  -1.643
  229    HG   SER  28           HG       SER  28   8.218  12.678  -0.751
  230    H    ARG  29           HN       ARG  29   9.999  11.330  -3.410
  231    HA   ARG  29           HA       ARG  29  12.562  10.108  -2.716
  232   1HB   ARG  29          HB2       ARG  29  11.514  11.610  -4.774
  233   2HB   ARG  29          HB1       ARG  29  12.510  12.795  -3.928
  234   1HG   ARG  29          HG2       ARG  29  14.306  10.881  -3.926
  235   2HG   ARG  29          HG1       ARG  29  13.344  10.231  -5.254
  236   1HD   ARG  29          HD2       ARG  29  13.638  12.251  -6.555
  237   2HD   ARG  29          HD1       ARG  29  14.398  13.078  -5.182
  238    HE   ARG  29           HE       ARG  29  16.303  11.542  -5.379
  239   1HH1  ARG  29          HH1       ARG  29  13.911  10.181  -7.278
  240   2HH1  ARG  29          HH1       ARG  29  14.918   9.878  -8.653
  241   1HH2  ARG  29          HH2       ARG  29  17.616  11.661  -7.402
  242   2HH2  ARG  29          HH2       ARG  29  17.016  10.715  -8.723
  243    H    SER  30           HN       SER  30  11.605  10.711  -0.277
  244    HA   SER  30           HA       SER  30  12.576  13.417   0.505
  245   1HB   SER  30          HB2       SER  30  10.337  12.405   1.187
  246   2HB   SER  30          HB1       SER  30  11.247  11.262   2.170
  247    HG   SER  30           HG       SER  30  10.476  13.605   2.901
  248    H    THR  31           HN       THR  31  13.138   9.967   1.178
  249    HA   THR  31           HA       THR  31  15.921  10.566   1.963
  250    HB   THR  31           HB       THR  31  15.105   8.960   4.066
  251    HG1  THR  31           HG1      THR  31  13.025   9.200   4.145
  252   1HG2  THR  31          HG2       THR  31  16.475  10.651   4.746
  253   2HG2  THR  31          HG2       THR  31  14.950  11.423   5.180
  254   3HG2  THR  31          HG2       THR  31  15.741  11.824   3.653
  255    H    CYS  32           HN       CYS  32  14.339   8.967  -0.081
  256    HA   CYS  32           HA       CYS  32  15.697   6.344   0.418
  257   1HB   CYS  32          HB2       CYS  32  12.845   7.027  -0.133
  258   2HB   CYS  32          HB1       CYS  32  13.483   5.572  -0.898
  259    H    LEU  33           HN       LEU  33  16.208   5.191  -1.588
  260    HA   LEU  33           HA       LEU  33  17.236   6.841  -3.679
  261   1HB   LEU  33          HB2       LEU  33  16.914   3.991  -3.010
  262   2HB   LEU  33          HB1       LEU  33  17.001   4.314  -4.741
  263    HG   LEU  33           HG       LEU  33  18.967   5.896  -3.322
  264   1HD1  LEU  33          HD1       LEU  33  19.577   2.970  -3.146
  265   2HD1  LEU  33          HD1       LEU  33  18.590   3.693  -1.876
  266   3HD1  LEU  33          HD1       LEU  33  20.215   4.307  -2.187
  267   1HD2  LEU  33          HD2       LEU  33  18.687   4.877  -5.797
  268   2HD2  LEU  33          HD2       LEU  33  19.701   3.615  -5.099
  269   3HD2  LEU  33          HD2       LEU  33  20.265   5.287  -5.127
  270    H    LYS  34           HN       LYS  34  14.895   4.262  -4.342
  271    HA   LYS  34           HA       LYS  34  13.672   5.935  -6.458
  272   1HB   LYS  34          HB2       LYS  34  14.271   3.205  -6.014
  273   2HB   LYS  34          HB1       LYS  34  12.513   3.315  -6.080
  274   1HG   LYS  34          HG2       LYS  34  12.504   3.856  -8.287
  275   2HG   LYS  34          HG1       LYS  34  13.909   4.912  -8.130
  276   1HD   LYS  34          HD2       LYS  34  14.997   2.421  -7.668
  277   2HD   LYS  34          HD1       LYS  34  13.778   2.075  -8.894
  278   1HE   LYS  34          HE2       LYS  34  15.609   2.674 -10.232
  279   2HE   LYS  34          HE1       LYS  34  14.802   4.245 -10.051
  280   1HZ   LYS  34          HZ1       LYS  34  17.108   4.477  -9.450
  281   2HZ   LYS  34          HZ2       LYS  34  16.999   3.183  -8.354
  282   3HZ   LYS  34          HZ3       LYS  34  16.160   4.627  -8.054
  283    H    ALA  35           HN       ALA  35  11.088   5.050  -6.532
  284    HA   ALA  35           HA       ALA  35   9.942   5.820  -3.867
  285   1HB   ALA  35          HB1       ALA  35   8.773   6.542  -6.558
  286   2HB   ALA  35          HB2       ALA  35   9.996   7.552  -5.786
  287   3HB   ALA  35          HB3       ALA  35   8.443   7.282  -4.992
  288    H    GLY  36           HN       GLY  36   8.257   4.539  -3.178
  289   1HA   GLY  36          HA2       GLY  36   6.731   2.890  -5.072
  290   2HA   GLY  36          HA1       GLY  36   7.724   1.982  -3.929
  291    H    VAL  37           HN       VAL  37   5.067   1.514  -3.634
  292    HA   VAL  37           HA       VAL  37   4.093   3.421  -1.552
  293    HB   VAL  37           HB       VAL  37   2.656   1.053  -2.784
  294   1HG1  VAL  37          HG1       VAL  37   1.928   3.475  -1.169
  295   2HG1  VAL  37          HG1       VAL  37   1.381   1.808  -0.986
  296   3HG1  VAL  37          HG1       VAL  37   0.743   2.808  -2.292
  297   1HG2  VAL  37          HG2       VAL  37   3.352   3.692  -3.937
  298   2HG2  VAL  37          HG2       VAL  37   1.653   3.242  -4.073
  299   3HG2  VAL  37          HG2       VAL  37   2.900   2.195  -4.752
  300    H    ILE  38           HN       ILE  38   2.915   2.202   0.318
  301    HA   ILE  38           HA       ILE  38   4.497  -0.216   1.123
  302    HB   ILE  38           HB       ILE  38   3.666   2.212   2.739
  303   1HG1  ILE  38          HG1       ILE  38   6.345   2.036   3.010
  304   2HG1  ILE  38          HG1       ILE  38   6.176   1.323   1.407
  305   1HG2  ILE  38          HG2       ILE  38   4.663  -0.495   3.484
  306   2HG2  ILE  38          HG2       ILE  38   3.581   0.586   4.361
  307   3HG2  ILE  38          HG2       ILE  38   5.320   0.879   4.374
  308   1HD1  ILE  38          HD1       ILE  38   5.041   3.278   0.570
  309   2HD1  ILE  38          HD1       ILE  38   6.490   3.835   1.404
  310   3HD1  ILE  38          HD1       ILE  38   4.914   3.963   2.189
  311    H    PHE  39           HN       PHE  39   3.027  -1.893   1.354
  312    HA   PHE  39           HA       PHE  39   0.250  -1.154   2.152
  313   1HB   PHE  39          HB2       PHE  39   1.492  -3.339   0.512
  314   2HB   PHE  39          HB1       PHE  39  -0.106  -3.578   1.218
  315    HD1  PHE  39           HD1      PHE  39  -1.986  -2.786   0.085
  316    HD2  PHE  39           HD2      PHE  39   1.855  -1.052  -0.735
  317    HE1  PHE  39           HE1      PHE  39  -2.994  -1.399  -1.703
  318    HE2  PHE  39           HE2      PHE  39   0.847   0.335  -2.526
  319    HZ   PHE  39           HZ       PHE  39  -1.582   0.163  -3.007
  320    H    THR  40           HN       THR  40  -0.242  -1.539   4.219
  321    HA   THR  40           HA       THR  40   1.371  -3.373   5.853
  322    HB   THR  40           HB       THR  40  -0.927  -1.455   6.314
  323    HG1  THR  40           HG1      THR  40   0.739  -0.205   6.445
  324   1HG2  THR  40          HG2       THR  40  -1.146  -3.380   7.862
  325   2HG2  THR  40          HG2       THR  40  -0.702  -1.900   8.715
  326   3HG2  THR  40          HG2       THR  40   0.518  -3.130   8.387
  327    H    THR  41           HN       THR  41   0.603  -5.341   6.668
  328    HA   THR  41           HA       THR  41  -1.820  -6.438   5.378
  329    HB   THR  41           HB       THR  41  -0.050  -7.964   7.241
  330    HG1  THR  41           HG1      THR  41   0.679  -7.252   4.597
  331   1HG2  THR  41          HG2       THR  41  -1.850  -9.154   6.171
  332   2HG2  THR  41          HG2       THR  41  -0.343  -9.670   5.415
  333   3HG2  THR  41          HG2       THR  41  -1.394  -8.520   4.590
  334    H    LYS  42           HN       LYS  42  -3.336  -7.716   6.772
  335    HA   LYS  42           HA       LYS  42  -4.312  -6.213   9.003
  336   1HB   LYS  42          HB2       LYS  42  -5.093  -8.332   7.349
  337   2HB   LYS  42          HB1       LYS  42  -5.059  -9.030   8.970
  338   1HG   LYS  42          HG2       LYS  42  -6.256  -6.610   9.447
  339   2HG   LYS  42          HG1       LYS  42  -6.872  -6.997   7.838
  340   1HD   LYS  42          HD2       LYS  42  -7.540  -9.250   8.676
  341   2HD   LYS  42          HD1       LYS  42  -7.022  -8.771  10.293
  342   1HE   LYS  42          HE2       LYS  42  -8.869  -7.461  10.628
  343   2HE   LYS  42          HE1       LYS  42  -8.884  -6.888   8.947
  344   1HZ   LYS  42          HZ1       LYS  42 -10.732  -8.421   9.419
  345   2HZ   LYS  42          HZ2       LYS  42  -9.610  -9.639   9.807
  346   3HZ   LYS  42          HZ3       LYS  42  -9.687  -9.023   8.224
  347    H    LYS  43           HN       LYS  43  -1.875  -8.690   8.752
  348    HA   LYS  43           HA       LYS  43  -1.971  -9.521  11.552
  349   1HB   LYS  43          HB2       LYS  43  -0.780 -10.305   9.092
  350   2HB   LYS  43          HB1       LYS  43   0.537 -10.025  10.231
  351   1HG   LYS  43          HG2       LYS  43  -1.900 -11.652  10.966
  352   2HG   LYS  43          HG1       LYS  43  -0.469 -12.380  10.232
  353   1HD   LYS  43          HD2       LYS  43   0.925 -11.685  12.063
  354   2HD   LYS  43          HD1       LYS  43  -0.362 -10.682  12.735
  355   1HE   LYS  43          HE2       LYS  43  -0.666 -13.679  12.390
  356   2HE   LYS  43          HE1       LYS  43  -0.054 -12.941  13.885
  357   1HZ   LYS  43          HZ1       LYS  43  -2.054 -11.447  13.773
  358   2HZ   LYS  43          HZ2       LYS  43  -2.388 -13.074  14.129
  359   3HZ   LYS  43          HZ3       LYS  43  -2.670 -12.468  12.567
  360    H    GLY  44           HN       GLY  44  -1.051  -6.620  10.206
  361   1HA   GLY  44          HA2       GLY  44  -0.034  -4.833  11.425
  362   2HA   GLY  44          HA1       GLY  44   0.673  -6.016  12.519
  363    H    GLN  45           HN       GLN  45   1.115  -6.994   9.306
  364    HA   GLN  45           HA       GLN  45   3.988  -6.488   9.463
  365   1HB   GLN  45          HB2       GLN  45   2.079  -8.104   8.001
  366   2HB   GLN  45          HB1       GLN  45   3.217  -7.353   6.883
  367   1HG   GLN  45          HG2       GLN  45   5.038  -8.125   8.577
  368   2HG   GLN  45          HG1       GLN  45   3.787  -9.215   9.180
  369   1HE2  GLN  45          HE2       GLN  45   5.097  -8.189   5.966
  370   2HE2  GLN  45          HE2       GLN  45   5.084  -9.753   5.303
  371    H    GLN  46           HN       GLN  46   5.039  -5.537   7.361
  372    HA   GLN  46           HA       GLN  46   3.440  -3.350   6.143
  373   1HB   GLN  46          HB2       GLN  46   5.778  -3.079   8.027
  374   2HB   GLN  46          HB1       GLN  46   5.457  -1.829   6.823
  375   1HG   GLN  46          HG2       GLN  46   3.077  -1.749   7.692
  376   2HG   GLN  46          HG1       GLN  46   3.604  -2.784   9.020
  377   1HE2  GLN  46          HE2       GLN  46   2.799   0.244   8.796
  378   2HE2  GLN  46          HE2       GLN  46   4.037   1.029   9.651
  379    H    SER  47           HN       SER  47   3.797  -4.296   4.087
  380    HA   SER  47           HA       SER  47   6.634  -4.716   3.245
  381   1HB   SER  47          HB2       SER  47   4.236  -6.158   2.964
  382   2HB   SER  47          HB1       SER  47   4.558  -5.493   1.366
  383    HG   SER  47           HG       SER  47   6.375  -6.960   2.989
  384    H    CYS  48           HN       CYS  48   7.298  -3.830   1.163
  385    HA   CYS  48           HA       CYS  48   6.058  -1.205   0.587
  386   1HB   CYS  48          HB2       CYS  48   8.535  -2.607  -0.463
  387   2HB   CYS  48          HB1       CYS  48   8.128  -0.913  -0.732
  388    H    GLY  49           HN       GLY  49   4.492  -1.103  -0.989
  389   1HA   GLY  49          HA2       GLY  49   4.396  -3.248  -3.035
  390   2HA   GLY  49          HA1       GLY  49   3.107  -2.095  -2.703
  391    H    ASP  50           HN       ASP  50   4.760  -2.839  -5.172
  392    HA   ASP  50           HA       ASP  50   6.012  -0.242  -5.835
  393   1HB   ASP  50          HB2       ASP  50   6.955  -2.530  -6.400
  394   2HB   ASP  50          HB1       ASP  50   5.619  -2.723  -7.535
  395    HA   PRO  51           HA       PRO  51   2.228   1.206  -7.650
  396   1HB   PRO  51          HB2       PRO  51   3.276   3.268  -9.131
  397   2HB   PRO  51          HB1       PRO  51   3.035   3.359  -7.373
  398   1HG   PRO  51          HG2       PRO  51   5.524   2.781  -8.912
  399   2HG   PRO  51          HG1       PRO  51   5.299   3.793  -7.476
  400   1HD   PRO  51          HD2       PRO  51   6.314   1.293  -7.336
  401   2HD   PRO  51          HD1       PRO  51   5.320   1.993  -6.039
  402    H    LYS  52           HN       LYS  52   5.062   0.241  -9.462
  403    HA   LYS  52           HA       LYS  52   3.910   0.325 -12.109
  404   1HB   LYS  52          HB2       LYS  52   6.176  -1.153 -10.755
  405   2HB   LYS  52          HB1       LYS  52   5.809  -1.401 -12.461
  406   1HG   LYS  52          HG2       LYS  52   6.273   0.854 -13.009
  407   2HG   LYS  52          HG1       LYS  52   6.196   1.366 -11.324
  408   1HD   LYS  52          HD2       LYS  52   8.378   0.904 -11.006
  409   2HD   LYS  52          HD1       LYS  52   8.190  -0.715 -11.684
  410   1HE   LYS  52          HE2       LYS  52   9.291  -0.030 -13.540
  411   2HE   LYS  52          HE1       LYS  52   8.000   1.149 -13.848
  412   1HZ   LYS  52          HZ1       LYS  52   9.042   2.690 -12.350
  413   2HZ   LYS  52          HZ2       LYS  52  10.188   2.205 -13.506
  414   3HZ   LYS  52          HZ3       LYS  52  10.237   1.561 -11.935
  415    H    GLN  53           HN       GLN  53   3.763  -1.930  -9.429
  416    HA   GLN  53           HA       GLN  53   2.751  -4.200 -10.921
  417   1HB   GLN  53          HB2       GLN  53   2.945  -3.321  -8.049
  418   2HB   GLN  53          HB1       GLN  53   2.025  -4.769  -8.459
  419   1HG   GLN  53          HG2       GLN  53   4.920  -4.266  -9.214
  420   2HG   GLN  53          HG1       GLN  53   4.378  -5.319  -7.907
  421   1HE2  GLN  53          HE2       GLN  53   3.010  -7.233  -8.568
  422   2HE2  GLN  53          HE2       GLN  53   3.217  -7.894 -10.118
  423    H    GLU  54           HN       GLU  54   0.495  -4.988 -10.758
  424    HA   GLU  54           HA       GLU  54  -1.439  -2.758 -10.978
  425   1HB   GLU  54          HB2       GLU  54  -1.536  -5.746 -11.496
  426   2HB   GLU  54          HB1       GLU  54  -2.892  -4.661 -11.792
  427   1HG   GLU  54          HG2       GLU  54  -2.009  -4.309 -13.839
  428   2HG   GLU  54          HG1       GLU  54  -0.741  -3.390 -13.028
  429    H    TRP  55           HN       TRP  55  -0.498  -5.082  -8.555
  430    HA   TRP  55           HA       TRP  55  -3.142  -5.182  -7.297
  431   1HB   TRP  55          HB2       TRP  55  -2.000  -6.506  -5.633
  432   2HB   TRP  55          HB1       TRP  55  -1.449  -7.010  -7.220
  433    HD1  TRP  55           HD1      TRP  55   1.067  -6.789  -7.757
  434    HE1  TRP  55           HE1      TRP  55   3.122  -6.065  -6.369
  435    HE3  TRP  55           HE3      TRP  55  -1.259  -4.726  -3.705
  436    HZ2  TRP  55           HZ2      TRP  55   3.696  -4.818  -3.910
  437    HZ3  TRP  55           HZ3      TRP  55   0.077  -3.775  -1.850
  438    HH2  TRP  55           HH2      TRP  55   2.556  -3.813  -1.945
  439    H    VAL  56           HN       VAL  56  -0.240  -3.168  -7.011
  440    HA   VAL  56           HA       VAL  56  -1.093  -1.879  -4.535
  441    HB   VAL  56           HB       VAL  56   0.666  -0.905  -6.832
  442   1HG1  VAL  56          HG1       VAL  56  -0.357   0.398  -4.455
  443   2HG1  VAL  56          HG1       VAL  56   0.628   1.075  -5.748
  444   3HG1  VAL  56          HG1       VAL  56   1.400   0.283  -4.377
  445   1HG2  VAL  56          HG2       VAL  56   2.313  -1.402  -4.704
  446   2HG2  VAL  56          HG2       VAL  56   2.027  -2.544  -6.017
  447   3HG2  VAL  56          HG2       VAL  56   1.117  -2.682  -4.516
  448    H    GLN  57           HN       GLN  57  -1.201  -1.033  -7.990
  449    HA   GLN  57           HA       GLN  57  -2.881   1.262  -7.810
  450   1HB   GLN  57          HB2       GLN  57  -1.648  -0.424  -9.761
  451   2HB   GLN  57          HB1       GLN  57  -3.348  -0.284 -10.205
  452   1HG   GLN  57          HG2       GLN  57  -2.541   2.307  -9.413
  453   2HG   GLN  57          HG1       GLN  57  -1.249   1.688 -10.442
  454   1HE2  GLN  57          HE2       GLN  57  -1.962   0.801 -12.625
  455   2HE2  GLN  57          HE2       GLN  57  -3.335   1.478 -13.362
  456    H    ARG  58           HN       ARG  58  -3.707  -2.181  -8.419
  457    HA   ARG  58           HA       ARG  58  -6.500  -1.969  -8.679
  458   1HB   ARG  58          HB2       ARG  58  -5.262  -4.035  -9.025
  459   2HB   ARG  58          HB1       ARG  58  -4.740  -4.053  -7.339
  460   1HG   ARG  58          HG2       ARG  58  -7.156  -4.213  -6.664
  461   2HG   ARG  58          HG1       ARG  58  -7.572  -4.379  -8.370
  462   1HD   ARG  58          HD2       ARG  58  -5.565  -6.264  -8.064
  463   2HD   ARG  58          HD1       ARG  58  -6.458  -6.382  -6.535
  464    HE   ARG  58           HE       ARG  58  -8.192  -6.194  -8.884
  465   1HH1  ARG  58          HH1       ARG  58  -5.991  -8.559  -8.323
  466   2HH1  ARG  58          HH1       ARG  58  -7.121  -9.821  -7.963
  467   1HH2  ARG  58          HH2       ARG  58  -9.846  -7.688  -7.754
  468   2HH2  ARG  58          HH2       ARG  58  -9.302  -9.329  -7.642
  469    H    TYR  59           HN       TYR  59  -4.553  -2.263  -5.702
  470    HA   TYR  59           HA       TYR  59  -6.815  -2.095  -3.892
  471   1HB   TYR  59          HB2       TYR  59  -3.842  -1.560  -3.554
  472   2HB   TYR  59          HB1       TYR  59  -4.977  -1.776  -2.230
  473    HD1  TYR  59           HD1      TYR  59  -2.846  -3.505  -1.975
  474    HD2  TYR  59           HD2      TYR  59  -6.164  -3.971  -4.671
  475    HE1  TYR  59           HE1      TYR  59  -2.458  -5.951  -2.017
  476    HE2  TYR  59           HE2      TYR  59  -5.767  -6.420  -4.706
  477    HH   TYR  59           HH       TYR  59  -3.080  -7.859  -3.890
  478    H    MET  60           HN       MET  60  -4.295   0.170  -4.936
  479    HA   MET  60           HA       MET  60  -5.015   2.511  -3.562
  480   1HB   MET  60          HB2       MET  60  -3.942   1.994  -6.352
  481   2HB   MET  60          HB1       MET  60  -3.941   3.586  -5.596
  482   1HG   MET  60          HG2       MET  60  -2.804   1.315  -4.027
  483   2HG   MET  60          HG1       MET  60  -1.851   1.931  -5.375
  484   1HE   MET  60          HE1       MET  60  -0.979   5.285  -4.876
  485   2HE   MET  60          HE2       MET  60  -2.730   5.427  -5.010
  486   3HE   MET  60          HE3       MET  60  -1.878   4.198  -5.942
  487    H    LYS  61           HN       LYS  61  -6.382   1.135  -6.548
  488    HA   LYS  61           HA       LYS  61  -8.047   3.333  -7.293
  489   1HB   LYS  61          HB2       LYS  61  -7.382   1.258  -8.603
  490   2HB   LYS  61          HB1       LYS  61  -8.584   0.373  -7.663
  491   1HG   LYS  61          HG2       LYS  61  -9.700   1.038  -9.666
  492   2HG   LYS  61          HG1       LYS  61 -10.269   2.143  -8.414
  493   1HD   LYS  61          HD2       LYS  61  -8.091   3.504  -9.265
  494   2HD   LYS  61          HD1       LYS  61  -8.529   2.677 -10.760
  495   1HE   LYS  61          HE2       LYS  61 -10.927   3.511 -10.342
  496   2HE   LYS  61          HE1       LYS  61 -10.211   4.598  -9.133
  497   1HZ   LYS  61          HZ1       LYS  61  -8.560   5.213 -10.907
  498   2HZ   LYS  61          HZ2       LYS  61 -10.146   5.761 -11.174
  499   3HZ   LYS  61          HZ3       LYS  61  -9.557   4.412 -12.020
  500    H    ASN  62           HN       ASN  62  -8.849   0.379  -5.405
  501    HA   ASN  62           HA       ASN  62 -11.532   1.315  -4.776
  502   1HB   ASN  62          HB2       ASN  62 -10.024  -1.052  -4.676
  503   2HB   ASN  62          HB1       ASN  62 -10.400  -0.690  -2.990
  504   1HD2  ASN  62          HD2       ASN  62 -12.154  -2.078  -2.553
  505   2HD2  ASN  62          HD2       ASN  62 -13.582  -2.124  -3.470
  506    H    LEU  63           HN       LEU  63  -8.384   1.386  -3.170
  507    HA   LEU  63           HA       LEU  63  -9.286   2.238  -0.582
  508   1HB   LEU  63          HB2       LEU  63  -6.769   2.101  -2.173
  509   2HB   LEU  63          HB1       LEU  63  -6.756   3.139  -0.743
  510    HG   LEU  63           HG       LEU  63  -7.972   0.441  -0.432
  511   1HD1  LEU  63          HD1       LEU  63  -6.148  -0.727  -1.027
  512   2HD1  LEU  63          HD1       LEU  63  -5.171   0.213   0.101
  513   3HD1  LEU  63          HD1       LEU  63  -5.372   0.762  -1.564
  514   1HD2  LEU  63          HD2       LEU  63  -5.974   1.260   1.497
  515   2HD2  LEU  63          HD2       LEU  63  -7.700   0.995   1.738
  516   3HD2  LEU  63          HD2       LEU  63  -7.113   2.573   1.206
  517    H    ASP  64           HN       ASP  64  -8.463   3.999  -3.542
  518    HA   ASP  64           HA       ASP  64  -8.461   6.628  -2.301
  519   1HB   ASP  64          HB2       ASP  64  -7.438   5.702  -4.538
  520   2HB   ASP  64          HB1       ASP  64  -9.031   6.067  -5.205
  521    H    ALA  65           HN       ALA  65 -10.868   4.649  -4.011
  522    HA   ALA  65           HA       ALA  65 -12.915   6.775  -3.797
  523   1HB   ALA  65          HB1       ALA  65 -12.335   4.523  -5.437
  524   2HB   ALA  65          HB2       ALA  65 -13.649   5.682  -5.627
  525   3HB   ALA  65          HB3       ALA  65 -13.895   4.218  -4.672
  526    H    LYS  66           HN       LYS  66 -11.682   4.928  -1.484
  527    HA   LYS  66           HA       LYS  66 -14.054   3.562  -0.455
  528   1HB   LYS  66          HB2       LYS  66 -11.493   3.070  -0.193
  529   2HB   LYS  66          HB1       LYS  66 -11.580   4.256   1.110
  530   1HG   LYS  66          HG2       LYS  66 -11.970   2.157   2.159
  531   2HG   LYS  66          HG1       LYS  66 -13.563   2.898   2.006
  532   1HD   LYS  66          HD2       LYS  66 -13.973   0.752   1.187
  533   2HD   LYS  66          HD1       LYS  66 -13.617   1.632  -0.299
  534   1HE   LYS  66          HE2       LYS  66 -11.978   0.112  -0.692
  535   2HE   LYS  66          HE1       LYS  66 -11.108   0.794   0.696
  536   1HZ   LYS  66          HZ1       LYS  66 -12.334  -0.643   2.169
  537   2HZ   LYS  66          HZ2       LYS  66 -11.585  -1.592   0.974
  538   3HZ   LYS  66          HZ3       LYS  66 -13.249  -1.259   0.881
  539    H    GLN  67           HN       GLN  67 -12.215   6.489   0.407
  540    HA   GLN  67           HA       GLN  67 -14.277   7.235   2.410
  541   1HB   GLN  67          HB2       GLN  67 -11.467   7.623   1.980
  542   2HB   GLN  67          HB1       GLN  67 -12.241   9.207   2.057
  543   1HG   GLN  67          HG2       GLN  67 -11.796   8.744   4.314
  544   2HG   GLN  67          HG1       GLN  67 -13.477   8.236   4.139
  545   1HE2  GLN  67          HE2       GLN  67 -12.265   6.993   6.203
  546   2HE2  GLN  67          HE2       GLN  67 -11.803   5.405   5.815
  547    H    LYS  68           HN       LYS  68 -12.528   9.149  -0.057
  548    HA   LYS  68           HA       LYS  68 -15.076  10.618  -0.601
  549   1HB   LYS  68          HB2       LYS  68 -12.138  11.243  -1.032
  550   2HB   LYS  68          HB1       LYS  68 -13.448  12.307  -1.540
  551   1HG   LYS  68          HG2       LYS  68 -13.549  13.167   0.536
  552   2HG   LYS  68          HG1       LYS  68 -13.936  11.567   1.173
  553   1HD   LYS  68          HD2       LYS  68 -11.923  12.405   2.271
  554   2HD   LYS  68          HD1       LYS  68 -11.497  11.042   1.234
  555   1HE   LYS  68          HE2       LYS  68 -10.776  12.611  -0.543
  556   2HE   LYS  68          HE1       LYS  68 -11.193  13.979   0.506
  557   1HZ   LYS  68          HZ1       LYS  68  -9.654  13.216   2.150
  558   2HZ   LYS  68          HZ2       LYS  68  -8.825  13.301   0.668
  559   3HZ   LYS  68          HZ3       LYS  68  -9.331  11.797   1.279
  560    H    LYS  69           HN       LYS  69 -15.221  11.370  -2.990
  561    HA   LYS  69           HA       LYS  69 -13.955   9.552  -4.948
  562   1HB   LYS  69          HB2       LYS  69 -16.157   8.720  -5.713
  563   2HB   LYS  69          HB1       LYS  69 -15.882   8.306  -4.020
  564   1HG   LYS  69          HG2       LYS  69 -17.056  10.821  -3.883
  565   2HG   LYS  69          HG1       LYS  69 -17.928  10.034  -5.199
  566   1HD   LYS  69          HD2       LYS  69 -17.513   8.211  -2.970
  567   2HD   LYS  69          HD1       LYS  69 -18.374   9.663  -2.462
  568   1HE   LYS  69          HE2       LYS  69 -20.158   9.283  -3.956
  569   2HE   LYS  69          HE1       LYS  69 -19.193   8.192  -4.971
  570   1HZ   LYS  69          HZ1       LYS  69 -18.983   6.753  -2.940
  571   2HZ   LYS  69          HZ2       LYS  69 -20.536   6.812  -3.625
  572   3HZ   LYS  69          HZ3       LYS  69 -20.189   7.703  -2.221
  573    H    ALA  70           HN       ALA  70 -13.823  12.406  -4.594
  574    HA   ALA  70           HA       ALA  70 -14.495  13.287  -7.269
  575   1HB   ALA  70          HB1       ALA  70 -16.638  13.197  -5.612
  576   2HB   ALA  70          HB2       ALA  70 -16.478  14.391  -6.900
  577   3HB   ALA  70          HB3       ALA  70 -16.045  14.818  -5.245
  578    H    SER  71           HN       SER  71 -13.633  15.424  -7.676
  579    HA   SER  71           HA       SER  71 -11.985  16.533  -5.424
  580   1HB   SER  71          HB2       SER  71 -11.325  15.508  -8.043
  581   2HB   SER  71          HB1       SER  71 -10.857  17.203  -7.934
  582    HG   SER  71           HG       SER  71  -9.263  15.669  -7.161
  583    HA   PRO  72           HA       PRO  72 -14.813  19.846  -6.948
  584   1HB   PRO  72          HB2       PRO  72 -15.312  20.920  -4.490
  585   2HB   PRO  72          HB1       PRO  72 -16.239  19.565  -5.160
  586   1HG   PRO  72          HG2       PRO  72 -14.032  19.545  -3.173
  587   2HG   PRO  72          HG1       PRO  72 -15.513  18.577  -3.228
  588   1HD   PRO  72          HD2       PRO  72 -13.071  17.633  -3.985
  589   2HD   PRO  72          HD1       PRO  72 -14.606  17.032  -4.652
  590    H    ARG  73           HN       ARG  73 -12.472  20.443  -7.709
  591    HA   ARG  73           HA       ARG  73 -11.761  23.018  -6.465
  592   1HB   ARG  73          HB2       ARG  73 -10.603  21.313  -5.089
  593   2HB   ARG  73          HB1       ARG  73  -9.839  20.668  -6.543
  594   1HG   ARG  73          HG2       ARG  73  -9.411  23.501  -6.479
  595   2HG   ARG  73          HG1       ARG  73  -8.950  22.833  -4.913
  596   1HD   ARG  73          HD2       ARG  73  -8.059  21.412  -7.409
  597   2HD   ARG  73          HD1       ARG  73  -7.179  22.856  -6.866
  598    HE   ARG  73           HE       ARG  73  -7.709  21.031  -4.672
  599   1HH1  ARG  73          HH2       ARG  73  -6.177  20.169  -7.442
  600   2HH1  ARG  73          HH2       ARG  73  -4.590  20.018  -6.771
  601   1HH2  ARG  73          HH1       ARG  73  -5.436  21.500  -3.753
  602   2HH2  ARG  73          HH1       ARG  73  -4.169  20.771  -4.680
  Start of MODEL    3
    1   1H    VAL   1          HT1       VAL   1  -4.725  10.279   8.192
    2   2H    VAL   1          HT2       VAL   1  -5.151   9.447   9.611
    3   3H    VAL   1          HT3       VAL   1  -5.118   8.630   8.121
    4    HA   VAL   1           HA       VAL   1  -2.827   9.596   9.733
    5    HB   VAL   1           HB       VAL   1  -3.617   6.962   8.448
    6   1HG1  VAL   1          HG1       VAL   1  -1.131   7.863   9.391
    7   2HG1  VAL   1          HG1       VAL   1  -1.589   6.194   9.055
    8   3HG1  VAL   1          HG1       VAL   1  -1.771   6.847  10.684
    9   1HG2  VAL   1          HG2       VAL   1  -3.761   6.524  11.110
   10   2HG2  VAL   1          HG2       VAL   1  -5.149   7.046  10.157
   11   3HG2  VAL   1          HG2       VAL   1  -4.216   8.228  11.074
   12    H    VAL   2           HN       VAL   2  -2.160  11.173   8.047
   13    HA   VAL   2           HA       VAL   2  -1.554  10.155   5.346
   14    HB   VAL   2           HB       VAL   2  -0.854  12.512   5.026
   15   1HG1  VAL   2          HG1       VAL   2  -3.462  11.903   6.403
   16   2HG1  VAL   2          HG1       VAL   2  -3.166  12.247   4.697
   17   3HG1  VAL   2          HG1       VAL   2  -3.088  13.548   5.887
   18   1HG2  VAL   2          HG2       VAL   2  -1.660  13.711   7.443
   19   2HG2  VAL   2          HG2       VAL   2  -0.014  13.600   6.817
   20   3HG2  VAL   2          HG2       VAL   2  -0.627  12.362   7.914
   21    H    ILE   3           HN       ILE   3   0.182   8.840   5.244
   22    HA   ILE   3           HA       ILE   3   2.466   8.939   7.000
   23    HB   ILE   3           HB       ILE   3   1.782   6.909   5.875
   24   1HG1  ILE   3          HG1       ILE   3   4.340   7.953   4.618
   25   2HG1  ILE   3          HG1       ILE   3   4.215   7.184   6.201
   26   1HG2  ILE   3          HG2       ILE   3   1.849   8.680   3.465
   27   2HG2  ILE   3          HG2       ILE   3   0.667   7.457   3.925
   28   3HG2  ILE   3          HG2       ILE   3   2.216   6.971   3.239
   29   1HD1  ILE   3          HD1       ILE   3   4.168   5.120   5.297
   30   2HD1  ILE   3          HD1       ILE   3   4.666   5.880   3.786
   31   3HD1  ILE   3          HD1       ILE   3   2.956   5.596   4.110
   32    HA   PRO   4           HA       PRO   4   4.623  12.199   4.914
   33   1HB   PRO   4          HB2       PRO   4   7.073  11.872   6.085
   34   2HB   PRO   4          HB1       PRO   4   5.692  12.610   6.918
   35   1HG   PRO   4          HG2       PRO   4   6.843   9.899   7.204
   36   2HG   PRO   4          HG1       PRO   4   6.037  10.920   8.400
   37   1HD   PRO   4          HD2       PRO   4   4.885   8.766   7.081
   38   2HD   PRO   4          HD1       PRO   4   4.001  10.050   7.928
   39    H    SER   5           HN       SER   5   7.359  10.014   5.353
   40    HA   SER   5           HA       SER   5   7.220   8.999   2.596
   41   1HB   SER   5          HB2       SER   5   8.045  11.176   2.114
   42   2HB   SER   5          HB1       SER   5   9.089  11.180   3.533
   43    HG   SER   5           HG       SER   5  10.529  10.527   2.137
   44    HA   PRO   6           HA       PRO   6   9.828   6.735   5.815
   45   1HB   PRO   6          HB2       PRO   6   8.203   4.577   6.201
   46   2HB   PRO   6          HB1       PRO   6   8.104   6.051   7.185
   47   1HG   PRO   6          HG2       PRO   6   6.407   5.177   4.907
   48   2HG   PRO   6          HG1       PRO   6   5.951   5.994   6.408
   49   1HD   PRO   6          HD2       PRO   6   6.198   7.275   4.014
   50   2HD   PRO   6          HD1       PRO   6   6.451   8.071   5.586
   51    H    CYS   7           HN       CYS   7  11.065   6.519   3.759
   52    HA   CYS   7           HA       CYS   7  10.515   4.845   1.593
   53   1HB   CYS   7          HB2       CYS   7  13.116   5.365   3.069
   54   2HB   CYS   7          HB1       CYS   7  13.012   4.709   1.435
   55    H    CYS   8           HN       CYS   8  11.646   2.674   1.156
   56    HA   CYS   8           HA       CYS   8  11.290   0.873   3.530
   57   1HB   CYS   8          HB2       CYS   8  10.566   0.801   0.644
   58   2HB   CYS   8          HB1       CYS   8  11.066  -0.730   1.361
   59    H    MET   9           HN       MET   9  12.534  -1.350   2.856
   60    HA   MET   9           HA       MET   9  15.371  -0.541   2.365
   61   1HB   MET   9          HB2       MET   9  14.882  -1.575   4.519
   62   2HB   MET   9          HB1       MET   9  14.062  -2.920   3.725
   63   1HG   MET   9          HG2       MET   9  16.235  -3.449   2.557
   64   2HG   MET   9          HG1       MET   9  17.008  -2.236   3.577
   65   1HE   MET   9          HE1       MET   9  18.422  -3.048   5.269
   66   2HE   MET   9          HE2       MET   9  18.616  -4.372   4.123
   67   3HE   MET   9          HE3       MET   9  18.445  -4.721   5.841
   68    H    PHE  10           HN       PHE  10  12.979  -3.069   1.564
   69    HA   PHE  10           HA       PHE  10  14.446  -3.532  -1.007
   70   1HB   PHE  10          HB2       PHE  10  14.193  -5.925  -0.659
   71   2HB   PHE  10          HB1       PHE  10  14.925  -5.246   0.792
   72    HD1  PHE  10           HD1      PHE  10  13.340  -4.618   2.745
   73    HD2  PHE  10           HD2      PHE  10  12.182  -7.149  -0.530
   74    HE1  PHE  10           HE1      PHE  10  11.466  -5.513   4.099
   75    HE2  PHE  10           HE2      PHE  10  10.310  -8.043   0.826
   76    HZ   PHE  10           HZ       PHE  10   9.950  -7.225   3.139
   77    H    PHE  11           HN       PHE  11  12.604  -5.528  -1.912
   78    HA   PHE  11           HA       PHE  11  10.025  -4.007  -1.968
   79   1HB   PHE  11          HB2       PHE  11  11.929  -4.579  -4.064
   80   2HB   PHE  11          HB1       PHE  11  10.392  -5.361  -4.432
   81    HD1  PHE  11           HD1      PHE  11   8.426  -3.563  -3.228
   82    HD2  PHE  11           HD2      PHE  11  12.019  -2.641  -5.394
   83    HE1  PHE  11           HE1      PHE  11   7.463  -1.379  -3.887
   84    HE2  PHE  11           HE2      PHE  11  11.056  -0.454  -6.054
   85    HZ   PHE  11           HZ       PHE  11   8.780   0.179  -5.301
   86    H    VAL  12           HN       VAL  12   8.162  -5.300  -1.969
   87    HA   VAL  12           HA       VAL  12   8.117  -7.780  -0.703
   88    HB   VAL  12           HB       VAL  12   5.862  -7.987  -1.865
   89   1HG1  VAL  12          HG1       VAL  12   5.542  -6.837   0.080
   90   2HG1  VAL  12          HG1       VAL  12   5.269  -5.485  -1.019
   91   3HG1  VAL  12          HG1       VAL  12   6.846  -5.699  -0.260
   92   1HG2  VAL  12          HG2       VAL  12   5.286  -6.637  -3.616
   93   2HG2  VAL  12          HG2       VAL  12   7.030  -6.513  -3.843
   94   3HG2  VAL  12          HG2       VAL  12   6.165  -5.254  -2.962
   95    H    SER  13           HN       SER  13   8.356  -9.913  -1.359
   96    HA   SER  13           HA       SER  13   9.812 -10.571  -3.718
   97   1HB   SER  13          HB2       SER  13   8.418 -11.899  -1.493
   98   2HB   SER  13          HB1       SER  13   8.460 -12.864  -2.965
   99    HG   SER  13           HG       SER  13  10.319 -13.127  -1.591
  100    H    LYS  14           HN       LYS  14   6.404 -10.091  -3.145
  101    HA   LYS  14           HA       LYS  14   5.830 -10.275  -6.010
  102   1HB   LYS  14          HB2       LYS  14   4.229 -12.147  -5.742
  103   2HB   LYS  14          HB1       LYS  14   5.857 -12.643  -5.281
  104   1HG   LYS  14          HG2       LYS  14   5.287 -12.171  -2.897
  105   2HG   LYS  14          HG1       LYS  14   3.635 -11.803  -3.397
  106   1HD   LYS  14          HD2       LYS  14   3.384 -14.040  -2.869
  107   2HD   LYS  14          HD1       LYS  14   3.842 -14.190  -4.565
  108   1HE   LYS  14          HE2       LYS  14   6.252 -14.009  -3.026
  109   2HE   LYS  14          HE1       LYS  14   5.213 -15.254  -2.299
  110   1HZ   LYS  14          HZ1       LYS  14   6.126 -15.040  -5.106
  111   2HZ   LYS  14          HZ2       LYS  14   4.774 -15.976  -4.679
  112   3HZ   LYS  14          HZ3       LYS  14   6.306 -16.346  -4.041
  113    H    ARG  15           HN       ARG  15   3.015 -10.605  -5.748
  114    HA   ARG  15           HA       ARG  15   2.307  -7.966  -4.673
  115   1HB   ARG  15          HB2       ARG  15   0.112  -8.546  -5.685
  116   2HB   ARG  15          HB1       ARG  15   1.442  -8.805  -6.809
  117   1HG   ARG  15          HG2       ARG  15   1.073 -11.191  -5.260
  118   2HG   ARG  15          HG1       ARG  15  -0.483 -10.703  -5.935
  119   1HD   ARG  15          HD2       ARG  15   1.415 -10.310  -8.000
  120   2HD   ARG  15          HD1       ARG  15   1.749 -11.907  -7.300
  121    HE   ARG  15           HE       ARG  15  -0.783 -12.297  -7.524
  122   1HH1  ARG  15          HH2       ARG  15  -1.412  -9.567  -8.605
  123   2HH1  ARG  15          HH2       ARG  15  -1.475  -9.862 -10.311
  124   1HH2  ARG  15          HH1       ARG  15   0.159 -12.913 -10.116
  125   2HH2  ARG  15          HH1       ARG  15  -0.588 -11.755 -11.165
  126    H    ILE  16           HN       ILE  16  -0.393  -8.702  -3.855
  127    HA   ILE  16           HA       ILE  16   0.020 -10.469  -1.490
  128    HB   ILE  16           HB       ILE  16  -1.350  -7.880  -0.953
  129   1HG1  ILE  16          HG1       ILE  16   1.645  -8.013  -1.457
  130   2HG1  ILE  16          HG1       ILE  16   0.477  -6.982  -2.279
  131   1HG2  ILE  16          HG2       ILE  16  -1.043  -8.765   1.083
  132   2HG2  ILE  16          HG2       ILE  16   0.675  -8.416   0.922
  133   3HG2  ILE  16          HG2       ILE  16   0.052  -9.990   0.446
  134   1HD1  ILE  16          HD1       ILE  16   0.055  -5.732  -0.239
  135   2HD1  ILE  16          HD1       ILE  16   1.797  -5.778  -0.510
  136   3HD1  ILE  16          HD1       ILE  16   1.064  -6.838   0.695
  137    HA   PRO  17           HA       PRO  17  -4.270 -11.171  -2.358
  138   1HB   PRO  17          HB2       PRO  17  -5.039 -12.362  -0.026
  139   2HB   PRO  17          HB1       PRO  17  -3.995 -13.158  -1.218
  140   1HG   PRO  17          HG2       PRO  17  -3.334 -12.120   1.415
  141   2HG   PRO  17          HG1       PRO  17  -2.430 -13.231   0.384
  142   1HD   PRO  17          HD2       PRO  17  -2.011 -10.411   0.795
  143   2HD   PRO  17          HD1       PRO  17  -1.018 -11.552  -0.136
  144    H    GLU  18           HN       GLU  18  -5.696  -9.435  -2.427
  145    HA   GLU  18           HA       GLU  18  -5.882  -7.274  -0.686
  146   1HB   GLU  18          HB2       GLU  18  -8.173  -7.021  -1.641
  147   2HB   GLU  18          HB1       GLU  18  -6.969  -7.420  -2.867
  148   1HG   GLU  18          HG2       GLU  18  -8.108  -9.276  -3.420
  149   2HG   GLU  18          HG1       GLU  18  -8.011  -9.857  -1.759
  150    H    ASN  19           HN       ASN  19  -7.137 -10.508  -0.163
  151    HA   ASN  19           HA       ASN  19  -9.082  -9.866   1.866
  152   1HB   ASN  19          HB2       ASN  19  -7.776 -12.176   0.645
  153   2HB   ASN  19          HB1       ASN  19  -8.053 -12.418   2.370
  154   1HD2  ASN  19          HD2       ASN  19 -10.124 -13.116   2.921
  155   2HD2  ASN  19          HD2       ASN  19 -11.498 -12.958   1.937
  156    H    ARG  20           HN       ARG  20  -5.595 -10.113   1.886
  157    HA   ARG  20           HA       ARG  20  -5.521 -10.171   4.862
  158   1HB   ARG  20          HB2       ARG  20  -3.493 -10.529   2.643
  159   2HB   ARG  20          HB1       ARG  20  -3.053 -10.511   4.346
  160   1HG   ARG  20          HG2       ARG  20  -4.980 -12.312   4.536
  161   2HG   ARG  20          HG1       ARG  20  -4.634 -12.544   2.822
  162   1HD   ARG  20          HD2       ARG  20  -2.734 -13.686   3.300
  163   2HD   ARG  20          HD1       ARG  20  -2.168 -12.389   4.373
  164    HE   ARG  20           HE       ARG  20  -3.041 -13.609   6.196
  165   1HH1  ARG  20          HH2       ARG  20  -2.820 -16.134   4.626
  166   2HH1  ARG  20          HH2       ARG  20  -4.431 -16.763   4.704
  167   1HH2  ARG  20          HH1       ARG  20  -5.841 -13.751   5.689
  168   2HH2  ARG  20          HH1       ARG  20  -6.144 -15.412   5.306
  169    H    VAL  21           HN       VAL  21  -4.635  -8.185   2.076
  170    HA   VAL  21           HA       VAL  21  -3.170  -6.169   3.536
  171    HB   VAL  21           HB       VAL  21  -4.718  -5.977   0.933
  172   1HG1  VAL  21          HG1       VAL  21  -4.033  -3.802   1.402
  173   2HG1  VAL  21          HG1       VAL  21  -2.630  -4.413   0.525
  174   3HG1  VAL  21          HG1       VAL  21  -2.603  -4.333   2.287
  175   1HG2  VAL  21          HG2       VAL  21  -2.555  -7.682   1.625
  176   2HG2  VAL  21          HG2       VAL  21  -1.885  -6.396   0.621
  177   3HG2  VAL  21          HG2       VAL  21  -3.216  -7.383   0.016
  178    H    VAL  22           HN       VAL  22  -3.931  -4.065   4.198
  179    HA   VAL  22           HA       VAL  22  -6.899  -3.818   4.411
  180    HB   VAL  22           HB       VAL  22  -6.348  -2.702   6.616
  181   1HG1  VAL  22          HG1       VAL  22  -5.916  -4.854   7.776
  182   2HG1  VAL  22          HG1       VAL  22  -5.548  -5.583   6.213
  183   3HG1  VAL  22          HG1       VAL  22  -7.172  -4.981   6.549
  184   1HG2  VAL  22          HG2       VAL  22  -4.143  -3.215   7.605
  185   2HG2  VAL  22          HG2       VAL  22  -3.988  -2.191   6.182
  186   3HG2  VAL  22          HG2       VAL  22  -3.628  -3.913   6.072
  187    H    SER  23           HN       SER  23  -3.788  -2.109   4.266
  188    HA   SER  23           HA       SER  23  -4.890   0.011   2.623
  189   1HB   SER  23          HB2       SER  23  -5.950   0.576   4.726
  190   2HB   SER  23          HB1       SER  23  -4.418   0.433   5.582
  191    HG   SER  23           HG       SER  23  -4.171   2.466   5.120
  192    H    TYR  24           HN       TYR  24  -3.200   1.226   1.729
  193    HA   TYR  24           HA       TYR  24  -0.497   0.267   2.323
  194   1HB   TYR  24          HB2       TYR  24   0.020   1.227   0.217
  195   2HB   TYR  24          HB1       TYR  24  -1.565   0.501   0.060
  196    HD1  TYR  24           HD1      TYR  24  -2.702   3.047   1.865
  197    HD2  TYR  24           HD2      TYR  24  -0.570   2.550  -1.836
  198    HE1  TYR  24           HE1      TYR  24  -3.598   5.205   1.057
  199    HE2  TYR  24           HE2      TYR  24  -1.462   4.721  -2.632
  200    HH   TYR  24           HH       TYR  24  -2.343   6.841  -1.587
  201    H    GLN  25           HN       GLN  25   1.138   2.221   1.753
  202    HA   GLN  25           HA       GLN  25   0.557   4.672   3.296
  203   1HB   GLN  25          HB2       GLN  25   1.830   2.326   4.370
  204   2HB   GLN  25          HB1       GLN  25   3.035   3.608   4.254
  205   1HG   GLN  25          HG2       GLN  25   1.164   5.107   5.305
  206   2HG   GLN  25          HG1       GLN  25   0.468   3.569   5.815
  207   1HE2  GLN  25          HE2       GLN  25   2.701   2.055   6.485
  208   2HE2  GLN  25          HE2       GLN  25   3.565   2.804   7.737
  209    H    LEU  26           HN       LEU  26   0.950   5.593   1.147
  210    HA   LEU  26           HA       LEU  26   3.187   5.074  -0.492
  211   1HB   LEU  26          HB2       LEU  26   1.220   7.263  -0.063
  212   2HB   LEU  26          HB1       LEU  26   2.655   7.668  -1.008
  213    HG   LEU  26           HG       LEU  26   0.783   5.346  -1.560
  214   1HD1  LEU  26          HD1       LEU  26   0.679   8.134  -2.275
  215   2HD1  LEU  26          HD1       LEU  26  -0.443   6.844  -2.708
  216   3HD1  LEU  26          HD1       LEU  26   0.959   7.171  -3.727
  217   1HD2  LEU  26          HD2       LEU  26   2.179   5.416  -3.761
  218   2HD2  LEU  26          HD2       LEU  26   2.899   4.664  -2.341
  219   3HD2  LEU  26          HD2       LEU  26   3.361   6.301  -2.799
  220    H    SER  27           HN       SER  27   5.236   6.007  -0.655
  221    HA   SER  27           HA       SER  27   6.104   7.753   1.605
  222   1HB   SER  27          HB2       SER  27   6.683   5.310   1.847
  223   2HB   SER  27          HB1       SER  27   7.630   5.444   0.368
  224    HG   SER  27           HG       SER  27   9.099   6.586   1.402
  225    H    SER  28           HN       SER  28   5.385   8.632  -1.058
  226    HA   SER  28           HA       SER  28   7.856   8.956  -2.612
  227   1HB   SER  28          HB2       SER  28   5.664   8.711  -3.676
  228   2HB   SER  28          HB1       SER  28   5.061  10.124  -2.815
  229    HG   SER  28           HG       SER  28   5.902  11.291  -4.334
  230    H    ARG  29           HN       ARG  29   9.213  10.725  -2.531
  231    HA   ARG  29           HA       ARG  29   8.371  13.332  -1.541
  232   1HB   ARG  29          HB2       ARG  29   9.053  11.331   0.325
  233   2HB   ARG  29          HB1       ARG  29  10.452  12.402   0.252
  234   1HG   ARG  29          HG2       ARG  29   8.578  14.285   0.343
  235   2HG   ARG  29          HG1       ARG  29   7.653  12.997   1.117
  236   1HD   ARG  29          HD2       ARG  29   9.983  12.729   2.468
  237   2HD   ARG  29          HD1       ARG  29  10.033  14.469   2.123
  238    HE   ARG  29           HE       ARG  29   7.454  13.427   3.113
  239   1HH1  ARG  29          HH2       ARG  29  10.350  13.766   4.654
  240   2HH1  ARG  29          HH2       ARG  29   9.865  15.041   5.720
  241   1HH2  ARG  29          HH1       ARG  29   6.856  15.616   4.096
  242   2HH2  ARG  29          HH1       ARG  29   7.888  16.088   5.406
  243    H    SER  30           HN       SER  30  10.771  14.425  -0.824
  244    HA   SER  30           HA       SER  30  12.343  14.201  -3.332
  245   1HB   SER  30          HB2       SER  30  11.730  16.199  -1.265
  246   2HB   SER  30          HB1       SER  30  13.419  16.211  -1.764
  247    HG   SER  30           HG       SER  30  12.801  16.593  -3.835
  248    H    THR  31           HN       THR  31  12.424  12.331  -0.783
  249    HA   THR  31           HA       THR  31  15.410  12.257  -0.668
  250    HB   THR  31           HB       THR  31  14.500  13.489   1.284
  251    HG1  THR  31           HG1      THR  31  16.265  12.400   1.855
  252   1HG2  THR  31          HG2       THR  31  12.531  11.400   1.147
  253   2HG2  THR  31          HG2       THR  31  12.531  12.848   2.152
  254   3HG2  THR  31          HG2       THR  31  13.296  11.371   2.738
  255    H    CYS  32           HN       CYS  32  12.929  10.613  -1.764
  256    HA   CYS  32           HA       CYS  32  13.755   7.986  -0.572
  257   1HB   CYS  32          HB2       CYS  32  11.309   9.150  -0.583
  258   2HB   CYS  32          HB1       CYS  32  11.228   8.281  -2.116
  259    H    LEU  33           HN       LEU  33  15.460   7.552  -2.076
  260    HA   LEU  33           HA       LEU  33  15.340   7.918  -4.901
  261   1HB   LEU  33          HB2       LEU  33  17.320   7.403  -3.380
  262   2HB   LEU  33          HB1       LEU  33  16.779   5.724  -3.383
  263    HG   LEU  33           HG       LEU  33  16.744   6.250  -6.050
  264   1HD1  LEU  33          HD1       LEU  33  19.074   7.814  -4.893
  265   2HD1  LEU  33          HD1       LEU  33  17.669   8.523  -5.690
  266   3HD1  LEU  33          HD1       LEU  33  18.783   7.508  -6.606
  267   1HD2  LEU  33          HD2       LEU  33  18.826   4.986  -6.149
  268   2HD2  LEU  33          HD2       LEU  33  17.841   4.354  -4.831
  269   3HD2  LEU  33          HD2       LEU  33  19.206   5.417  -4.482
  270    H    LYS  34           HN       LYS  34  13.911   5.497  -2.828
  271    HA   LYS  34           HA       LYS  34  13.193   3.837  -5.215
  272   1HB   LYS  34          HB2       LYS  34  13.126   3.261  -2.232
  273   2HB   LYS  34          HB1       LYS  34  12.777   2.092  -3.508
  274   1HG   LYS  34          HG2       LYS  34  14.988   1.918  -4.149
  275   2HG   LYS  34          HG1       LYS  34  15.373   3.565  -3.648
  276   1HD   LYS  34          HD2       LYS  34  14.603   1.565  -1.552
  277   2HD   LYS  34          HD1       LYS  34  16.231   1.504  -2.228
  278   1HE   LYS  34          HE2       LYS  34  15.465   4.245  -1.597
  279   2HE   LYS  34          HE1       LYS  34  15.382   3.196  -0.167
  280   1HZ   LYS  34          HZ1       LYS  34  17.637   4.020  -0.509
  281   2HZ   LYS  34          HZ2       LYS  34  17.662   3.350  -2.070
  282   3HZ   LYS  34          HZ3       LYS  34  17.574   2.335  -0.709
  283    H    ALA  35           HN       ALA  35  11.466   5.376  -5.818
  284    HA   ALA  35           HA       ALA  35   9.339   6.148  -4.058
  285   1HB   ALA  35          HB1       ALA  35   8.262   6.121  -6.583
  286   2HB   ALA  35          HB2       ALA  35   9.990   6.133  -6.938
  287   3HB   ALA  35          HB3       ALA  35   9.283   7.416  -5.956
  288    H    GLY  36           HN       GLY  36   8.767   4.143  -2.929
  289   1HA   GLY  36          HA2       GLY  36   7.070   2.346  -4.612
  290   2HA   GLY  36          HA1       GLY  36   8.102   1.700  -3.337
  291    H    VAL  37           HN       VAL  37   5.366   1.198  -3.205
  292    HA   VAL  37           HA       VAL  37   4.343   3.181  -1.205
  293    HB   VAL  37           HB       VAL  37   2.870   0.885  -2.527
  294   1HG1  VAL  37          HG1       VAL  37   2.225   3.028  -0.685
  295   2HG1  VAL  37          HG1       VAL  37   1.236   1.660  -1.194
  296   3HG1  VAL  37          HG1       VAL  37   1.242   3.145  -2.144
  297   1HG2  VAL  37          HG2       VAL  37   3.182   1.954  -4.506
  298   2HG2  VAL  37          HG2       VAL  37   3.859   3.381  -3.720
  299   3HG2  VAL  37          HG2       VAL  37   2.110   3.200  -3.864
  300    H    ILE  38           HN       ILE  38   3.235   2.137   0.747
  301    HA   ILE  38           HA       ILE  38   4.604  -0.440   1.448
  302    HB   ILE  38           HB       ILE  38   3.968   2.047   3.053
  303   1HG1  ILE  38          HG1       ILE  38   6.447   1.731   3.600
  304   2HG1  ILE  38          HG1       ILE  38   6.470   0.494   2.346
  305   1HG2  ILE  38          HG2       ILE  38   4.834   0.785   5.027
  306   2HG2  ILE  38          HG2       ILE  38   4.849  -0.683   4.051
  307   3HG2  ILE  38          HG2       ILE  38   3.320   0.116   4.419
  308   1HD1  ILE  38          HD1       ILE  38   5.193   2.955   1.433
  309   2HD1  ILE  38          HD1       ILE  38   6.501   2.032   0.695
  310   3HD1  ILE  38          HD1       ILE  38   6.858   3.219   1.949
  311    H    PHE  39           HN       PHE  39   3.095  -2.060   1.459
  312    HA   PHE  39           HA       PHE  39   0.289  -1.375   2.201
  313   1HB   PHE  39          HB2       PHE  39   1.651  -3.521   0.600
  314   2HB   PHE  39          HB1       PHE  39   0.013  -3.770   1.196
  315    HD1  PHE  39           HD1      PHE  39  -1.850  -2.667   0.210
  316    HD2  PHE  39           HD2      PHE  39   2.148  -1.528  -0.866
  317    HE1  PHE  39           HE1      PHE  39  -2.740  -1.294  -1.648
  318    HE2  PHE  39           HE2      PHE  39   1.253  -0.154  -2.723
  319    HZ   PHE  39           HZ       PHE  39  -1.194  -0.037  -3.109
  320    H    THR  40           HN       THR  40  -0.435  -1.999   4.186
  321    HA   THR  40           HA       THR  40   1.207  -3.893   5.774
  322    HB   THR  40           HB       THR  40  -0.997  -1.911   6.405
  323    HG1  THR  40           HG1      THR  40   1.697  -2.028   7.268
  324   1HG2  THR  40          HG2       THR  40  -1.424  -3.164   8.236
  325   2HG2  THR  40          HG2       THR  40   0.183  -2.700   8.804
  326   3HG2  THR  40          HG2       THR  40  -0.041  -4.214   7.924
  327    H    THR  41           HN       THR  41   0.260  -5.762   6.697
  328    HA   THR  41           HA       THR  41  -2.135  -6.778   5.298
  329    HB   THR  41           HB       THR  41  -0.533  -8.281   7.342
  330    HG1  THR  41           HG1      THR  41   0.310  -7.480   4.764
  331   1HG2  THR  41          HG2       THR  41  -0.797  -9.989   5.374
  332   2HG2  THR  41          HG2       THR  41  -2.039  -8.870   4.814
  333   3HG2  THR  41          HG2       THR  41  -2.186  -9.629   6.399
  334    H    LYS  42           HN       LYS  42  -3.667  -8.116   6.794
  335    HA   LYS  42           HA       LYS  42  -4.745  -6.357   8.831
  336   1HB   LYS  42          HB2       LYS  42  -5.569  -8.508   7.237
  337   2HB   LYS  42          HB1       LYS  42  -5.662  -9.125   8.886
  338   1HG   LYS  42          HG2       LYS  42  -6.687  -6.431   8.812
  339   2HG   LYS  42          HG1       LYS  42  -7.501  -7.403   7.586
  340   1HD   LYS  42          HD2       LYS  42  -8.666  -8.528   9.152
  341   2HD   LYS  42          HD1       LYS  42  -7.198  -8.903  10.053
  342   1HE   LYS  42          HE2       LYS  42  -7.450  -7.101  11.473
  343   2HE   LYS  42          HE1       LYS  42  -8.208  -6.094  10.225
  344   1HZ   LYS  42          HZ1       LYS  42  -9.423  -8.360  11.708
  345   2HZ   LYS  42          HZ2       LYS  42 -10.117  -7.695  10.308
  346   3HZ   LYS  42          HZ3       LYS  42  -9.929  -6.741  11.701
  347    H    LYS  43           HN       LYS  43  -2.414  -8.933   8.848
  348    HA   LYS  43           HA       LYS  43  -2.749  -9.636  11.668
  349   1HB   LYS  43          HB2       LYS  43  -0.597 -10.172   9.596
  350   2HB   LYS  43          HB1       LYS  43  -0.659 -10.934  11.186
  351   1HG   LYS  43          HG2       LYS  43  -3.192 -11.091   9.698
  352   2HG   LYS  43          HG1       LYS  43  -1.854 -11.941   8.921
  353   1HD   LYS  43          HD2       LYS  43  -1.762 -13.528  10.543
  354   2HD   LYS  43          HD1       LYS  43  -2.010 -12.352  11.836
  355   1HE   LYS  43          HE2       LYS  43  -4.146 -13.085  12.006
  356   2HE   LYS  43          HE1       LYS  43  -4.444 -12.466  10.368
  357   1HZ   LYS  43          HZ1       LYS  43  -3.824 -14.478   9.408
  358   2HZ   LYS  43          HZ2       LYS  43  -4.742 -14.963  10.753
  359   3HZ   LYS  43          HZ3       LYS  43  -3.045 -15.031  10.809
  360    H    GLY  44           HN       GLY  44  -1.477  -6.911  10.167
  361   1HA   GLY  44          HA2       GLY  44  -0.495  -5.104  11.425
  362   2HA   GLY  44          HA1       GLY  44   0.116  -6.285  12.581
  363    H    GLN  45           HN       GLN  45   0.615  -7.317   9.377
  364    HA   GLN  45           HA       GLN  45   3.507  -6.993   9.647
  365   1HB   GLN  45          HB2       GLN  45   1.632  -8.603   8.248
  366   2HB   GLN  45          HB1       GLN  45   2.603  -7.788   7.023
  367   1HG   GLN  45          HG2       GLN  45   4.387  -9.085   7.480
  368   2HG   GLN  45          HG1       GLN  45   4.279  -8.715   9.201
  369   1HE2  GLN  45          HE2       GLN  45   4.760 -11.027   9.672
  370   2HE2  GLN  45          HE2       GLN  45   3.543 -12.199   9.494
  371    H    GLN  46           HN       GLN  46   4.457  -6.326   7.211
  372    HA   GLN  46           HA       GLN  46   3.137  -3.929   6.131
  373   1HB   GLN  46          HB2       GLN  46   4.342  -3.363   8.342
  374   2HB   GLN  46          HB1       GLN  46   5.842  -3.648   7.456
  375   1HG   GLN  46          HG2       GLN  46   4.738  -2.021   5.688
  376   2HG   GLN  46          HG1       GLN  46   3.809  -1.478   7.083
  377   1HE2  GLN  46          HE2       GLN  46   6.925  -1.337   5.541
  378   2HE2  GLN  46          HE2       GLN  46   7.701  -0.412   6.735
  379    H    SER  47           HN       SER  47   3.382  -4.743   4.023
  380    HA   SER  47           HA       SER  47   6.143  -5.522   3.168
  381   1HB   SER  47          HB2       SER  47   3.512  -6.577   2.796
  382   2HB   SER  47          HB1       SER  47   4.118  -6.072   1.220
  383    HG   SER  47           HG       SER  47   5.119  -7.979   3.021
  384    H    CYS  48           HN       CYS  48   7.212  -4.126   1.824
  385    HA   CYS  48           HA       CYS  48   6.018  -1.622   0.980
  386   1HB   CYS  48          HB2       CYS  48   8.589  -3.004   0.137
  387   2HB   CYS  48          HB1       CYS  48   8.238  -1.284  -0.020
  388    H    GLY  49           HN       GLY  49   4.579  -1.529  -0.721
  389   1HA   GLY  49          HA2       GLY  49   4.713  -3.603  -2.828
  390   2HA   GLY  49          HA1       GLY  49   3.392  -2.467  -2.590
  391    H    ASP  50           HN       ASP  50   5.171  -3.173  -4.933
  392    HA   ASP  50           HA       ASP  50   6.480  -0.584  -5.543
  393   1HB   ASP  50          HB2       ASP  50   7.450  -2.875  -6.046
  394   2HB   ASP  50          HB1       ASP  50   6.153  -3.096  -7.220
  395    HA   PRO  51           HA       PRO  51   2.815   0.863  -7.585
  396   1HB   PRO  51          HB2       PRO  51   3.959   2.804  -9.154
  397   2HB   PRO  51          HB1       PRO  51   3.680   3.004  -7.413
  398   1HG   PRO  51          HG2       PRO  51   6.186   2.264  -8.853
  399   2HG   PRO  51          HG1       PRO  51   5.957   3.364  -7.482
  400   1HD   PRO  51          HD2       PRO  51   6.893   0.850  -7.172
  401   2HD   PRO  51          HD1       PRO  51   5.889   1.651  -5.945
  402    H    LYS  52           HN       LYS  52   5.710  -0.072  -9.391
  403    HA   LYS  52           HA       LYS  52   4.607  -0.158 -12.020
  404   1HB   LYS  52          HB2       LYS  52   6.773  -1.657 -10.537
  405   2HB   LYS  52          HB1       LYS  52   6.437  -1.986 -12.235
  406   1HG   LYS  52          HG2       LYS  52   6.536   0.755 -12.220
  407   2HG   LYS  52          HG1       LYS  52   7.746   0.348 -11.004
  408   1HD   LYS  52          HD2       LYS  52   9.168  -0.034 -12.715
  409   2HD   LYS  52          HD1       LYS  52   8.219  -1.482 -13.053
  410   1HE   LYS  52          HE2       LYS  52   8.127  -0.370 -15.119
  411   2HE   LYS  52          HE1       LYS  52   6.650   0.231 -14.338
  412   1HZ   LYS  52          HZ1       LYS  52   9.317   1.542 -14.226
  413   2HZ   LYS  52          HZ2       LYS  52   7.901   2.105 -13.474
  414   3HZ   LYS  52          HZ3       LYS  52   8.006   2.064 -15.169
  415    H    GLN  53           HN       GLN  53   4.102  -2.190  -9.237
  416    HA   GLN  53           HA       GLN  53   3.126  -4.514 -10.718
  417   1HB   GLN  53          HB2       GLN  53   3.035  -3.602  -7.828
  418   2HB   GLN  53          HB1       GLN  53   2.427  -5.166  -8.371
  419   1HG   GLN  53          HG2       GLN  53   5.235  -4.260  -9.004
  420   2HG   GLN  53          HG1       GLN  53   4.849  -5.102  -7.501
  421   1HE2  GLN  53          HE2       GLN  53   6.344  -6.825  -8.511
  422   2HE2  GLN  53          HE2       GLN  53   5.638  -7.947  -9.573
  423    H    GLU  54           HN       GLU  54   0.847  -5.235 -10.565
  424    HA   GLU  54           HA       GLU  54  -1.007  -2.965 -10.955
  425   1HB   GLU  54          HB2       GLU  54  -0.574  -5.496 -12.065
  426   2HB   GLU  54          HB1       GLU  54  -2.092  -5.659 -11.183
  427   1HG   GLU  54          HG2       GLU  54  -2.565  -3.289 -12.336
  428   2HG   GLU  54          HG1       GLU  54  -1.437  -3.936 -13.528
  429    H    TRP  55           HN       TRP  55  -0.256  -5.206  -8.378
  430    HA   TRP  55           HA       TRP  55  -2.960  -5.138  -7.255
  431   1HB   TRP  55          HB2       TRP  55  -1.921  -6.390  -5.436
  432   2HB   TRP  55          HB1       TRP  55  -1.431  -7.050  -6.986
  433    HD1  TRP  55           HD1      TRP  55   1.094  -6.783  -7.701
  434    HE1  TRP  55           HE1      TRP  55   3.213  -6.217  -6.333
  435    HE3  TRP  55           HE3      TRP  55  -1.046  -4.905  -3.473
  436    HZ2  TRP  55           HZ2      TRP  55   3.893  -5.144  -3.809
  437    HZ3  TRP  55           HZ3      TRP  55   0.363  -4.126  -1.600
  438    HH2  TRP  55           HH2      TRP  55   2.834  -4.230  -1.758
  439    H    VAL  56           HN       VAL  56  -0.014  -3.218  -6.962
  440    HA   VAL  56           HA       VAL  56  -0.905  -1.795  -4.568
  441    HB   VAL  56           HB       VAL  56   1.023  -1.059  -6.816
  442   1HG1  VAL  56          HG1       VAL  56   0.888   1.020  -5.916
  443   2HG1  VAL  56          HG1       VAL  56   1.722   0.346  -4.518
  444   3HG1  VAL  56          HG1       VAL  56  -0.036   0.443  -4.532
  445   1HG2  VAL  56          HG2       VAL  56   2.005  -2.870  -5.697
  446   2HG2  VAL  56          HG2       VAL  56   1.300  -2.418  -4.145
  447   3HG2  VAL  56          HG2       VAL  56   2.647  -1.491  -4.805
  448    H    GLN  57           HN       GLN  57  -0.825  -1.093  -8.063
  449    HA   GLN  57           HA       GLN  57  -2.384   1.287  -8.046
  450   1HB   GLN  57          HB2       GLN  57  -1.095  -0.388  -9.860
  451   2HB   GLN  57          HB1       GLN  57  -2.792  -0.552 -10.313
  452   1HG   GLN  57          HG2       GLN  57  -2.611   2.152  -9.932
  453   2HG   GLN  57          HG1       GLN  57  -0.999   1.784 -10.547
  454   1HE2  GLN  57          HE2       GLN  57  -0.840   1.676 -12.792
  455   2HE2  GLN  57          HE2       GLN  57  -2.143   1.408 -13.847
  456    H    ARG  58           HN       ARG  58  -3.353  -2.139  -8.422
  457    HA   ARG  58           HA       ARG  58  -6.148  -1.776  -8.733
  458   1HB   ARG  58          HB2       ARG  58  -5.005  -3.904  -9.056
  459   2HB   ARG  58          HB1       ARG  58  -4.490  -3.928  -7.371
  460   1HG   ARG  58          HG2       ARG  58  -6.906  -3.962  -6.694
  461   2HG   ARG  58          HG1       ARG  58  -7.334  -4.120  -8.398
  462   1HD   ARG  58          HD2       ARG  58  -5.404  -6.044  -7.079
  463   2HD   ARG  58          HD1       ARG  58  -7.158  -6.319  -7.062
  464    HE   ARG  58           HE       ARG  58  -5.783  -5.781  -9.657
  465   1HH1  ARG  58          HH1       ARG  58  -5.978  -8.549  -8.035
  466   2HH1  ARG  58          HH1       ARG  58  -7.148  -9.341  -9.036
  467   1HH2  ARG  58          HH2       ARG  58  -8.020  -6.459 -10.753
  468   2HH2  ARG  58          HH2       ARG  58  -8.304  -8.158 -10.576
  469    H    TYR  59           HN       TYR  59  -4.273  -2.347  -5.730
  470    HA   TYR  59           HA       TYR  59  -6.467  -1.979  -3.911
  471   1HB   TYR  59          HB2       TYR  59  -3.463  -1.582  -3.664
  472   2HB   TYR  59          HB1       TYR  59  -4.560  -1.630  -2.292
  473    HD1  TYR  59           HD1      TYR  59  -2.696  -3.491  -1.805
  474    HD2  TYR  59           HD2      TYR  59  -5.832  -3.891  -4.720
  475    HE1  TYR  59           HE1      TYR  59  -2.476  -5.951  -1.692
  476    HE2  TYR  59           HE2      TYR  59  -5.601  -6.357  -4.600
  477    HH   TYR  59           HH       TYR  59  -3.015  -7.883  -2.832
  478    H    MET  60           HN       MET  60  -3.783   0.174  -4.749
  479    HA   MET  60           HA       MET  60  -4.432   2.557  -3.507
  480   1HB   MET  60          HB2       MET  60  -3.256   1.809  -6.176
  481   2HB   MET  60          HB1       MET  60  -3.383   3.502  -5.708
  482   1HG   MET  60          HG2       MET  60  -2.231   2.841  -3.523
  483   2HG   MET  60          HG1       MET  60  -1.864   1.305  -4.298
  484   1HE   MET  60          HE1       MET  60  -0.441   5.328  -4.458
  485   2HE   MET  60          HE2       MET  60  -2.125   4.814  -4.506
  486   3HE   MET  60          HE3       MET  60  -1.317   5.299  -5.995
  487    H    LYS  61           HN       LYS  61  -5.827   1.277  -6.530
  488    HA   LYS  61           HA       LYS  61  -7.338   3.554  -7.309
  489   1HB   LYS  61          HB2       LYS  61  -7.193   0.670  -7.829
  490   2HB   LYS  61          HB1       LYS  61  -8.820   1.320  -8.039
  491   1HG   LYS  61          HG2       LYS  61  -6.954   3.168  -9.189
  492   2HG   LYS  61          HG1       LYS  61  -6.598   1.558  -9.811
  493   1HD   LYS  61          HD2       LYS  61  -8.359   1.735 -11.199
  494   2HD   LYS  61          HD1       LYS  61  -9.426   1.821  -9.798
  495   1HE   LYS  61          HE2       LYS  61  -9.701   4.082 -10.001
  496   2HE   LYS  61          HE1       LYS  61  -7.994   4.341 -10.412
  497   1HZ   LYS  61          HZ1       LYS  61  -9.818   2.942 -12.267
  498   2HZ   LYS  61          HZ2       LYS  61  -8.338   3.705 -12.606
  499   3HZ   LYS  61          HZ3       LYS  61  -9.720   4.635 -12.265
  500    H    ASN  62           HN       ASN  62  -8.208   0.837  -5.146
  501    HA   ASN  62           HA       ASN  62 -10.858   1.956  -4.582
  502   1HB   ASN  62          HB2       ASN  62  -9.804  -0.517  -4.571
  503   2HB   ASN  62          HB1       ASN  62  -9.557  -0.114  -2.871
  504   1HD2  ASN  62          HD2       ASN  62 -11.253  -1.133  -1.770
  505   2HD2  ASN  62          HD2       ASN  62 -12.890  -1.009  -2.199
  506    H    LEU  63           HN       LEU  63  -7.693   1.817  -2.989
  507    HA   LEU  63           HA       LEU  63  -8.466   2.843  -0.436
  508   1HB   LEU  63          HB2       LEU  63  -6.011   2.521  -2.090
  509   2HB   LEU  63          HB1       LEU  63  -5.902   3.658  -0.742
  510    HG   LEU  63           HG       LEU  63  -7.153   0.981  -0.257
  511   1HD1  LEU  63          HD1       LEU  63  -4.547   0.549   0.454
  512   2HD1  LEU  63          HD1       LEU  63  -4.346   1.466  -1.039
  513   3HD1  LEU  63          HD1       LEU  63  -5.273  -0.034  -1.044
  514   1HD2  LEU  63          HD2       LEU  63  -5.198   2.198   1.600
  515   2HD2  LEU  63          HD2       LEU  63  -6.795   1.525   1.930
  516   3HD2  LEU  63          HD2       LEU  63  -6.643   3.166   1.303
  517    H    ASP  64           HN       ASP  64  -7.893   4.407  -3.524
  518    HA   ASP  64           HA       ASP  64  -7.572   7.102  -2.485
  519   1HB   ASP  64          HB2       ASP  64  -7.638   5.660  -5.010
  520   2HB   ASP  64          HB1       ASP  64  -8.520   7.182  -5.129
  521    H    ALA  65           HN       ALA  65 -10.306   5.041  -3.104
  522    HA   ALA  65           HA       ALA  65 -12.332   6.964  -3.640
  523   1HB   ALA  65          HB1       ALA  65 -12.276   4.344  -3.609
  524   2HB   ALA  65          HB2       ALA  65 -13.780   5.166  -3.193
  525   3HB   ALA  65          HB3       ALA  65 -12.742   4.529  -1.917
  526    H    LYS  66           HN       LYS  66 -10.899   5.867  -0.574
  527    HA   LYS  66           HA       LYS  66 -12.699   7.000   1.273
  528   1HB   LYS  66          HB2       LYS  66 -10.712   5.548   1.732
  529   2HB   LYS  66          HB1       LYS  66  -9.667   6.930   1.401
  530   1HG   LYS  66          HG2       LYS  66 -10.368   8.089   3.308
  531   2HG   LYS  66          HG1       LYS  66 -11.876   7.181   3.424
  532   1HD   LYS  66          HD2       LYS  66 -10.201   5.135   3.752
  533   2HD   LYS  66          HD1       LYS  66  -9.129   6.415   4.320
  534   1HE   LYS  66          HE2       LYS  66 -11.460   7.079   5.605
  535   2HE   LYS  66          HE1       LYS  66 -11.551   5.308   5.595
  536   1HZ   LYS  66          HZ1       LYS  66 -10.243   5.830   7.454
  537   2HZ   LYS  66          HZ2       LYS  66  -9.364   7.023   6.622
  538   3HZ   LYS  66          HZ3       LYS  66  -9.123   5.379   6.264
  539    H    GLN  67           HN       GLN  67 -10.303   8.569  -0.771
  540    HA   GLN  67           HA       GLN  67 -11.221  11.215   0.305
  541   1HB   GLN  67          HB2       GLN  67  -8.437  10.208  -0.353
  542   2HB   GLN  67          HB1       GLN  67  -8.806  11.915  -0.089
  543   1HG   GLN  67          HG2       GLN  67  -9.345  11.586   2.166
  544   2HG   GLN  67          HG1       GLN  67  -9.648   9.864   1.942
  545   1HE2  GLN  67          HE2       GLN  67  -7.788   8.419   1.860
  546   2HE2  GLN  67          HE2       GLN  67  -6.243   8.934   2.338
  547    H    LYS  68           HN       LYS  68 -12.108   9.710  -2.091
  548    HA   LYS  68           HA       LYS  68 -12.489  10.104  -4.390
  549   1HB   LYS  68          HB2       LYS  68 -12.684  12.440  -2.900
  550   2HB   LYS  68          HB1       LYS  68 -11.632  12.903  -4.238
  551   1HG   LYS  68          HG2       LYS  68 -13.611  13.220  -5.331
  552   2HG   LYS  68          HG1       LYS  68 -13.514  11.477  -5.579
  553   1HD   LYS  68          HD2       LYS  68 -14.624  12.048  -2.971
  554   2HD   LYS  68          HD1       LYS  68 -15.544  12.889  -4.222
  555   1HE   LYS  68          HE2       LYS  68 -15.890  10.805  -5.444
  556   2HE   LYS  68          HE1       LYS  68 -14.849   9.930  -4.303
  557   1HZ   LYS  68          HZ1       LYS  68 -17.337  11.399  -3.607
  558   2HZ   LYS  68          HZ2       LYS  68 -16.323  10.602  -2.503
  559   3HZ   LYS  68          HZ3       LYS  68 -17.176   9.712  -3.673
  560    H    LYS  69           HN       LYS  69 -11.295  11.447  -6.349
  561    HA   LYS  69           HA       LYS  69  -8.553  10.353  -6.395
  562   1HB   LYS  69          HB2       LYS  69 -10.680  10.836  -8.210
  563   2HB   LYS  69          HB1       LYS  69  -9.334  11.851  -8.734
  564   1HG   LYS  69          HG2       LYS  69  -8.048  10.065  -9.319
  565   2HG   LYS  69          HG1       LYS  69  -8.571   9.113  -7.930
  566   1HD   LYS  69          HD2       LYS  69  -9.753   7.914  -9.452
  567   2HD   LYS  69          HD1       LYS  69 -10.885   9.267  -9.404
  568   1HE   LYS  69          HE2       LYS  69  -9.409  10.341 -11.234
  569   2HE   LYS  69          HE1       LYS  69  -8.712   8.721 -11.435
  570   1HZ   LYS  69          HZ1       LYS  69 -10.729   9.165 -12.825
  571   2HZ   LYS  69          HZ2       LYS  69 -11.633   9.247 -11.389
  572   3HZ   LYS  69          HZ3       LYS  69 -10.848   7.804 -11.821
  573    H    ALA  70           HN       ALA  70  -7.416  12.242  -8.191
  574    HA   ALA  70           HA       ALA  70  -6.892  14.499  -6.308
  575   1HB   ALA  70          HB1       ALA  70  -5.133  12.840  -7.234
  576   2HB   ALA  70          HB2       ALA  70  -4.746  14.558  -7.321
  577   3HB   ALA  70          HB3       ALA  70  -5.312  13.707  -8.759
  578    H    SER  71           HN       SER  71  -6.199  16.578  -7.632
  579    HA   SER  71           HA       SER  71  -8.494  17.290  -9.342
  580   1HB   SER  71          HB2       SER  71  -7.930  18.946  -7.783
  581   2HB   SER  71          HB1       SER  71  -6.200  18.674  -7.974
  582    HG   SER  71           HG       SER  71  -7.967  20.201  -9.479
  583    HA   PRO  72           HA       PRO  72  -6.283  16.692 -13.110
  584   1HB   PRO  72          HB2       PRO  72  -7.739  18.311 -14.753
  585   2HB   PRO  72          HB1       PRO  72  -8.325  16.738 -14.174
  586   1HG   PRO  72          HG2       PRO  72  -8.985  19.470 -13.223
  587   2HG   PRO  72          HG1       PRO  72 -10.021  18.046 -13.379
  588   1HD   PRO  72          HD2       PRO  72  -8.973  18.927 -11.008
  589   2HD   PRO  72          HD1       PRO  72  -9.441  17.243 -11.323
  590    H    ARG  73           HN       ARG  73  -5.844  18.581 -15.113
  591    HA   ARG  73           HA       ARG  73  -3.824  20.310 -13.851
  592   1HB   ARG  73          HB2       ARG  73  -4.560  19.258 -16.516
  593   2HB   ARG  73          HB1       ARG  73  -3.838  20.868 -16.535
  594   1HG   ARG  73          HG2       ARG  73  -2.031  19.288 -16.698
  595   2HG   ARG  73          HG1       ARG  73  -1.990  19.948 -15.063
  596   1HD   ARG  73          HD2       ARG  73  -3.000  17.976 -14.139
  597   2HD   ARG  73          HD1       ARG  73  -3.419  17.359 -15.752
  598    HE   ARG  73           HE       ARG  73  -1.188  16.618 -15.972
  599   1HH1  ARG  73          HH1       ARG  73  -1.082  16.759 -12.912
  600   2HH1  ARG  73          HH1       ARG  73   0.388  17.647 -12.679
  601   1HH2  ARG  73          HH2       ARG  73   0.549  18.760 -15.958
  602   2HH2  ARG  73          HH2       ARG  73   1.310  18.779 -14.403
  Start of MODEL    4
    1   1H    VAL   1          HT1       VAL   1  -2.108  -0.602  11.545
    2   2H    VAL   1          HT2       VAL   1  -3.533   0.288  11.791
    3   3H    VAL   1          HT3       VAL   1  -2.785  -0.502  13.097
    4    HA   VAL   1           HA       VAL   1  -2.320   1.876  13.182
    5    HB   VAL   1           HB       VAL   1  -0.054   0.004  12.423
    6   1HG1  VAL   1          HG1       VAL   1   0.823   1.861  14.334
    7   2HG1  VAL   1          HG1       VAL   1  -0.068   2.820  13.152
    8   3HG1  VAL   1          HG1       VAL   1   1.282   1.812  12.632
    9   1HG2  VAL   1          HG2       VAL   1  -1.499   0.656  14.998
   10   2HG2  VAL   1          HG2       VAL   1   0.108  -0.072  14.993
   11   3HG2  VAL   1          HG2       VAL   1  -1.250  -0.926  14.258
   12    H    VAL   2           HN       VAL   2  -2.185   3.702  11.932
   13    HA   VAL   2           HA       VAL   2  -1.872   3.492   9.029
   14    HB   VAL   2           HB       VAL   2  -2.276   5.938   9.190
   15   1HG1  VAL   2          HG1       VAL   2  -4.172   4.332   9.301
   16   2HG1  VAL   2          HG1       VAL   2  -4.494   5.803  10.222
   17   3HG1  VAL   2          HG1       VAL   2  -4.034   4.320  11.059
   18   1HG2  VAL   2          HG2       VAL   2  -1.535   6.997  11.040
   19   2HG2  VAL   2          HG2       VAL   2  -1.279   5.462  11.869
   20   3HG2  VAL   2          HG2       VAL   2  -2.858   6.246  11.931
   21    H    ILE   3           HN       ILE   3   0.136   3.147   8.285
   22    HA   ILE   3           HA       ILE   3   2.574   3.952   9.585
   23    HB   ILE   3           HB       ILE   3   2.469   2.049   8.104
   24   1HG1  ILE   3          HG1       ILE   3   3.934   4.239   6.606
   25   2HG1  ILE   3          HG1       ILE   3   4.563   3.445   8.050
   26   1HG2  ILE   3          HG2       ILE   3   1.059   3.982   6.358
   27   2HG2  ILE   3          HG2       ILE   3   0.835   2.242   6.525
   28   3HG2  ILE   3          HG2       ILE   3   2.144   2.868   5.524
   29   1HD1  ILE   3          HD1       ILE   3   5.103   1.557   6.920
   30   2HD1  ILE   3          HD1       ILE   3   4.965   2.560   5.476
   31   3HD1  ILE   3          HD1       ILE   3   3.599   1.573   6.002
   32    HA   PRO   4           HA       PRO   4   2.569   8.135   8.075
   33   1HB   PRO   4          HB2       PRO   4   5.068   8.840   8.926
   34   2HB   PRO   4          HB1       PRO   4   3.677   8.693  10.018
   35   1HG   PRO   4          HG2       PRO   4   5.969   6.874   9.632
   36   2HG   PRO   4          HG1       PRO   4   4.977   7.158  11.066
   37   1HD   PRO   4          HD2       PRO   4   4.781   4.974   9.325
   38   2HD   PRO   4          HD1       PRO   4   3.593   5.448  10.556
   39    H    SER   5           HN       SER   5   6.024   7.440   7.793
   40    HA   SER   5           HA       SER   5   5.869   6.964   4.891
   41   1HB   SER   5          HB2       SER   5   6.467   9.584   6.175
   42   2HB   SER   5          HB1       SER   5   7.472   9.132   4.800
   43    HG   SER   5           HG       SER   5   5.499  10.280   4.269
   44    HA   PRO   6           HA       PRO   6   9.667   5.493   7.202
   45   1HB   PRO   6          HB2       PRO   6   9.228   2.812   7.004
   46   2HB   PRO   6          HB1       PRO   6   8.616   3.796   8.348
   47   1HG   PRO   6          HG2       PRO   6   7.194   2.758   5.966
   48   2HG   PRO   6          HG1       PRO   6   6.619   2.967   7.625
   49   1HD   PRO   6          HD2       PRO   6   6.036   4.667   5.538
   50   2HD   PRO   6          HD1       PRO   6   5.977   5.116   7.257
   51    H    CYS   7           HN       CYS   7   8.412   5.435   4.111
   52    HA   CYS   7           HA       CYS   7   9.340   4.922   2.002
   53   1HB   CYS   7          HB2       CYS   7  11.183   6.196   3.500
   54   2HB   CYS   7          HB1       CYS   7  12.032   4.667   3.268
   55    H    CYS   8           HN       CYS   8  11.646   3.238   1.480
   56    HA   CYS   8           HA       CYS   8  11.176   0.679   2.855
   57   1HB   CYS   8          HB2       CYS   8   9.921   1.478   0.299
   58   2HB   CYS   8          HB1       CYS   8  10.657  -0.126   0.298
   59    H    MET   9           HN       MET   9  12.779  -0.895   2.306
   60    HA   MET   9           HA       MET   9  15.165   0.226   0.913
   61   1HB   MET   9          HB2       MET   9  15.479  -0.579   3.182
   62   2HB   MET   9          HB1       MET   9  14.683  -2.105   2.796
   63   1HG   MET   9          HG2       MET   9  16.620  -2.984   2.063
   64   2HG   MET   9          HG1       MET   9  16.842  -1.645   0.938
   65   1HE   MET   9          HE1       MET   9  19.772  -2.812   3.370
   66   2HE   MET   9          HE2       MET   9  18.295  -3.628   2.861
   67   3HE   MET   9          HE3       MET   9  18.450  -3.058   4.522
   68    H    PHE  10           HN       PHE  10  13.204  -2.779   1.033
   69    HA   PHE  10           HA       PHE  10  14.220  -3.419  -1.715
   70   1HB   PHE  10          HB2       PHE  10  14.095  -5.718  -1.085
   71   2HB   PHE  10          HB1       PHE  10  14.778  -4.901   0.316
   72    HD1  PHE  10           HD1      PHE  10  13.375  -4.469   2.330
   73    HD2  PHE  10           HD2      PHE  10  11.890  -6.707  -1.023
   74    HE1  PHE  10           HE1      PHE  10  11.516  -5.330   3.728
   75    HE2  PHE  10           HE2      PHE  10  10.032  -7.565   0.375
   76    HZ   PHE  10           HZ       PHE  10   9.844  -6.878   2.750
   77    H    PHE  11           HN       PHE  11  12.344  -5.296  -2.471
   78    HA   PHE  11           HA       PHE  11   9.731  -3.850  -2.254
   79   1HB   PHE  11          HB2       PHE  11  11.460  -4.327  -4.535
   80   2HB   PHE  11          HB1       PHE  11   9.889  -5.084  -4.789
   81    HD1  PHE  11           HD1      PHE  11  11.391  -2.401  -5.896
   82    HD2  PHE  11           HD2      PHE  11   8.114  -3.258  -3.258
   83    HE1  PHE  11           HE1      PHE  11  10.399  -0.189  -6.405
   84    HE2  PHE  11           HE2      PHE  11   7.129  -1.047  -3.761
   85    HZ   PHE  11           HZ       PHE  11   8.267   0.491  -5.338
   86    H    VAL  12           HN       VAL  12   7.891  -5.197  -2.233
   87    HA   VAL  12           HA       VAL  12   7.989  -7.714  -1.046
   88    HB   VAL  12           HB       VAL  12   5.691  -7.975  -2.150
   89   1HG1  VAL  12          HG1       VAL  12   5.383  -6.999  -0.127
   90   2HG1  VAL  12          HG1       VAL  12   5.027  -5.572  -1.095
   91   3HG1  VAL  12          HG1       VAL  12   6.634  -5.787  -0.400
   92   1HG2  VAL  12          HG2       VAL  12   6.816  -5.920  -3.841
   93   2HG2  VAL  12          HG2       VAL  12   5.377  -5.299  -3.037
   94   3HG2  VAL  12          HG2       VAL  12   5.278  -6.766  -4.006
   95    H    SER  13           HN       SER  13   8.032  -9.860  -1.821
   96    HA   SER  13           HA       SER  13   9.411 -10.364  -4.315
   97   1HB   SER  13          HB2       SER  13   9.003 -12.717  -3.658
   98   2HB   SER  13          HB1       SER  13   9.538 -11.770  -2.270
   99    HG   SER  13           HG       SER  13   7.143 -13.014  -2.757
  100    H    LYS  14           HN       LYS  14   6.070 -10.055  -3.364
  101    HA   LYS  14           HA       LYS  14   5.198 -10.246  -6.159
  102   1HB   LYS  14          HB2       LYS  14   4.704 -12.340  -4.063
  103   2HB   LYS  14          HB1       LYS  14   3.460 -12.040  -5.276
  104   1HG   LYS  14          HG2       LYS  14   5.623 -12.157  -6.887
  105   2HG   LYS  14          HG1       LYS  14   6.165 -13.227  -5.594
  106   1HD   LYS  14          HD2       LYS  14   4.733 -14.858  -6.218
  107   2HD   LYS  14          HD1       LYS  14   3.387 -13.725  -6.341
  108   1HE   LYS  14          HE2       LYS  14   3.545 -14.120  -8.589
  109   2HE   LYS  14          HE1       LYS  14   4.938 -13.021  -8.518
  110   1HZ   LYS  14          HZ1       LYS  14   6.352 -14.914  -7.980
  111   2HZ   LYS  14          HZ2       LYS  14   5.578 -15.151  -9.474
  112   3HZ   LYS  14          HZ3       LYS  14   5.025 -15.962  -8.087
  113    H    ARG  15           HN       ARG  15   2.528 -10.276  -5.925
  114    HA   ARG  15           HA       ARG  15   1.889  -7.743  -4.690
  115   1HB   ARG  15          HB2       ARG  15  -0.363  -8.288  -5.529
  116   2HB   ARG  15          HB1       ARG  15   0.854  -8.681  -6.742
  117   1HG   ARG  15          HG2       ARG  15   0.450 -10.924  -4.959
  118   2HG   ARG  15          HG1       ARG  15  -1.081 -10.421  -5.678
  119   1HD   ARG  15          HD2       ARG  15   0.571 -10.289  -7.856
  120   2HD   ARG  15          HD1       ARG  15   1.278 -11.653  -6.967
  121    HE   ARG  15           HE       ARG  15  -1.676 -11.563  -7.372
  122   1HH1  ARG  15          HH1       ARG  15   0.870 -12.533  -9.221
  123   2HH1  ARG  15          HH1       ARG  15   0.488 -14.221  -9.233
  124   1HH2  ARG  15          HH2       ARG  15  -1.950 -13.956  -6.782
  125   2HH2  ARG  15          HH2       ARG  15  -1.109 -15.027  -7.850
  126    H    ILE  16           HN       ILE  16  -0.725  -8.426  -3.639
  127    HA   ILE  16           HA       ILE  16  -0.137 -10.154  -1.279
  128    HB   ILE  16           HB       ILE  16  -1.505  -7.573  -0.702
  129   1HG1  ILE  16          HG1       ILE  16   1.462  -7.679  -1.361
  130   2HG1  ILE  16          HG1       ILE  16   0.242  -6.707  -2.180
  131   1HG2  ILE  16          HG2       ILE  16  -1.051  -8.427   1.322
  132   2HG2  ILE  16          HG2       ILE  16   0.647  -8.049   1.037
  133   3HG2  ILE  16          HG2       ILE  16   0.020  -9.643   0.627
  134   1HD1  ILE  16          HD1       ILE  16  -0.106  -5.352  -0.212
  135   2HD1  ILE  16          HD1       ILE  16   1.634  -5.435  -0.486
  136   3HD1  ILE  16          HD1       ILE  16   0.891  -6.424   0.770
  137    HA   PRO  17           HA       PRO  17  -4.436 -10.995  -1.881
  138   1HB   PRO  17          HB2       PRO  17  -5.032 -12.178   0.502
  139   2HB   PRO  17          HB1       PRO  17  -4.031 -12.953  -0.739
  140   1HG   PRO  17          HG2       PRO  17  -3.255 -11.842   1.839
  141   2HG   PRO  17          HG1       PRO  17  -2.388 -12.964   0.785
  142   1HD   PRO  17          HD2       PRO  17  -1.980 -10.137   1.112
  143   2HD   PRO  17          HD1       PRO  17  -1.050 -11.278   0.116
  144    H    GLU  18           HN       GLU  18  -5.988  -9.387  -1.871
  145    HA   GLU  18           HA       GLU  18  -6.198  -7.169  -0.208
  146   1HB   GLU  18          HB2       GLU  18  -7.634  -8.406  -2.263
  147   2HB   GLU  18          HB1       GLU  18  -8.803  -8.247  -0.950
  148   1HG   GLU  18          HG2       GLU  18  -7.036  -5.923  -1.673
  149   2HG   GLU  18          HG1       GLU  18  -8.490  -6.251  -2.618
  150    H    ASN  19           HN       ASN  19  -7.336 -10.447   0.443
  151    HA   ASN  19           HA       ASN  19  -9.054  -9.846   2.664
  152   1HB   ASN  19          HB2       ASN  19  -8.850 -11.970   1.282
  153   2HB   ASN  19          HB1       ASN  19  -7.381 -12.329   2.188
  154   1HD2  ASN  19          HD2       ASN  19 -10.903 -12.076   2.440
  155   2HD2  ASN  19          HD2       ASN  19 -11.021 -12.788   3.977
  156    H    ARG  20           HN       ARG  20  -5.628  -9.682   2.370
  157    HA   ARG  20           HA       ARG  20  -5.289  -9.880   5.336
  158   1HB   ARG  20          HB2       ARG  20  -3.449 -10.247   2.959
  159   2HB   ARG  20          HB1       ARG  20  -2.887 -10.259   4.626
  160   1HG   ARG  20          HG2       ARG  20  -4.823 -12.027   4.943
  161   2HG   ARG  20          HG1       ARG  20  -4.622 -12.238   3.204
  162   1HD   ARG  20          HD2       ARG  20  -2.066 -12.421   3.772
  163   2HD   ARG  20          HD1       ARG  20  -2.646 -12.796   5.407
  164    HE   ARG  20           HE       ARG  20  -2.885 -14.542   3.112
  165   1HH1  ARG  20          HH1       ARG  20  -5.730 -13.756   3.949
  166   2HH1  ARG  20          HH1       ARG  20  -6.110 -15.038   5.049
  167   1HH2  ARG  20          HH2       ARG  20  -2.819 -16.070   5.400
  168   2HH2  ARG  20          HH2       ARG  20  -4.464 -16.350   5.868
  169    H    VAL  21           HN       VAL  21  -4.708  -7.882   2.486
  170    HA   VAL  21           HA       VAL  21  -3.074  -5.889   3.812
  171    HB   VAL  21           HB       VAL  21  -4.811  -5.676   1.335
  172   1HG1  VAL  21          HG1       VAL  21  -3.617  -3.634   2.506
  173   2HG1  VAL  21          HG1       VAL  21  -3.531  -3.818   0.755
  174   3HG1  VAL  21          HG1       VAL  21  -2.171  -4.314   1.764
  175   1HG2  VAL  21          HG2       VAL  21  -2.515  -7.335   1.907
  176   2HG2  VAL  21          HG2       VAL  21  -2.102  -6.148   0.669
  177   3HG2  VAL  21          HG2       VAL  21  -3.464  -7.241   0.426
  178    H    VAL  22           HN       VAL  22  -3.736  -3.761   4.497
  179    HA   VAL  22           HA       VAL  22  -6.671  -3.447   4.945
  180    HB   VAL  22           HB       VAL  22  -5.909  -2.301   7.083
  181   1HG1  VAL  22          HG1       VAL  22  -6.292  -5.013   6.463
  182   2HG1  VAL  22          HG1       VAL  22  -6.453  -4.245   8.043
  183   3HG1  VAL  22          HG1       VAL  22  -4.912  -4.957   7.562
  184   1HG2  VAL  22          HG2       VAL  22  -3.666  -2.913   7.919
  185   2HG2  VAL  22          HG2       VAL  22  -3.560  -1.929   6.460
  186   3HG2  VAL  22          HG2       VAL  22  -3.306  -3.671   6.372
  187    H    SER  23           HN       SER  23  -3.536  -1.787   4.551
  188    HA   SER  23           HA       SER  23  -4.722   0.333   2.965
  189   1HB   SER  23          HB2       SER  23  -5.632   0.841   5.196
  190   2HB   SER  23          HB1       SER  23  -4.005   0.847   5.868
  191    HG   SER  23           HG       SER  23  -3.574   2.549   4.273
  192    H    TYR  24           HN       TYR  24  -3.069   1.657   2.056
  193    HA   TYR  24           HA       TYR  24  -0.300   0.765   2.658
  194   1HB   TYR  24          HB2       TYR  24   0.119   1.373   0.364
  195   2HB   TYR  24          HB1       TYR  24  -1.375   0.457   0.406
  196    HD1  TYR  24           HD1      TYR  24  -3.549   1.565   0.079
  197    HD2  TYR  24           HD2      TYR  24   0.131   3.774  -0.129
  198    HE1  TYR  24           HE1      TYR  24  -4.750   3.465  -0.970
  199    HE2  TYR  24           HE2      TYR  24  -1.074   5.674  -1.172
  200    HH   TYR  24           HH       TYR  24  -3.074   6.146  -2.370
  201    H    GLN  25           HN       GLN  25   1.019   2.816   1.388
  202    HA   GLN  25           HA       GLN  25   0.293   5.457   2.366
  203   1HB   GLN  25          HB2       GLN  25   1.035   4.243   4.426
  204   2HB   GLN  25          HB1       GLN  25   2.599   3.958   3.662
  205   1HG   GLN  25          HG2       GLN  25   1.472   6.746   3.919
  206   2HG   GLN  25          HG1       GLN  25   2.382   6.006   5.237
  207   1HE2  GLN  25          HE2       GLN  25   3.176   8.317   3.482
  208   2HE2  GLN  25          HE2       GLN  25   4.645   7.856   2.767
  209    H    LEU  26           HN       LEU  26   1.089   6.680   0.689
  210    HA   LEU  26           HA       LEU  26   3.185   5.609  -1.044
  211   1HB   LEU  26          HB2       LEU  26   1.316   7.945  -0.966
  212   2HB   LEU  26          HB1       LEU  26   2.693   7.999  -2.071
  213    HG   LEU  26           HG       LEU  26   0.708   5.717  -1.919
  214   1HD1  LEU  26          HD1       LEU  26   0.230   6.712  -4.318
  215   2HD1  LEU  26          HD1       LEU  26   0.838   8.201  -3.592
  216   3HD1  LEU  26          HD1       LEU  26  -0.569   7.391  -2.900
  217   1HD2  LEU  26          HD2       LEU  26   1.838   5.245  -4.193
  218   2HD2  LEU  26          HD2       LEU  26   2.763   4.880  -2.738
  219   3HD2  LEU  26          HD2       LEU  26   3.099   6.351  -3.646
  220    H    SER  27           HN       SER  27   5.296   5.904  -0.689
  221    HA   SER  27           HA       SER  27   6.201   8.122   1.076
  222   1HB   SER  27          HB2       SER  27   6.849   5.365   0.669
  223   2HB   SER  27          HB1       SER  27   8.281   6.322   0.294
  224    HG   SER  27           HG       SER  27   8.431   6.879   2.327
  225    H    SER  28           HN       SER  28   7.342   9.825   0.197
  226    HA   SER  28           HA       SER  28   8.899   9.513  -2.270
  227   1HB   SER  28          HB2       SER  28   6.377  11.198  -2.164
  228   2HB   SER  28          HB1       SER  28   7.518  11.177  -3.506
  229    HG   SER  28           HG       SER  28   5.671   9.264  -2.669
  230    H    ARG  29           HN       ARG  29  10.601  10.330  -0.900
  231    HA   ARG  29           HA       ARG  29  10.351  13.251  -0.260
  232   1HB   ARG  29          HB2       ARG  29  10.559  11.104   1.494
  233   2HB   ARG  29          HB1       ARG  29  12.217  11.693   1.378
  234   1HG   ARG  29          HG2       ARG  29  11.706  13.736   2.315
  235   2HG   ARG  29          HG1       ARG  29  10.056  13.728   1.692
  236   1HD   ARG  29          HD2       ARG  29   9.784  11.670   3.355
  237   2HD   ARG  29          HD1       ARG  29  11.137  12.465   4.185
  238    HE   ARG  29           HE       ARG  29   9.760  14.495   4.357
  239   1HH1  ARG  29          HH1       ARG  29   7.973  13.654   1.984
  240   2HH1  ARG  29          HH1       ARG  29   6.482  13.343   2.806
  241   1HH2  ARG  29          HH2       ARG  29   7.936  13.234   5.954
  242   2HH2  ARG  29          HH2       ARG  29   6.459  13.108   5.055
  243    H    SER  30           HN       SER  30  13.107  13.388   0.624
  244    HA   SER  30           HA       SER  30  14.494  13.050  -2.014
  245   1HB   SER  30          HB2       SER  30  14.017  15.272  -0.345
  246   2HB   SER  30          HB1       SER  30  15.728  14.896  -0.150
  247    HG   SER  30           HG       SER  30  14.483  16.057  -2.209
  248    H    THR  31           HN       THR  31  14.497  12.109   1.310
  249    HA   THR  31           HA       THR  31  17.373  11.343   1.240
  250    HB   THR  31           HB       THR  31  16.350  12.550   3.180
  251    HG1  THR  31           HG1      THR  31  17.916  11.503   4.078
  252   1HG2  THR  31          HG2       THR  31  14.994  10.132   4.173
  253   2HG2  THR  31          HG2       THR  31  14.214  10.875   2.778
  254   3HG2  THR  31          HG2       THR  31  14.483  11.819   4.243
  255    H    CYS  32           HN       CYS  32  15.079   9.962  -0.289
  256    HA   CYS  32           HA       CYS  32  15.338   7.239   0.939
  257   1HB   CYS  32          HB2       CYS  32  13.247   8.732  -0.591
  258   2HB   CYS  32          HB1       CYS  32  13.328   6.984  -0.817
  259    H    LEU  33           HN       LEU  33  14.822   5.637  -1.204
  260    HA   LEU  33           HA       LEU  33  16.793   6.423  -3.302
  261   1HB   LEU  33          HB2       LEU  33  17.767   4.179  -3.112
  262   2HB   LEU  33          HB1       LEU  33  17.790   4.974  -1.538
  263    HG   LEU  33           HG       LEU  33  15.293   3.701  -1.664
  264   1HD1  LEU  33          HD1       LEU  33  16.005   1.325  -2.110
  265   2HD1  LEU  33          HD1       LEU  33  17.521   1.955  -2.755
  266   3HD1  LEU  33          HD1       LEU  33  15.995   2.347  -3.546
  267   1HD2  LEU  33          HD2       LEU  33  16.094   3.379   0.422
  268   2HD2  LEU  33          HD2       LEU  33  17.753   3.636  -0.118
  269   3HD2  LEU  33          HD2       LEU  33  17.031   2.032  -0.221
  270    H    LYS  34           HN       LYS  34  13.701   6.064  -3.045
  271    HA   LYS  34           HA       LYS  34  13.278   5.015  -5.705
  272   1HB   LYS  34          HB2       LYS  34  12.102   2.929  -4.964
  273   2HB   LYS  34          HB1       LYS  34  13.821   2.920  -4.569
  274   1HG   LYS  34          HG2       LYS  34  13.447   3.132  -2.308
  275   2HG   LYS  34          HG1       LYS  34  11.961   4.055  -2.534
  276   1HD   LYS  34          HD2       LYS  34  11.414   1.840  -1.660
  277   2HD   LYS  34          HD1       LYS  34  10.829   1.979  -3.318
  278   1HE   LYS  34          HE2       LYS  34  11.908  -0.100  -3.398
  279   2HE   LYS  34          HE1       LYS  34  13.231   0.976  -3.892
  280   1HZ   LYS  34          HZ1       LYS  34  12.648   0.157  -1.094
  281   2HZ   LYS  34          HZ2       LYS  34  13.934   1.147  -1.602
  282   3HZ   LYS  34          HZ3       LYS  34  13.887  -0.490  -2.055
  283    H    ALA  35           HN       ALA  35  10.813   4.681  -6.061
  284    HA   ALA  35           HA       ALA  35   9.214   6.359  -4.166
  285   1HB   ALA  35          HB1       ALA  35   8.257   6.985  -6.682
  286   2HB   ALA  35          HB2       ALA  35   9.990   6.817  -6.966
  287   3HB   ALA  35          HB3       ALA  35   9.401   7.966  -5.767
  288    H    GLY  36           HN       GLY  36   8.523   4.053  -3.579
  289   1HA   GLY  36          HA2       GLY  36   6.416   3.117  -5.492
  290   2HA   GLY  36          HA1       GLY  36   7.357   1.996  -4.501
  291    H    VAL  37           HN       VAL  37   5.049   1.377  -3.720
  292    HA   VAL  37           HA       VAL  37   4.145   3.368  -1.659
  293    HB   VAL  37           HB       VAL  37   2.585   1.036  -2.773
  294   1HG1  VAL  37          HG1       VAL  37   0.730   2.777  -2.158
  295   2HG1  VAL  37          HG1       VAL  37   2.003   3.531  -1.198
  296   3HG1  VAL  37          HG1       VAL  37   1.513   1.872  -0.863
  297   1HG2  VAL  37          HG2       VAL  37   2.576   2.118  -4.770
  298   2HG2  VAL  37          HG2       VAL  37   3.320   3.559  -4.077
  299   3HG2  VAL  37          HG2       VAL  37   1.574   3.329  -3.970
  300    H    ILE  38           HN       ILE  38   3.100   2.204   0.272
  301    HA   ILE  38           HA       ILE  38   4.635  -0.285   0.959
  302    HB   ILE  38           HB       ILE  38   4.051   2.209   2.590
  303   1HG1  ILE  38          HG1       ILE  38   6.713   1.821   2.743
  304   2HG1  ILE  38          HG1       ILE  38   6.415   1.071   1.175
  305   1HG2  ILE  38          HG2       ILE  38   5.709   0.745   4.149
  306   2HG2  ILE  38          HG2       ILE  38   4.811  -0.557   3.369
  307   3HG2  ILE  38          HG2       ILE  38   3.953   0.677   4.293
  308   1HD1  ILE  38          HD1       ILE  38   5.232   3.144   0.445
  309   2HD1  ILE  38          HD1       ILE  38   6.917   3.441   0.857
  310   3HD1  ILE  38          HD1       ILE  38   5.641   3.890   1.988
  311    H    PHE  39           HN       PHE  39   3.208  -1.924   1.497
  312    HA   PHE  39           HA       PHE  39   0.462  -1.102   2.367
  313   1HB   PHE  39          HB2       PHE  39   1.566  -3.303   0.642
  314   2HB   PHE  39          HB1       PHE  39   0.001  -3.508   1.428
  315    HD1  PHE  39           HD1      PHE  39  -1.911  -2.700   0.365
  316    HD2  PHE  39           HD2      PHE  39   1.909  -0.980  -0.576
  317    HE1  PHE  39           HE1      PHE  39  -2.971  -1.276  -1.364
  318    HE2  PHE  39           HE2      PHE  39   0.842   0.433  -2.308
  319    HZ   PHE  39           HZ       PHE  39  -1.596   0.284  -2.705
  320    H    THR  40           HN       THR  40  -0.238  -1.829   4.309
  321    HA   THR  40           HA       THR  40   1.523  -3.667   5.845
  322    HB   THR  40           HB       THR  40  -0.620  -1.638   6.530
  323    HG1  THR  40           HG1      THR  40   1.297  -0.664   6.243
  324   1HG2  THR  40          HG2       THR  40   0.686  -2.522   8.885
  325   2HG2  THR  40          HG2       THR  40   0.162  -3.970   8.030
  326   3HG2  THR  40          HG2       THR  40  -1.013  -2.727   8.457
  327    H    THR  41           HN       THR  41   0.627  -5.554   6.789
  328    HA   THR  41           HA       THR  41  -1.847  -6.537   5.517
  329    HB   THR  41           HB       THR  41  -0.286  -8.113   7.511
  330    HG1  THR  41           HG1      THR  41   1.411  -8.373   6.121
  331   1HG2  THR  41          HG2       THR  41  -1.414  -9.745   6.467
  332   2HG2  THR  41          HG2       THR  41  -0.567  -9.359   4.968
  333   3HG2  THR  41          HG2       THR  41  -2.098  -8.566   5.346
  334    H    LYS  42           HN       LYS  42  -3.334  -7.846   7.082
  335    HA   LYS  42           HA       LYS  42  -4.267  -6.041   9.167
  336   1HB   LYS  42          HB2       LYS  42  -6.017  -7.759   9.398
  337   2HB   LYS  42          HB1       LYS  42  -5.720  -7.414   7.695
  338   1HG   LYS  42          HG2       LYS  42  -5.026  -9.525   7.294
  339   2HG   LYS  42          HG1       LYS  42  -3.966  -9.521   8.702
  340   1HD   LYS  42          HD2       LYS  42  -6.001  -9.884  10.144
  341   2HD   LYS  42          HD1       LYS  42  -6.941 -10.091   8.663
  342   1HE   LYS  42          HE2       LYS  42  -4.955 -11.825   8.118
  343   2HE   LYS  42          HE1       LYS  42  -4.927 -11.916   9.891
  344   1HZ   LYS  42          HZ1       LYS  42  -7.422 -12.055   8.292
  345   2HZ   LYS  42          HZ2       LYS  42  -7.236 -12.381   9.948
  346   3HZ   LYS  42          HZ3       LYS  42  -6.570 -13.433   8.793
  347    H    LYS  43           HN       LYS  43  -2.012  -8.652   9.081
  348    HA   LYS  43           HA       LYS  43  -2.368  -9.478  11.870
  349   1HB   LYS  43          HB2       LYS  43  -0.624 -10.099   9.529
  350   2HB   LYS  43          HB1       LYS  43  -0.002 -10.513  11.127
  351   1HG   LYS  43          HG2       LYS  43  -2.763 -11.291  10.973
  352   2HG   LYS  43          HG1       LYS  43  -1.900 -11.955   9.585
  353   1HD   LYS  43          HD2       LYS  43  -0.369 -13.128  10.944
  354   2HD   LYS  43          HD1       LYS  43  -0.755 -12.159  12.367
  355   1HE   LYS  43          HE2       LYS  43  -2.486 -13.521  12.933
  356   2HE   LYS  43          HE1       LYS  43  -3.101 -13.548  11.268
  357   1HZ   LYS  43          HZ1       LYS  43  -1.081 -14.969  10.762
  358   2HZ   LYS  43          HZ2       LYS  43  -2.323 -15.712  11.651
  359   3HZ   LYS  43          HZ3       LYS  43  -0.918 -15.171  12.439
  360    H    GLY  44           HN       GLY  44  -0.647  -6.972  10.208
  361   1HA   GLY  44          HA2       GLY  44   0.208  -5.138  11.668
  362   2HA   GLY  44          HA1       GLY  44   0.861  -6.395  12.714
  363    H    GLN  45           HN       GLN  45   1.052  -6.835   9.273
  364    HA   GLN  45           HA       GLN  45   4.016  -6.612   9.456
  365   1HB   GLN  45          HB2       GLN  45   2.042  -8.248   8.091
  366   2HB   GLN  45          HB1       GLN  45   3.193  -7.573   6.936
  367   1HG   GLN  45          HG2       GLN  45   4.944  -8.311   8.810
  368   2HG   GLN  45          HG1       GLN  45   3.667  -9.466   9.199
  369   1HE2  GLN  45          HE2       GLN  45   5.039  -8.154   6.116
  370   2HE2  GLN  45          HE2       GLN  45   5.233  -9.676   5.390
  371    H    GLN  46           HN       GLN  46   5.048  -5.727   7.349
  372    HA   GLN  46           HA       GLN  46   3.446  -3.552   6.093
  373   1HB   GLN  46          HB2       GLN  46   5.960  -3.314   7.756
  374   2HB   GLN  46          HB1       GLN  46   5.516  -2.074   6.582
  375   1HG   GLN  46          HG2       GLN  46   4.206  -1.168   8.176
  376   2HG   GLN  46          HG1       GLN  46   3.156  -2.574   8.004
  377   1HE2  GLN  46          HE2       GLN  46   4.149  -0.934  10.467
  378   2HE2  GLN  46          HE2       GLN  46   4.683  -2.133  11.543
  379    H    SER  47           HN       SER  47   3.635  -4.611   4.063
  380    HA   SER  47           HA       SER  47   6.386  -5.230   3.089
  381   1HB   SER  47          HB2       SER  47   3.910  -5.849   1.539
  382   2HB   SER  47          HB1       SER  47   5.359  -6.822   1.772
  383    HG   SER  47           HG       SER  47   3.084  -6.564   3.361
  384    H    CYS  48           HN       CYS  48   7.272  -4.080   1.388
  385    HA   CYS  48           HA       CYS  48   6.120  -1.512   0.655
  386   1HB   CYS  48          HB2       CYS  48   8.428  -3.078  -0.546
  387   2HB   CYS  48          HB1       CYS  48   8.174  -1.338  -0.659
  388    H    GLY  49           HN       GLY  49   4.627  -1.197  -0.985
  389   1HA   GLY  49          HA2       GLY  49   4.203  -3.406  -2.913
  390   2HA   GLY  49          HA1       GLY  49   3.108  -2.055  -2.659
  391    H    ASP  50           HN       ASP  50   4.734  -3.233  -5.004
  392    HA   ASP  50           HA       ASP  50   6.324  -0.910  -5.881
  393   1HB   ASP  50          HB2       ASP  50   6.404  -3.640  -6.251
  394   2HB   ASP  50          HB1       ASP  50   5.702  -3.087  -7.772
  395    HA   PRO  51           HA       PRO  51   2.673   0.864  -7.744
  396   1HB   PRO  51          HB2       PRO  51   3.940   2.856  -9.147
  397   2HB   PRO  51          HB1       PRO  51   3.612   2.948  -7.406
  398   1HG   PRO  51          HG2       PRO  51   6.130   2.202  -8.816
  399   2HG   PRO  51          HG1       PRO  51   5.900   3.217  -7.380
  400   1HD   PRO  51          HD2       PRO  51   6.725   0.654  -7.214
  401   2HD   PRO  51          HD1       PRO  51   5.707   1.404  -5.967
  402    H    LYS  52           HN       LYS  52   5.445  -0.422  -9.407
  403    HA   LYS  52           HA       LYS  52   4.430  -0.164 -12.112
  404   1HB   LYS  52          HB2       LYS  52   6.237  -1.803 -12.569
  405   2HB   LYS  52          HB1       LYS  52   6.807  -0.507 -11.516
  406   1HG   LYS  52          HG2       LYS  52   6.727  -1.881  -9.591
  407   2HG   LYS  52          HG1       LYS  52   5.708  -3.081 -10.385
  408   1HD   LYS  52          HD2       LYS  52   7.829  -3.140 -12.052
  409   2HD   LYS  52          HD1       LYS  52   8.648  -2.683 -10.558
  410   1HE   LYS  52          HE2       LYS  52   6.931  -4.692  -9.714
  411   2HE   LYS  52          HE1       LYS  52   7.471  -5.263 -11.305
  412   1HZ   LYS  52          HZ1       LYS  52   9.374  -4.076  -9.382
  413   2HZ   LYS  52          HZ2       LYS  52   9.695  -5.089 -10.707
  414   3HZ   LYS  52          HZ3       LYS  52   8.980  -5.723  -9.303
  415    H    GLN  53           HN       GLN  53   3.860  -2.354  -9.454
  416    HA   GLN  53           HA       GLN  53   2.735  -4.512 -11.071
  417   1HB   GLN  53          HB2       GLN  53   2.858  -3.787  -8.140
  418   2HB   GLN  53          HB1       GLN  53   1.976  -5.205  -8.704
  419   1HG   GLN  53          HG2       GLN  53   4.622  -5.044  -9.907
  420   2HG   GLN  53          HG1       GLN  53   4.708  -5.085  -8.145
  421   1HE2  GLN  53          HE2       GLN  53   2.345  -6.646 -10.375
  422   2HE2  GLN  53          HE2       GLN  53   2.645  -8.224  -9.825
  423    H    GLU  54           HN       GLU  54   0.392  -5.145 -10.783
  424    HA   GLU  54           HA       GLU  54  -1.319  -2.750 -11.086
  425   1HB   GLU  54          HB2       GLU  54  -1.345  -4.623 -12.699
  426   2HB   GLU  54          HB1       GLU  54  -1.845  -5.722 -11.413
  427   1HG   GLU  54          HG2       GLU  54  -3.950  -4.653 -11.165
  428   2HG   GLU  54          HG1       GLU  54  -3.430  -3.240 -12.082
  429    H    TRP  55           HN       TRP  55  -0.623  -5.064  -8.558
  430    HA   TRP  55           HA       TRP  55  -3.273  -4.863  -7.331
  431   1HB   TRP  55          HB2       TRP  55  -2.254  -6.192  -5.578
  432   2HB   TRP  55          HB1       TRP  55  -1.741  -6.821  -7.135
  433    HD1  TRP  55           HD1      TRP  55   0.785  -6.590  -7.794
  434    HE1  TRP  55           HE1      TRP  55   2.896  -6.030  -6.415
  435    HE3  TRP  55           HE3      TRP  55  -1.372  -4.700  -3.563
  436    HZ2  TRP  55           HZ2      TRP  55   3.573  -4.960  -3.897
  437    HZ3  TRP  55           HZ3      TRP  55   0.045  -3.914  -1.684
  438    HH2  TRP  55           HH2      TRP  55   2.520  -4.040  -1.847
  439    H    VAL  56           HN       VAL  56  -0.112  -3.219  -6.849
  440    HA   VAL  56           HA       VAL  56  -0.975  -1.767  -4.496
  441    HB   VAL  56           HB       VAL  56   1.003  -0.946  -6.662
  442   1HG1  VAL  56          HG1       VAL  56   0.127   0.157  -4.088
  443   2HG1  VAL  56          HG1       VAL  56   1.004   0.944  -5.396
  444   3HG1  VAL  56          HG1       VAL  56   1.874  -0.023  -4.206
  445   1HG2  VAL  56          HG2       VAL  56   2.441  -1.846  -4.477
  446   2HG2  VAL  56          HG2       VAL  56   2.170  -2.766  -5.957
  447   3HG2  VAL  56          HG2       VAL  56   1.113  -3.001  -4.564
  448    H    GLN  57           HN       GLN  57  -1.062  -1.186  -7.986
  449    HA   GLN  57           HA       GLN  57  -2.321   1.414  -7.882
  450   1HB   GLN  57          HB2       GLN  57  -1.185  -0.363  -9.750
  451   2HB   GLN  57          HB1       GLN  57  -2.873  -0.219 -10.241
  452   1HG   GLN  57          HG2       GLN  57  -2.544   2.326  -9.962
  453   2HG   GLN  57          HG1       GLN  57  -0.816   1.969  -9.952
  454   1HE2  GLN  57          HE2       GLN  57  -0.380   0.139 -11.873
  455   2HE2  GLN  57          HE2       GLN  57  -0.980   0.630 -13.382
  456    H    ARG  58           HN       ARG  58  -3.572  -1.850  -8.673
  457    HA   ARG  58           HA       ARG  58  -6.325  -1.280  -8.863
  458   1HB   ARG  58          HB2       ARG  58  -5.359  -3.444  -9.406
  459   2HB   ARG  58          HB1       ARG  58  -4.782  -3.652  -7.755
  460   1HG   ARG  58          HG2       ARG  58  -7.217  -3.548  -7.020
  461   2HG   ARG  58          HG1       ARG  58  -7.645  -3.674  -8.726
  462   1HD   ARG  58          HD2       ARG  58  -5.701  -5.691  -8.219
  463   2HD   ARG  58          HD1       ARG  58  -6.913  -5.791  -6.927
  464    HE   ARG  58           HE       ARG  58  -7.774  -5.599  -9.783
  465   1HH1  ARG  58          HH2       ARG  58  -9.119  -6.072  -6.863
  466   2HH1  ARG  58          HH2       ARG  58  -9.760  -7.653  -7.159
  467   1HH2  ARG  58          HH1       ARG  58  -7.999  -8.102 -10.112
  468   2HH2  ARG  58          HH1       ARG  58  -9.128  -8.802  -8.999
  469    H    TYR  59           HN       TYR  59  -4.368  -2.070  -6.001
  470    HA   TYR  59           HA       TYR  59  -6.446  -1.963  -4.050
  471   1HB   TYR  59          HB2       TYR  59  -3.458  -1.555  -4.105
  472   2HB   TYR  59          HB1       TYR  59  -4.358  -1.325  -2.612
  473    HD1  TYR  59           HD1      TYR  59  -3.362  -3.150  -1.412
  474    HD2  TYR  59           HD2      TYR  59  -5.299  -3.859  -5.184
  475    HE1  TYR  59           HE1      TYR  59  -3.299  -5.584  -0.978
  476    HE2  TYR  59           HE2      TYR  59  -5.236  -6.299  -4.739
  477    HH   TYR  59           HH       TYR  59  -5.151  -7.771  -2.609
  478    H    MET  60           HN       MET  60  -4.026   0.511  -4.937
  479    HA   MET  60           HA       MET  60  -4.998   2.664  -3.417
  480   1HB   MET  60          HB2       MET  60  -3.151   2.163  -5.500
  481   2HB   MET  60          HB1       MET  60  -4.125   3.540  -5.995
  482   1HG   MET  60          HG2       MET  60  -3.481   4.834  -4.153
  483   2HG   MET  60          HG1       MET  60  -3.043   3.417  -3.199
  484   1HE   MET  60          HE1       MET  60  -0.015   2.166  -3.948
  485   2HE   MET  60          HE2       MET  60  -0.796   1.796  -5.485
  486   3HE   MET  60          HE3       MET  60  -1.740   1.775  -3.998
  487    H    LYS  61           HN       LYS  61  -5.934   1.645  -6.704
  488    HA   LYS  61           HA       LYS  61  -7.765   3.726  -7.300
  489   1HB   LYS  61          HB2       LYS  61  -6.789   1.479  -8.507
  490   2HB   LYS  61          HB1       LYS  61  -8.445   0.974  -8.168
  491   1HG   LYS  61          HG2       LYS  61  -9.360   2.527  -9.593
  492   2HG   LYS  61          HG1       LYS  61  -8.078   3.704  -9.303
  493   1HD   LYS  61          HD2       LYS  61  -6.844   2.947 -11.042
  494   2HD   LYS  61          HD1       LYS  61  -7.110   1.261 -10.600
  495   1HE   LYS  61          HE2       LYS  61  -9.563   1.743 -11.498
  496   2HE   LYS  61          HE1       LYS  61  -8.731   3.017 -12.411
  497   1HZ   LYS  61          HZ1       LYS  61  -7.068   1.321 -13.062
  498   2HZ   LYS  61          HZ2       LYS  61  -8.621   1.006 -13.679
  499   3HZ   LYS  61          HZ3       LYS  61  -8.039   0.129 -12.343
  500    H    ASN  62           HN       ASN  62  -8.356   0.560  -5.707
  501    HA   ASN  62           HA       ASN  62 -11.178   1.087  -5.258
  502   1HB   ASN  62          HB2       ASN  62  -9.161  -0.970  -4.781
  503   2HB   ASN  62          HB1       ASN  62 -10.261  -0.812  -3.411
  504   1HD2  ASN  62          HD2       ASN  62 -10.069  -2.957  -5.593
  505   2HD2  ASN  62          HD2       ASN  62 -11.639  -3.046  -6.233
  506    H    LEU  63           HN       LEU  63  -8.291   1.131  -3.164
  507    HA   LEU  63           HA       LEU  63  -9.452   1.950  -0.739
  508   1HB   LEU  63          HB2       LEU  63  -6.836   2.052  -2.123
  509   2HB   LEU  63          HB1       LEU  63  -7.016   3.200  -0.795
  510    HG   LEU  63           HG       LEU  63  -7.925   0.385  -0.356
  511   1HD1  LEU  63          HD1       LEU  63  -5.157   1.215  -0.959
  512   2HD1  LEU  63          HD1       LEU  63  -5.882  -0.392  -0.981
  513   3HD1  LEU  63          HD1       LEU  63  -5.337   0.307   0.544
  514   1HD2  LEU  63          HD2       LEU  63  -6.446   1.323   1.808
  515   2HD2  LEU  63          HD2       LEU  63  -8.202   1.386   1.657
  516   3HD2  LEU  63          HD2       LEU  63  -7.226   2.777   1.183
  517    H    ASP  64           HN       ASP  64  -8.931   3.768  -3.681
  518    HA   ASP  64           HA       ASP  64  -9.143   6.408  -2.444
  519   1HB   ASP  64          HB2       ASP  64  -8.926   5.183  -5.156
  520   2HB   ASP  64          HB1       ASP  64  -9.594   6.814  -5.068
  521    H    ALA  65           HN       ALA  65 -11.342   4.185  -4.145
  522    HA   ALA  65           HA       ALA  65 -13.581   6.098  -3.988
  523   1HB   ALA  65          HB1       ALA  65 -13.009   3.395  -5.145
  524   2HB   ALA  65          HB2       ALA  65 -13.639   4.838  -5.940
  525   3HB   ALA  65          HB3       ALA  65 -14.692   3.865  -4.912
  526    H    LYS  66           HN       LYS  66 -12.178   4.484  -1.595
  527    HA   LYS  66           HA       LYS  66 -14.767   3.594  -0.371
  528   1HB   LYS  66          HB2       LYS  66 -11.973   2.491  -0.382
  529   2HB   LYS  66          HB1       LYS  66 -13.027   2.152   0.993
  530   1HG   LYS  66          HG2       LYS  66 -13.823   1.653  -1.886
  531   2HG   LYS  66          HG1       LYS  66 -13.123   0.417  -0.838
  532   1HD   LYS  66          HD2       LYS  66 -15.119   0.047   0.132
  533   2HD   LYS  66          HD1       LYS  66 -15.273   1.755   0.543
  534   1HE   LYS  66          HE2       LYS  66 -17.099   1.521  -0.885
  535   2HE   LYS  66          HE1       LYS  66 -15.848   1.938  -2.072
  536   1HZ   LYS  66          HZ1       LYS  66 -17.118  -0.141  -2.588
  537   2HZ   LYS  66          HZ2       LYS  66 -16.416  -0.843  -1.209
  538   3HZ   LYS  66          HZ3       LYS  66 -15.437  -0.343  -2.504
  539    H    GLN  67           HN       GLN  67 -11.465   4.459   0.688
  540    HA   GLN  67           HA       GLN  67 -12.705   6.140   2.840
  541   1HB   GLN  67          HB2       GLN  67 -10.907   3.974   2.901
  542   2HB   GLN  67          HB1       GLN  67  -9.927   5.401   3.238
  543   1HG   GLN  67          HG2       GLN  67 -11.752   6.068   4.912
  544   2HG   GLN  67          HG1       GLN  67 -12.367   4.424   4.731
  545   1HE2  GLN  67          HE2       GLN  67 -11.643   3.208   6.484
  546   2HE2  GLN  67          HE2       GLN  67 -10.071   3.260   7.123
  547    H    LYS  68           HN       LYS  68 -12.203   7.154   0.169
  548    HA   LYS  68           HA       LYS  68 -10.569   9.475   0.841
  549   1HB   LYS  68          HB2       LYS  68  -9.337   7.138  -0.214
  550   2HB   LYS  68          HB1       LYS  68  -9.339   8.345  -1.500
  551   1HG   LYS  68          HG2       LYS  68  -8.544   9.960   0.429
  552   2HG   LYS  68          HG1       LYS  68  -8.036   8.456   1.199
  553   1HD   LYS  68          HD2       LYS  68  -7.304   8.628  -1.643
  554   2HD   LYS  68          HD1       LYS  68  -6.541   9.861  -0.640
  555   1HE   LYS  68          HE2       LYS  68  -5.046   8.282   0.007
  556   2HE   LYS  68          HE1       LYS  68  -6.375   7.461   0.849
  557   1HZ   LYS  68          HZ1       LYS  68  -5.627   5.899  -0.703
  558   2HZ   LYS  68          HZ2       LYS  68  -5.436   7.060  -1.929
  559   3HZ   LYS  68          HZ3       LYS  68  -6.992   6.584  -1.442
  560    H    LYS  69           HN       LYS  69  -9.953  10.210  -1.854
  561    HA   LYS  69           HA       LYS  69 -12.644  10.242  -3.175
  562   1HB   LYS  69          HB2       LYS  69 -12.234  12.680  -3.571
  563   2HB   LYS  69          HB1       LYS  69 -12.343  12.284  -1.855
  564   1HG   LYS  69          HG2       LYS  69  -9.878  12.196  -1.720
  565   2HG   LYS  69          HG1       LYS  69  -9.772  12.614  -3.431
  566   1HD   LYS  69          HD2       LYS  69  -9.900  14.793  -2.896
  567   2HD   LYS  69          HD1       LYS  69 -11.496  14.516  -2.198
  568   1HE   LYS  69          HE2       LYS  69 -10.386  15.289  -0.307
  569   2HE   LYS  69          HE1       LYS  69 -10.000  13.562  -0.171
  570   1HZ   LYS  69          HZ1       LYS  69  -8.343  15.727  -1.321
  571   2HZ   LYS  69          HZ2       LYS  69  -8.064  14.096  -1.708
  572   3HZ   LYS  69          HZ3       LYS  69  -7.931  14.625  -0.099
  573    H    ALA  70           HN       ALA  70 -12.539  10.155  -5.433
  574    HA   ALA  70           HA       ALA  70  -9.812   9.805  -6.607
  575   1HB   ALA  70          HB1       ALA  70 -12.597   8.850  -7.286
  576   2HB   ALA  70          HB2       ALA  70 -11.179   7.882  -6.882
  577   3HB   ALA  70          HB3       ALA  70 -11.271   8.709  -8.438
  578    H    SER  71           HN       SER  71 -12.302  12.104  -6.433
  579    HA   SER  71           HA       SER  71 -11.134  13.613  -8.690
  580   1HB   SER  71          HB2       SER  71 -13.345  11.931  -9.039
  581   2HB   SER  71          HB1       SER  71 -14.043  13.543  -8.891
  582    HG   SER  71           HG       SER  71 -12.833  14.220 -10.597
  583    HA   PRO  72           HA       PRO  72 -12.563  16.156  -5.110
  584   1HB   PRO  72          HB2       PRO  72 -10.343  17.739  -5.001
  585   2HB   PRO  72          HB1       PRO  72 -10.462  16.178  -4.166
  586   1HG   PRO  72          HG2       PRO  72  -9.125  16.855  -6.732
  587   2HG   PRO  72          HG1       PRO  72  -8.605  15.760  -5.441
  588   1HD   PRO  72          HD2       PRO  72  -9.726  14.906  -7.771
  589   2HD   PRO  72          HD1       PRO  72  -9.851  14.016  -6.238
  590    H    ARG  73           HN       ARG  73 -14.137  17.038  -6.660
  591    HA   ARG  73           HA       ARG  73 -13.391  19.737  -7.596
  592   1HB   ARG  73          HB2       ARG  73 -13.057  17.593  -9.282
  593   2HB   ARG  73          HB1       ARG  73 -14.695  18.110  -9.685
  594   1HG   ARG  73          HG2       ARG  73 -13.979  20.298 -10.270
  595   2HG   ARG  73          HG1       ARG  73 -12.410  20.076  -9.495
  596   1HD   ARG  73          HD2       ARG  73 -11.546  18.883 -11.272
  597   2HD   ARG  73          HD1       ARG  73 -13.120  18.175 -11.690
  598    HE   ARG  73           HE       ARG  73 -12.707  21.098 -12.098
  599   1HH1  ARG  73          HH2       ARG  73 -11.387  19.612 -14.279
  600   2HH1  ARG  73          HH2       ARG  73 -12.665  19.386 -15.426
  601   1HH2  ARG  73          HH1       ARG  73 -15.187  20.083 -13.150
  602   2HH2  ARG  73          HH1       ARG  73 -14.816  19.655 -14.786
  Start of MODEL    5
    1   1H    VAL   1          HT1       VAL   1  -4.083   5.442   5.626
    2   2H    VAL   1          HT2       VAL   1  -5.452   6.015   6.452
    3   3H    VAL   1          HT3       VAL   1  -4.742   4.539   6.901
    4    HA   VAL   1           HA       VAL   1  -4.257   6.647   8.316
    5    HB   VAL   1           HB       VAL   1  -1.957   5.649   8.676
    6   1HG1  VAL   1          HG1       VAL   1  -2.920   3.946   9.830
    7   2HG1  VAL   1          HG1       VAL   1  -3.667   3.266   8.385
    8   3HG1  VAL   1          HG1       VAL   1  -4.438   4.611   9.227
    9   1HG2  VAL   1          HG2       VAL   1  -1.395   5.089   6.378
   10   2HG2  VAL   1          HG2       VAL   1  -2.800   4.031   6.252
   11   3HG2  VAL   1          HG2       VAL   1  -1.462   3.593   7.313
   12    H    VAL   2           HN       VAL   2  -3.365   8.682   8.156
   13    HA   VAL   2           HA       VAL   2  -2.288   9.594   5.590
   14    HB   VAL   2           HB       VAL   2  -2.205  11.756   6.830
   15   1HG1  VAL   2          HG1       VAL   2  -4.369  11.808   6.208
   16   2HG1  VAL   2          HG1       VAL   2  -4.776  11.174   7.802
   17   3HG1  VAL   2          HG1       VAL   2  -4.531  10.068   6.451
   18   1HG2  VAL   2          HG2       VAL   2  -2.175   9.932   9.080
   19   2HG2  VAL   2          HG2       VAL   2  -3.508  11.076   9.236
   20   3HG2  VAL   2          HG2       VAL   2  -1.855  11.667   9.057
   21    H    ILE   3           HN       ILE   3  -0.376   8.358   5.395
   22    HA   ILE   3           HA       ILE   3   1.736   8.272   7.353
   23    HB   ILE   3           HB       ILE   3   1.504   6.618   5.596
   24   1HG1  ILE   3          HG1       ILE   3   3.910   8.415   5.140
   25   2HG1  ILE   3          HG1       ILE   3   3.810   7.048   6.250
   26   1HG2  ILE   3          HG2       ILE   3   0.685   7.273   3.601
   27   2HG2  ILE   3          HG2       ILE   3   2.248   8.003   3.234
   28   3HG2  ILE   3          HG2       ILE   3   0.983   8.965   3.996
   29   1HD1  ILE   3          HD1       ILE   3   4.479   7.040   3.454
   30   2HD1  ILE   3          HD1       ILE   3   3.018   6.089   3.708
   31   3HD1  ILE   3          HD1       ILE   3   4.489   5.695   4.594
   32    HA   PRO   4           HA       PRO   4   3.433  12.304   6.627
   33   1HB   PRO   4          HB2       PRO   4   5.923  11.904   7.698
   34   2HB   PRO   4          HB1       PRO   4   4.465  12.130   8.684
   35   1HG   PRO   4          HG2       PRO   4   5.928   9.632   8.018
   36   2HG   PRO   4          HG1       PRO   4   5.087  10.089   9.504
   37   1HD   PRO   4          HD2       PRO   4   4.064   8.389   7.607
   38   2HD   PRO   4          HD1       PRO   4   3.081   9.321   8.754
   39    H    SER   5           HN       SER   5   6.417  10.423   6.361
   40    HA   SER   5           HA       SER   5   6.403  10.320   3.449
   41   1HB   SER   5          HB2       SER   5   6.665  12.753   3.969
   42   2HB   SER   5          HB1       SER   5   8.137  12.373   4.861
   43    HG   SER   5           HG       SER   5   7.686  12.531   2.160
   44    HA   PRO   6           HA       PRO   6   9.646   7.918   5.907
   45   1HB   PRO   6          HB2       PRO   6   8.509   5.440   5.814
   46   2HB   PRO   6          HB1       PRO   6   8.220   6.589   7.135
   47   1HG   PRO   6          HG2       PRO   6   6.513   5.911   4.807
   48   2HG   PRO   6          HG1       PRO   6   6.055   6.287   6.474
   49   1HD   PRO   6          HD2       PRO   6   5.860   8.057   4.390
   50   2HD   PRO   6          HD1       PRO   6   6.029   8.534   6.094
   51    H    CYS   7           HN       CYS   7  10.478   5.531   4.964
   52    HA   CYS   7           HA       CYS   7  10.291   5.620   1.980
   53   1HB   CYS   7          HB2       CYS   7  12.837   5.538   3.635
   54   2HB   CYS   7          HB1       CYS   7  12.752   5.525   1.873
   55    H    CYS   8           HN       CYS   8  12.054   3.623   1.361
   56    HA   CYS   8           HA       CYS   8  11.344   1.281   3.083
   57   1HB   CYS   8          HB2       CYS   8  10.501   1.958   0.331
   58   2HB   CYS   8          HB1       CYS   8  11.090   0.307   0.532
   59    H    MET   9           HN       MET   9  12.800  -0.557   2.727
   60    HA   MET   9           HA       MET   9  15.367   0.224   1.384
   61   1HB   MET   9          HB2       MET   9  16.456  -1.099   3.158
   62   2HB   MET   9          HB1       MET   9  15.430   0.150   3.862
   63   1HG   MET   9          HG2       MET   9  13.940  -2.302   3.368
   64   2HG   MET   9          HG1       MET   9  15.323  -2.589   4.420
   65   1HE   MET   9          HE1       MET   9  12.525  -2.837   6.504
   66   2HE   MET   9          HE2       MET   9  13.976  -2.410   7.407
   67   3HE   MET   9          HE3       MET   9  14.111  -3.394   5.951
   68    H    PHE  10           HN       PHE  10  12.807  -1.546   0.671
   69    HA   PHE  10           HA       PHE  10  14.235  -3.426  -0.986
   70   1HB   PHE  10          HB2       PHE  10  13.915  -5.437   0.242
   71   2HB   PHE  10          HB1       PHE  10  14.444  -4.276   1.456
   72    HD1  PHE  10           HD1      PHE  10  12.143  -6.808   0.865
   73    HD2  PHE  10           HD2      PHE  10  12.325  -2.806   2.419
   74    HE1  PHE  10           HE1      PHE  10  10.061  -7.210   2.151
   75    HE2  PHE  10           HE2      PHE  10  10.246  -3.211   3.706
   76    HZ   PHE  10           HZ       PHE  10   9.113  -5.413   3.571
   77    H    PHE  11           HN       PHE  11  12.600  -4.998  -2.041
   78    HA   PHE  11           HA       PHE  11   9.910  -3.682  -2.143
   79   1HB   PHE  11          HB2       PHE  11  11.885  -4.352  -4.152
   80   2HB   PHE  11          HB1       PHE  11  10.377  -5.203  -4.487
   81    HD1  PHE  11           HD1      PHE  11  11.909  -2.601  -5.739
   82    HD2  PHE  11           HD2      PHE  11   8.386  -3.286  -3.379
   83    HE1  PHE  11           HE1      PHE  11  10.916  -0.504  -6.608
   84    HE2  PHE  11           HE2      PHE  11   7.399  -1.189  -4.241
   85    HZ   PHE  11           HZ       PHE  11   8.661   0.206  -5.859
   86    H    VAL  12           HN       VAL  12   8.100  -5.052  -2.110
   87    HA   VAL  12           HA       VAL  12   8.152  -7.441  -0.662
   88    HB   VAL  12           HB       VAL  12   5.913  -7.821  -1.860
   89   1HG1  VAL  12          HG1       VAL  12   5.110  -5.430  -1.014
   90   2HG1  VAL  12          HG1       VAL  12   6.741  -5.385  -0.346
   91   3HG1  VAL  12          HG1       VAL  12   5.633  -6.675   0.119
   92   1HG2  VAL  12          HG2       VAL  12   5.175  -6.320  -3.500
   93   2HG2  VAL  12          HG2       VAL  12   6.875  -6.506  -3.931
   94   3HG2  VAL  12          HG2       VAL  12   6.344  -5.083  -3.035
   95    H    SER  13           HN       SER  13   8.200  -9.658  -1.245
   96    HA   SER  13           HA       SER  13   9.770 -10.382  -3.564
   97   1HB   SER  13          HB2       SER  13   9.098 -12.702  -2.758
   98   2HB   SER  13          HB1       SER  13   9.849 -11.685  -1.532
   99    HG   SER  13           HG       SER  13   8.061 -11.781  -0.447
  100    H    LYS  14           HN       LYS  14   6.353 -10.050  -2.908
  101    HA   LYS  14           HA       LYS  14   5.696 -10.372  -5.732
  102   1HB   LYS  14          HB2       LYS  14   4.220 -12.355  -5.311
  103   2HB   LYS  14          HB1       LYS  14   5.929 -12.708  -5.042
  104   1HG   LYS  14          HG2       LYS  14   5.490 -12.105  -2.578
  105   2HG   LYS  14          HG1       LYS  14   3.776 -12.224  -2.978
  106   1HD   LYS  14          HD2       LYS  14   3.892 -14.511  -3.398
  107   2HD   LYS  14          HD1       LYS  14   5.616 -14.459  -3.769
  108   1HE   LYS  14          HE2       LYS  14   5.823 -15.319  -1.645
  109   2HE   LYS  14          HE1       LYS  14   5.620 -13.626  -1.154
  110   1HZ   LYS  14          HZ1       LYS  14   3.288 -15.354  -1.719
  111   2HZ   LYS  14          HZ2       LYS  14   3.344 -13.906  -0.831
  112   3HZ   LYS  14          HZ3       LYS  14   4.004 -15.331  -0.180
  113    H    ARG  15           HN       ARG  15   3.230 -10.200  -6.002
  114    HA   ARG  15           HA       ARG  15   2.206  -7.903  -4.729
  115   1HB   ARG  15          HB2       ARG  15   0.068  -8.675  -5.731
  116   2HB   ARG  15          HB1       ARG  15   1.421  -8.854  -6.851
  117   1HG   ARG  15          HG2       ARG  15   0.688 -10.991  -7.065
  118   2HG   ARG  15          HG1       ARG  15   1.488 -11.247  -5.513
  119   1HD   ARG  15          HD2       ARG  15  -0.868 -10.255  -4.630
  120   2HD   ARG  15          HD1       ARG  15  -1.413 -11.047  -6.122
  121    HE   ARG  15           HE       ARG  15  -0.026 -12.412  -3.864
  122   1HH1  ARG  15          HH1       ARG  15   0.238 -13.151  -6.965
  123   2HH1  ARG  15          HH1       ARG  15  -0.779 -14.555  -6.980
  124   1HH2  ARG  15          HH2       ARG  15  -2.139 -13.930  -3.853
  125   2HH2  ARG  15          HH2       ARG  15  -2.124 -14.995  -5.218
  126    H    ILE  16           HN       ILE  16  -0.234  -8.301  -3.688
  127    HA   ILE  16           HA       ILE  16   0.107 -10.197  -1.387
  128    HB   ILE  16           HB       ILE  16  -1.316  -7.643  -0.868
  129   1HG1  ILE  16          HG1       ILE  16   1.675  -7.662  -1.406
  130   2HG1  ILE  16          HG1       ILE  16   0.462  -6.705  -2.249
  131   1HG2  ILE  16          HG2       ILE  16   0.076  -9.702   0.542
  132   2HG2  ILE  16          HG2       ILE  16  -0.885  -8.380   1.201
  133   3HG2  ILE  16          HG2       ILE  16   0.842  -8.160   0.916
  134   1HD1  ILE  16          HD1       ILE  16   0.018  -5.392  -0.278
  135   2HD1  ILE  16          HD1       ILE  16   1.768  -5.437  -0.487
  136   3HD1  ILE  16          HD1       ILE  16   1.000  -6.458   0.726
  137    HA   PRO  17           HA       PRO  17  -4.117 -11.062  -2.354
  138   1HB   PRO  17          HB2       PRO  17  -4.935 -12.216  -0.023
  139   2HB   PRO  17          HB1       PRO  17  -3.842 -13.018  -1.167
  140   1HG   PRO  17          HG2       PRO  17  -3.272 -11.830   1.446
  141   2HG   PRO  17          HG1       PRO  17  -2.381 -13.059   0.542
  142   1HD   PRO  17          HD2       PRO  17  -1.765 -10.296   0.794
  143   2HD   PRO  17          HD1       PRO  17  -0.921 -11.508  -0.191
  144    H    GLU  18           HN       GLU  18  -5.528  -9.339  -2.517
  145    HA   GLU  18           HA       GLU  18  -5.845  -7.134  -0.870
  146   1HB   GLU  18          HB2       GLU  18  -6.857  -7.469  -3.089
  147   2HB   GLU  18          HB1       GLU  18  -7.966  -8.661  -2.412
  148   1HG   GLU  18          HG2       GLU  18  -9.375  -7.035  -1.758
  149   2HG   GLU  18          HG1       GLU  18  -8.088  -6.253  -0.841
  150    H    ASN  19           HN       ASN  19  -7.089 -10.373  -0.291
  151    HA   ASN  19           HA       ASN  19  -9.062  -9.666   1.700
  152   1HB   ASN  19          HB2       ASN  19  -8.278 -11.889   0.278
  153   2HB   ASN  19          HB1       ASN  19  -7.715 -12.279   1.902
  154   1HD2  ASN  19          HD2       ASN  19 -10.450 -12.356  -0.108
  155   2HD2  ASN  19          HD2       ASN  19 -11.633 -12.552   1.095
  156    H    ARG  20           HN       ARG  20  -5.637  -9.622   1.785
  157    HA   ARG  20           HA       ARG  20  -5.601  -9.913   4.760
  158   1HB   ARG  20          HB2       ARG  20  -3.566 -10.235   2.546
  159   2HB   ARG  20          HB1       ARG  20  -3.120 -10.244   4.248
  160   1HG   ARG  20          HG2       ARG  20  -5.084 -12.024   4.403
  161   2HG   ARG  20          HG1       ARG  20  -4.700 -12.247   2.696
  162   1HD   ARG  20          HD2       ARG  20  -3.349 -13.813   3.998
  163   2HD   ARG  20          HD1       ARG  20  -2.271 -12.545   3.378
  164    HE   ARG  20           HE       ARG  20  -3.367 -11.737   5.908
  165   1HH1  ARG  20          HH1       ARG  20  -0.458 -11.597   4.989
  166   2HH1  ARG  20          HH1       ARG  20   0.300 -12.663   6.124
  167   1HH2  ARG  20          HH2       ARG  20  -2.675 -14.114   7.154
  168   2HH2  ARG  20          HH2       ARG  20  -0.954 -14.088   7.348
  169    H    VAL  21           HN       VAL  21  -4.717  -7.829   2.058
  170    HA   VAL  21           HA       VAL  21  -3.191  -5.902   3.574
  171    HB   VAL  21           HB       VAL  21  -4.767  -5.549   1.007
  172   1HG1  VAL  21          HG1       VAL  21  -2.310  -4.207   0.923
  173   2HG1  VAL  21          HG1       VAL  21  -2.934  -3.897   2.541
  174   3HG1  VAL  21          HG1       VAL  21  -3.899  -3.472   1.128
  175   1HG2  VAL  21          HG2       VAL  21  -2.109  -6.045   0.358
  176   2HG2  VAL  21          HG2       VAL  21  -3.436  -7.195   0.197
  177   3HG2  VAL  21          HG2       VAL  21  -2.433  -7.201   1.647
  178    H    VAL  22           HN       VAL  22  -3.882  -3.753   4.223
  179    HA   VAL  22           HA       VAL  22  -6.830  -3.463   4.589
  180    HB   VAL  22           HB       VAL  22  -6.159  -2.344   6.749
  181   1HG1  VAL  22          HG1       VAL  22  -6.958  -4.652   6.710
  182   2HG1  VAL  22          HG1       VAL  22  -5.685  -4.463   7.918
  183   3HG1  VAL  22          HG1       VAL  22  -5.323  -5.219   6.366
  184   1HG2  VAL  22          HG2       VAL  22  -3.462  -3.537   6.065
  185   2HG2  VAL  22          HG2       VAL  22  -3.896  -2.832   7.617
  186   3HG2  VAL  22          HG2       VAL  22  -3.831  -1.817   6.179
  187    H    SER  23           HN       SER  23  -3.707  -1.807   4.275
  188    HA   SER  23           HA       SER  23  -4.806   0.324   2.652
  189   1HB   SER  23          HB2       SER  23  -5.813   0.880   4.811
  190   2HB   SER  23          HB1       SER  23  -4.238   0.797   5.592
  191    HG   SER  23           HG       SER  23  -5.348   2.765   3.987
  192    H    TYR  24           HN       TYR  24  -3.081   1.581   1.782
  193    HA   TYR  24           HA       TYR  24  -0.398   0.536   2.388
  194   1HB   TYR  24          HB2       TYR  24   0.145   1.458   0.240
  195   2HB   TYR  24          HB1       TYR  24  -1.434   0.704   0.100
  196    HD1  TYR  24           HD1      TYR  24  -3.466   2.049  -0.138
  197    HD2  TYR  24           HD2      TYR  24   0.392   3.899   0.226
  198    HE1  TYR  24           HE1      TYR  24  -4.432   4.207  -0.889
  199    HE2  TYR  24           HE2      TYR  24  -0.573   6.057  -0.525
  200    HH   TYR  24           HH       TYR  24  -3.654   6.813  -0.468
  201    H    GLN  25           HN       GLN  25   1.228   2.468   1.695
  202    HA   GLN  25           HA       GLN  25   0.705   4.963   3.198
  203   1HB   GLN  25          HB2       GLN  25   2.343   2.649   4.048
  204   2HB   GLN  25          HB1       GLN  25   3.192   4.189   4.126
  205   1HG   GLN  25          HG2       GLN  25   2.158   4.503   6.112
  206   2HG   GLN  25          HG1       GLN  25   0.687   4.777   5.180
  207   1HE2  GLN  25          HE2       GLN  25   1.057   3.402   7.872
  208   2HE2  GLN  25          HE2       GLN  25   0.357   1.869   7.672
  209    H    LEU  26           HN       LEU  26   1.004   6.049   1.181
  210    HA   LEU  26           HA       LEU  26   3.062   5.385  -0.690
  211   1HB   LEU  26          HB2       LEU  26   0.997   7.416  -0.258
  212   2HB   LEU  26          HB1       LEU  26   2.407   8.044  -1.110
  213    HG   LEU  26           HG       LEU  26   0.783   5.604  -1.893
  214   1HD1  LEU  26          HD1       LEU  26  -0.482   7.141  -2.953
  215   2HD1  LEU  26          HD1       LEU  26   0.912   7.451  -3.991
  216   3HD1  LEU  26          HD1       LEU  26   0.646   8.437  -2.553
  217   1HD2  LEU  26          HD2       LEU  26   2.313   5.876  -3.993
  218   2HD2  LEU  26          HD2       LEU  26   2.981   5.084  -2.568
  219   3HD2  LEU  26          HD2       LEU  26   3.374   6.769  -2.905
  220    H    SER  27           HN       SER  27   5.134   6.048  -0.883
  221    HA   SER  27           HA       SER  27   6.150   8.217   0.889
  222   1HB   SER  27          HB2       SER  27   6.920   5.330   0.711
  223   2HB   SER  27          HB1       SER  27   8.192   6.507   1.030
  224    HG   SER  27           HG       SER  27   5.927   5.829   2.551
  225    H    SER  28           HN       SER  28   5.524   8.201  -1.962
  226    HA   SER  28           HA       SER  28   7.988   7.849  -3.481
  227   1HB   SER  28          HB2       SER  28   5.302   7.990  -4.006
  228   2HB   SER  28          HB1       SER  28   5.840   9.583  -4.531
  229    HG   SER  28           HG       SER  28   6.148   8.266  -6.256
  230    H    ARG  29           HN       ARG  29   8.923   9.405  -1.533
  231    HA   ARG  29           HA       ARG  29   8.772  12.236  -2.493
  232   1HB   ARG  29          HB2       ARG  29   8.723  10.928   0.052
  233   2HB   ARG  29          HB1       ARG  29  10.182  11.917  -0.022
  234   1HG   ARG  29          HG2       ARG  29   8.635  13.488   0.720
  235   2HG   ARG  29          HG1       ARG  29   8.530  13.722  -1.025
  236   1HD   ARG  29          HD2       ARG  29   6.458  12.671  -1.182
  237   2HD   ARG  29          HD1       ARG  29   6.740  11.682   0.265
  238    HE   ARG  29           HE       ARG  29   6.088  13.532   1.621
  239   1HH1  ARG  29          HH1       ARG  29   5.054  13.994  -1.486
  240   2HH1  ARG  29          HH1       ARG  29   4.967  15.722  -1.413
  241   1HH2  ARG  29          HH2       ARG  29   6.599  15.940   1.639
  242   2HH2  ARG  29          HH2       ARG  29   5.842  16.825   0.356
  243    H    SER  30           HN       SER  30  10.901  13.424  -2.421
  244    HA   SER  30           HA       SER  30  12.978  11.895  -3.780
  245   1HB   SER  30          HB2       SER  30  12.832  14.729  -2.709
  246   2HB   SER  30          HB1       SER  30  14.087  14.128  -3.789
  247    HG   SER  30           HG       SER  30  11.601  14.984  -4.361
  248    H    THR  31           HN       THR  31  12.221  12.087  -0.530
  249    HA   THR  31           HA       THR  31  15.022  12.220   0.435
  250    HB   THR  31           HB       THR  31  13.666  11.911   2.652
  251    HG1  THR  31           HG1      THR  31  11.654  11.512   2.273
  252   1HG2  THR  31          HG2       THR  31  14.081  14.180   0.882
  253   2HG2  THR  31          HG2       THR  31  14.217  14.095   2.638
  254   3HG2  THR  31          HG2       THR  31  12.650  14.400   1.889
  255    H    CYS  32           HN       CYS  32  13.254   9.837  -0.971
  256    HA   CYS  32           HA       CYS  32  14.205   7.714   0.921
  257   1HB   CYS  32          HB2       CYS  32  12.058   7.700  -1.228
  258   2HB   CYS  32          HB1       CYS  32  12.428   6.357  -0.146
  259    H    LEU  33           HN       LEU  33  15.182   5.797  -0.086
  260    HA   LEU  33           HA       LEU  33  16.903   6.462  -2.355
  261   1HB   LEU  33          HB2       LEU  33  16.811   4.653  -0.150
  262   2HB   LEU  33          HB1       LEU  33  16.960   3.690  -1.622
  263    HG   LEU  33           HG       LEU  33  19.184   4.314  -0.765
  264   1HD1  LEU  33          HD1       LEU  33  18.932   6.090  -3.134
  265   2HD1  LEU  33          HD1       LEU  33  18.356   4.437  -3.338
  266   3HD1  LEU  33          HD1       LEU  33  20.026   4.735  -2.855
  267   1HD2  LEU  33          HD2       LEU  33  19.185   7.104  -1.418
  268   2HD2  LEU  33          HD2       LEU  33  19.513   6.350   0.142
  269   3HD2  LEU  33          HD2       LEU  33  17.866   6.802  -0.289
  270    H    LYS  34           HN       LYS  34  14.044   4.461  -1.794
  271    HA   LYS  34           HA       LYS  34  13.962   3.884  -4.738
  272   1HB   LYS  34          HB2       LYS  34  13.674   2.205  -2.301
  273   2HB   LYS  34          HB1       LYS  34  12.555   1.853  -3.618
  274   1HG   LYS  34          HG2       LYS  34  15.019   2.196  -4.888
  275   2HG   LYS  34          HG1       LYS  34  15.405   1.286  -3.428
  276   1HD   LYS  34          HD2       LYS  34  13.050   0.114  -4.385
  277   2HD   LYS  34          HD1       LYS  34  14.024   0.402  -5.828
  278   1HE   LYS  34          HE2       LYS  34  14.748  -1.733  -5.070
  279   2HE   LYS  34          HE1       LYS  34  15.979  -0.627  -4.427
  280   1HZ   LYS  34          HZ1       LYS  34  14.831  -0.509  -2.356
  281   2HZ   LYS  34          HZ2       LYS  34  15.028  -2.154  -2.732
  282   3HZ   LYS  34          HZ3       LYS  34  13.520  -1.404  -2.956
  283    H    ALA  35           HN       ALA  35  12.133   4.665  -5.712
  284    HA   ALA  35           HA       ALA  35  10.013   5.874  -4.061
  285   1HB   ALA  35          HB1       ALA  35   9.528   5.853  -6.908
  286   2HB   ALA  35          HB2       ALA  35  11.218   6.253  -6.598
  287   3HB   ALA  35          HB3       ALA  35   9.935   7.221  -5.872
  288    H    GLY  36           HN       GLY  36   8.327   4.620  -3.387
  289   1HA   GLY  36          HA2       GLY  36   6.781   3.040  -5.245
  290   2HA   GLY  36          HA1       GLY  36   7.718   2.001  -4.169
  291    H    VAL  37           HN       VAL  37   5.254   1.482  -3.608
  292    HA   VAL  37           HA       VAL  37   4.294   3.463  -1.566
  293    HB   VAL  37           HB       VAL  37   2.894   1.135  -2.908
  294   1HG1  VAL  37          HG1       VAL  37   1.728   1.676  -0.914
  295   2HG1  VAL  37          HG1       VAL  37   0.868   2.561  -2.175
  296   3HG1  VAL  37          HG1       VAL  37   2.008   3.406  -1.125
  297   1HG2  VAL  37          HG2       VAL  37   1.845   3.614  -3.786
  298   2HG2  VAL  37          HG2       VAL  37   2.744   2.436  -4.742
  299   3HG2  VAL  37          HG2       VAL  37   3.598   3.745  -3.924
  300    H    ILE  38           HN       ILE  38   3.164   2.292   0.354
  301    HA   ILE  38           HA       ILE  38   4.677  -0.197   1.082
  302    HB   ILE  38           HB       ILE  38   4.111   2.346   2.624
  303   1HG1  ILE  38          HG1       ILE  38   6.672   1.831   3.082
  304   2HG1  ILE  38          HG1       ILE  38   6.511   0.859   1.618
  305   1HG2  ILE  38          HG2       ILE  38   3.571   0.652   4.217
  306   2HG2  ILE  38          HG2       ILE  38   5.249   1.083   4.551
  307   3HG2  ILE  38          HG2       ILE  38   4.879  -0.393   3.658
  308   1HD1  ILE  38          HD1       ILE  38   6.877   2.785   0.487
  309   2HD1  ILE  38          HD1       ILE  38   6.580   3.773   1.917
  310   3HD1  ILE  38          HD1       ILE  38   5.228   3.217   0.936
  311    H    PHE  39           HN       PHE  39   3.235  -1.862   1.463
  312    HA   PHE  39           HA       PHE  39   0.442  -1.102   2.225
  313   1HB   PHE  39          HB2       PHE  39   1.675  -3.325   0.624
  314   2HB   PHE  39          HB1       PHE  39   0.048  -3.493   1.287
  315    HD1  PHE  39           HD1      PHE  39   2.183  -1.160  -0.701
  316    HD2  PHE  39           HD2      PHE  39  -1.787  -2.529   0.178
  317    HE1  PHE  39           HE1      PHE  39   1.281   0.272  -2.505
  318    HE2  PHE  39           HE2      PHE  39  -2.678  -1.097  -1.631
  319    HZ   PHE  39           HZ       PHE  39  -1.149   0.307  -2.974
  320    H    THR  40           HN       THR  40  -0.497  -2.009   4.018
  321    HA   THR  40           HA       THR  40   1.249  -3.708   5.742
  322    HB   THR  40           HB       THR  40  -0.992  -1.740   6.292
  323    HG1  THR  40           HG1      THR  40   0.617  -0.448   6.551
  324   1HG2  THR  40          HG2       THR  40  -0.100  -3.990   7.866
  325   2HG2  THR  40          HG2       THR  40  -1.383  -2.833   8.217
  326   3HG2  THR  40          HG2       THR  40   0.277  -2.482   8.700
  327    H    THR  41           HN       THR  41   0.299  -5.580   6.697
  328    HA   THR  41           HA       THR  41  -2.137  -6.567   5.326
  329    HB   THR  41           HB       THR  41  -0.398  -8.148   7.191
  330    HG1  THR  41           HG1      THR  41   1.110  -7.173   5.926
  331   1HG2  THR  41          HG2       THR  41  -1.171  -9.970   6.002
  332   2HG2  THR  41          HG2       THR  41  -1.359  -9.049   4.510
  333   3HG2  THR  41          HG2       THR  41  -2.544  -8.881   5.805
  334    H    LYS  42           HN       LYS  42  -3.821  -7.618   6.637
  335    HA   LYS  42           HA       LYS  42  -4.567  -6.110   8.977
  336   1HB   LYS  42          HB2       LYS  42  -6.445  -7.700   9.001
  337   2HB   LYS  42          HB1       LYS  42  -6.108  -7.193   7.347
  338   1HG   LYS  42          HG2       LYS  42  -4.798  -9.249   6.973
  339   2HG   LYS  42          HG1       LYS  42  -5.119  -9.757   8.632
  340   1HD   LYS  42          HD2       LYS  42  -7.652  -9.255   7.770
  341   2HD   LYS  42          HD1       LYS  42  -6.900  -9.797   6.269
  342   1HE   LYS  42          HE2       LYS  42  -7.194 -11.922   7.012
  343   2HE   LYS  42          HE1       LYS  42  -5.967 -11.578   8.248
  344   1HZ   LYS  42          HZ1       LYS  42  -7.931 -12.165   9.406
  345   2HZ   LYS  42          HZ2       LYS  42  -8.898 -11.158   8.439
  346   3HZ   LYS  42          HZ3       LYS  42  -7.794 -10.479   9.539
  347    H    LYS  43           HN       LYS  43  -2.612  -8.947   8.522
  348    HA   LYS  43           HA       LYS  43  -2.984 -10.086  11.173
  349   1HB   LYS  43          HB2       LYS  43  -2.171 -11.168   8.983
  350   2HB   LYS  43          HB1       LYS  43  -0.616 -10.407   9.320
  351   1HG   LYS  43          HG2       LYS  43  -0.846 -11.503  11.670
  352   2HG   LYS  43          HG1       LYS  43  -2.052 -12.532  10.899
  353   1HD   LYS  43          HD2       LYS  43  -0.266 -12.961   9.088
  354   2HD   LYS  43          HD1       LYS  43   0.882 -12.275  10.240
  355   1HE   LYS  43          HE2       LYS  43  -0.965 -14.616  10.836
  356   2HE   LYS  43          HE1       LYS  43   0.763 -14.754  10.454
  357   1HZ   LYS  43          HZ1       LYS  43   1.095 -13.051  12.282
  358   2HZ   LYS  43          HZ2       LYS  43   0.673 -14.620  12.780
  359   3HZ   LYS  43          HZ3       LYS  43  -0.497 -13.389  12.760
  360    H    GLY  44           HN       GLY  44  -1.025  -7.527   9.842
  361   1HA   GLY  44          HA2       GLY  44  -0.150  -5.917  11.564
  362   2HA   GLY  44          HA1       GLY  44   0.419  -7.334  12.445
  363    H    GLN  45           HN       GLN  45   0.631  -7.085   8.946
  364    HA   GLN  45           HA       GLN  45   3.612  -7.092   9.211
  365   1HB   GLN  45          HB2       GLN  45   1.576  -8.336   7.434
  366   2HB   GLN  45          HB1       GLN  45   3.090  -7.860   6.664
  367   1HG   GLN  45          HG2       GLN  45   4.380  -9.197   8.200
  368   2HG   GLN  45          HG1       GLN  45   2.960  -9.522   9.193
  369   1HE2  GLN  45          HE2       GLN  45   3.775 -11.869   8.614
  370   2HE2  GLN  45          HE2       GLN  45   3.119 -12.556   7.207
  371    H    GLN  46           HN       GLN  46   4.720  -5.986   7.274
  372    HA   GLN  46           HA       GLN  46   3.198  -3.801   6.000
  373   1HB   GLN  46          HB2       GLN  46   4.726  -3.532   8.464
  374   2HB   GLN  46          HB1       GLN  46   5.361  -2.474   7.202
  375   1HG   GLN  46          HG2       GLN  46   3.277  -1.382   6.914
  376   2HG   GLN  46          HG1       GLN  46   2.403  -2.642   7.784
  377   1HE2  GLN  46          HE2       GLN  46   3.348  -2.923  10.189
  378   2HE2  GLN  46          HE2       GLN  46   3.604  -1.468  11.024
  379    H    SER  47           HN       SER  47   3.937  -4.493   3.970
  380    HA   SER  47           HA       SER  47   6.908  -4.598   3.572
  381   1HB   SER  47          HB2       SER  47   5.164  -6.569   3.169
  382   2HB   SER  47          HB1       SER  47   4.908  -5.725   1.646
  383    HG   SER  47           HG       SER  47   7.300  -5.770   1.508
  384    H    CYS  48           HN       CYS  48   7.645  -3.743   1.439
  385    HA   CYS  48           HA       CYS  48   6.258  -1.231   0.766
  386   1HB   CYS  48          HB2       CYS  48   8.778  -2.504  -0.353
  387   2HB   CYS  48          HB1       CYS  48   8.307  -0.812  -0.504
  388    H    GLY  49           HN       GLY  49   4.803  -1.101  -0.929
  389   1HA   GLY  49          HA2       GLY  49   4.670  -3.386  -2.818
  390   2HA   GLY  49          HA1       GLY  49   3.416  -2.171  -2.601
  391    H    ASP  50           HN       ASP  50   5.000  -3.126  -4.998
  392    HA   ASP  50           HA       ASP  50   6.442  -0.679  -5.823
  393   1HB   ASP  50          HB2       ASP  50   7.388  -2.861  -6.328
  394   2HB   ASP  50          HB1       ASP  50   5.890  -3.376  -7.101
  395    HA   PRO  51           HA       PRO  51   2.682   0.917  -7.625
  396   1HB   PRO  51          HB2       PRO  51   3.838   2.961  -9.048
  397   2HB   PRO  51          HB1       PRO  51   3.536   3.044  -7.301
  398   1HG   PRO  51          HG2       PRO  51   6.060   2.384  -8.753
  399   2HG   PRO  51          HG1       PRO  51   5.816   3.414  -7.333
  400   1HD   PRO  51          HD2       PRO  51   6.746   0.902  -7.112
  401   2HD   PRO  51          HD1       PRO  51   5.679   1.618  -5.883
  402    H    LYS  52           HN       LYS  52   5.517  -0.181  -9.327
  403    HA   LYS  52           HA       LYS  52   4.534  -0.002 -12.024
  404   1HB   LYS  52          HB2       LYS  52   6.468  -1.926 -10.687
  405   2HB   LYS  52          HB1       LYS  52   6.348  -1.647 -12.423
  406   1HG   LYS  52          HG2       LYS  52   7.134   0.581 -12.235
  407   2HG   LYS  52          HG1       LYS  52   6.860   0.616 -10.492
  408   1HD   LYS  52          HD2       LYS  52   8.764  -0.617 -10.026
  409   2HD   LYS  52          HD1       LYS  52   8.742  -1.436 -11.588
  410   1HE   LYS  52          HE2       LYS  52   9.185   1.532 -11.552
  411   2HE   LYS  52          HE1       LYS  52  10.534   0.461 -11.122
  412   1HZ   LYS  52          HZ1       LYS  52   8.854   0.250 -13.567
  413   2HZ   LYS  52          HZ2       LYS  52  10.107  -0.816 -13.139
  414   3HZ   LYS  52          HZ3       LYS  52  10.456   0.803 -13.514
  415    H    GLN  53           HN       GLN  53   4.102  -2.318  -9.407
  416    HA   GLN  53           HA       GLN  53   2.907  -4.416 -11.014
  417   1HB   GLN  53          HB2       GLN  53   2.913  -3.708  -8.065
  418   2HB   GLN  53          HB1       GLN  53   2.194  -5.190  -8.698
  419   1HG   GLN  53          HG2       GLN  53   4.934  -4.644  -9.658
  420   2HG   GLN  53          HG1       GLN  53   4.808  -4.968  -7.928
  421   1HE2  GLN  53          HE2       GLN  53   3.737  -6.323 -11.093
  422   2HE2  GLN  53          HE2       GLN  53   3.766  -7.940 -10.576
  423    H    GLU  54           HN       GLU  54   0.562  -5.025 -10.779
  424    HA   GLU  54           HA       GLU  54  -1.124  -2.612 -11.049
  425   1HB   GLU  54          HB2       GLU  54  -1.326  -5.553 -11.658
  426   2HB   GLU  54          HB1       GLU  54  -2.778  -4.552 -11.669
  427   1HG   GLU  54          HG2       GLU  54  -2.051  -3.270 -13.469
  428   2HG   GLU  54          HG1       GLU  54  -0.348  -3.597 -13.144
  429    H    TRP  55           HN       TRP  55  -0.441  -4.941  -8.546
  430    HA   TRP  55           HA       TRP  55  -3.105  -4.748  -7.338
  431   1HB   TRP  55          HB2       TRP  55  -2.111  -6.121  -5.603
  432   2HB   TRP  55          HB1       TRP  55  -1.612  -6.735  -7.172
  433    HD1  TRP  55           HD1      TRP  55   0.922  -6.577  -7.811
  434    HE1  TRP  55           HE1      TRP  55   3.041  -6.080  -6.423
  435    HE3  TRP  55           HE3      TRP  55  -1.195  -4.628  -3.586
  436    HZ2  TRP  55           HZ2      TRP  55   3.738  -5.031  -3.903
  437    HZ3  TRP  55           HZ3      TRP  55   0.234  -3.885  -1.702
  438    HH2  TRP  55           HH2      TRP  55   2.705  -4.081  -1.857
  439    H    VAL  56           HN       VAL  56   0.059  -3.143  -6.886
  440    HA   VAL  56           HA       VAL  56  -0.721  -1.713  -4.490
  441    HB   VAL  56           HB       VAL  56   1.210  -0.975  -6.731
  442   1HG1  VAL  56          HG1       VAL  56   1.205   1.009  -5.612
  443   2HG1  VAL  56          HG1       VAL  56   2.125   0.144  -4.383
  444   3HG1  VAL  56          HG1       VAL  56   0.382   0.312  -4.221
  445   1HG2  VAL  56          HG2       VAL  56   2.422  -2.706  -5.906
  446   2HG2  VAL  56          HG2       VAL  56   1.342  -2.897  -4.524
  447   3HG2  VAL  56          HG2       VAL  56   2.650  -1.715  -4.463
  448    H    GLN  57           HN       GLN  57  -0.852  -1.067  -7.971
  449    HA   GLN  57           HA       GLN  57  -2.134   1.516  -7.813
  450   1HB   GLN  57          HB2       GLN  57  -1.030  -0.255  -9.727
  451   2HB   GLN  57          HB1       GLN  57  -2.716  -0.042 -10.202
  452   1HG   GLN  57          HG2       GLN  57  -2.379   2.450  -9.976
  453   2HG   GLN  57          HG1       GLN  57  -0.659   2.136  -9.744
  454   1HE2  GLN  57          HE2       GLN  57   0.597   1.509 -11.595
  455   2HE2  GLN  57          HE2       GLN  57  -0.039   1.492 -13.168
  456    H    ARG  58           HN       ARG  58  -3.363  -1.766  -8.553
  457    HA   ARG  58           HA       ARG  58  -6.119  -1.196  -8.759
  458   1HB   ARG  58          HB2       ARG  58  -5.094  -3.350  -9.292
  459   2HB   ARG  58          HB1       ARG  58  -4.609  -3.568  -7.612
  460   1HG   ARG  58          HG2       ARG  58  -7.268  -3.194  -7.275
  461   2HG   ARG  58          HG1       ARG  58  -7.264  -3.936  -8.874
  462   1HD   ARG  58          HD2       ARG  58  -5.904  -5.080  -6.407
  463   2HD   ARG  58          HD1       ARG  58  -7.407  -5.683  -7.137
  464    HE   ARG  58           HE       ARG  58  -5.302  -5.476  -9.111
  465   1HH1  ARG  58          HH2       ARG  58  -7.398  -7.595  -7.675
  466   2HH1  ARG  58          HH2       ARG  58  -6.354  -8.976  -7.730
  467   1HH2  ARG  58          HH1       ARG  58  -3.559  -7.158  -8.681
  468   2HH2  ARG  58          HH1       ARG  58  -4.181  -8.729  -8.299
  469    H    TYR  59           HN       TYR  59  -4.226  -2.100  -5.862
  470    HA   TYR  59           HA       TYR  59  -6.326  -1.912  -3.955
  471   1HB   TYR  59          HB2       TYR  59  -3.330  -1.485  -3.875
  472   2HB   TYR  59          HB1       TYR  59  -4.322  -1.401  -2.426
  473    HD1  TYR  59           HD1      TYR  59  -2.561  -3.296  -1.867
  474    HD2  TYR  59           HD2      TYR  59  -5.792  -3.747  -4.669
  475    HE1  TYR  59           HE1      TYR  59  -2.439  -5.754  -1.602
  476    HE2  TYR  59           HE2      TYR  59  -5.664  -6.211  -4.396
  477    HH   TYR  59           HH       TYR  59  -4.361  -7.908  -3.621
  478    H    MET  60           HN       MET  60  -3.882   0.527  -4.890
  479    HA   MET  60           HA       MET  60  -4.778   2.689  -3.343
  480   1HB   MET  60          HB2       MET  60  -3.015   2.186  -5.490
  481   2HB   MET  60          HB1       MET  60  -4.009   3.560  -5.955
  482   1HG   MET  60          HG2       MET  60  -3.330   4.846  -4.102
  483   2HG   MET  60          HG1       MET  60  -2.789   3.425  -3.209
  484   1HE   MET  60          HE1       MET  60   0.213   2.291  -4.157
  485   2HE   MET  60          HE2       MET  60  -0.636   1.927  -5.658
  486   3HE   MET  60          HE3       MET  60  -1.499   1.849  -4.124
  487    H    LYS  61           HN       LYS  61  -6.089   1.351  -6.318
  488    HA   LYS  61           HA       LYS  61  -7.816   3.501  -7.080
  489   1HB   LYS  61          HB2       LYS  61  -7.073   1.064  -8.053
  490   2HB   LYS  61          HB1       LYS  61  -8.707   0.702  -7.494
  491   1HG   LYS  61          HG2       LYS  61  -8.815   3.221  -8.810
  492   2HG   LYS  61          HG1       LYS  61  -7.910   2.124  -9.856
  493   1HD   LYS  61          HD2       LYS  61  -9.737   0.439  -9.598
  494   2HD   LYS  61          HD1       LYS  61 -10.658   1.626  -8.673
  495   1HE   LYS  61          HE2       LYS  61 -11.509   2.255 -10.698
  496   2HE   LYS  61          HE1       LYS  61  -9.940   3.045 -10.952
  497   1HZ   LYS  61          HZ1       LYS  61 -10.634   0.240 -11.646
  498   2HZ   LYS  61          HZ2       LYS  61  -9.080   0.910 -11.777
  499   3HZ   LYS  61          HZ3       LYS  61 -10.348   1.502 -12.740
  500    H    ASN  62           HN       ASN  62  -8.545   0.524  -5.206
  501    HA   ASN  62           HA       ASN  62 -11.223   1.363  -4.498
  502   1HB   ASN  62          HB2       ASN  62 -10.248  -0.982  -4.584
  503   2HB   ASN  62          HB1       ASN  62  -9.386  -0.601  -3.093
  504   1HD2  ASN  62          HD2       ASN  62 -10.748  -2.376  -2.097
  505   2HD2  ASN  62          HD2       ASN  62 -12.330  -2.014  -1.606
  506    H    LEU  63           HN       LEU  63  -8.042   1.648  -2.974
  507    HA   LEU  63           HA       LEU  63  -8.881   2.551  -0.392
  508   1HB   LEU  63          HB2       LEU  63  -6.446   2.678  -2.129
  509   2HB   LEU  63          HB1       LEU  63  -6.477   3.677  -0.676
  510    HG   LEU  63           HG       LEU  63  -7.417   0.924  -0.251
  511   1HD1  LEU  63          HD1       LEU  63  -4.852   1.461  -1.608
  512   2HD1  LEU  63          HD1       LEU  63  -5.770  -0.040  -1.490
  513   3HD1  LEU  63          HD1       LEU  63  -4.718   0.457  -0.164
  514   1HD2  LEU  63          HD2       LEU  63  -6.606   1.347   1.835
  515   2HD2  LEU  63          HD2       LEU  63  -6.510   3.020   1.280
  516   3HD2  LEU  63          HD2       LEU  63  -5.084   1.984   1.211
  517    H    ASP  64           HN       ASP  64  -8.517   4.191  -3.483
  518    HA   ASP  64           HA       ASP  64  -8.556   6.901  -2.504
  519   1HB   ASP  64          HB2       ASP  64  -8.237   5.540  -4.905
  520   2HB   ASP  64          HB1       ASP  64  -9.764   6.397  -5.130
  521    H    ALA  65           HN       ALA  65 -11.032   4.492  -2.984
  522    HA   ALA  65           HA       ALA  65 -13.232   6.468  -2.941
  523   1HB   ALA  65          HB1       ALA  65 -14.573   4.320  -3.090
  524   2HB   ALA  65          HB2       ALA  65 -13.043   3.445  -3.072
  525   3HB   ALA  65          HB3       ALA  65 -13.412   4.547  -4.398
  526    H    LYS  66           HN       LYS  66 -11.293   5.791  -0.568
  527    HA   LYS  66           HA       LYS  66 -13.164   4.709   1.442
  528   1HB   LYS  66          HB2       LYS  66 -10.731   4.154   1.339
  529   2HB   LYS  66          HB1       LYS  66 -10.359   5.846   1.675
  530   1HG   LYS  66          HG2       LYS  66 -10.557   5.429   3.876
  531   2HG   LYS  66          HG1       LYS  66 -12.251   5.007   3.623
  532   1HD   LYS  66          HD2       LYS  66 -11.527   2.990   4.454
  533   2HD   LYS  66          HD1       LYS  66 -11.129   2.725   2.756
  534   1HE   LYS  66          HE2       LYS  66  -8.850   2.996   3.107
  535   2HE   LYS  66          HE1       LYS  66  -9.089   4.079   4.494
  536   1HZ   LYS  66          HZ1       LYS  66  -8.393   1.724   5.037
  537   2HZ   LYS  66          HZ2       LYS  66  -9.941   1.242   4.532
  538   3HZ   LYS  66          HZ3       LYS  66  -9.765   2.301   5.847
  539    H    GLN  67           HN       GLN  67 -12.072   7.819   0.294
  540    HA   GLN  67           HA       GLN  67 -12.401   9.492   2.525
  541   1HB   GLN  67          HB2       GLN  67 -12.142   9.682  -0.275
  542   2HB   GLN  67          HB1       GLN  67 -13.585  10.614   0.125
  543   1HG   GLN  67          HG2       GLN  67 -10.965  10.931   1.605
  544   2HG   GLN  67          HG1       GLN  67 -11.403  11.917   0.210
  545   1HE2  GLN  67          HE2       GLN  67 -11.622  11.775   3.590
  546   2HE2  GLN  67          HE2       GLN  67 -12.881  12.892   3.805
  547    H    LYS  68           HN       LYS  68 -14.871   7.963   0.506
  548    HA   LYS  68           HA       LYS  68 -17.057   9.400   1.895
  549   1HB   LYS  68          HB2       LYS  68 -16.637   7.734  -0.521
  550   2HB   LYS  68          HB1       LYS  68 -18.209   7.540   0.258
  551   1HG   LYS  68          HG2       LYS  68 -17.428  10.342   0.112
  552   2HG   LYS  68          HG1       LYS  68 -17.478   9.595  -1.487
  553   1HD   LYS  68          HD2       LYS  68 -19.754   8.597  -0.666
  554   2HD   LYS  68          HD1       LYS  68 -19.694   9.901   0.521
  555   1HE   LYS  68          HE2       LYS  68 -20.905  10.740  -1.407
  556   2HE   LYS  68          HE1       LYS  68 -19.302  11.500  -1.434
  557   1HZ   LYS  68          HZ1       LYS  68 -19.751   8.899  -2.752
  558   2HZ   LYS  68          HZ2       LYS  68 -18.542  10.053  -3.053
  559   3HZ   LYS  68          HZ3       LYS  68 -20.138  10.338  -3.560
  560    H    LYS  69           HN       LYS  69 -17.475   8.587   3.934
  561    HA   LYS  69           HA       LYS  69 -17.626   5.603   4.228
  562   1HB   LYS  69          HB2       LYS  69 -16.930   6.076   6.603
  563   2HB   LYS  69          HB1       LYS  69 -15.715   6.537   5.409
  564   1HG   LYS  69          HG2       LYS  69 -15.877   8.731   5.941
  565   2HG   LYS  69          HG1       LYS  69 -17.640   8.679   5.954
  566   1HD   LYS  69          HD2       LYS  69 -17.438   8.926   8.200
  567   2HD   LYS  69          HD1       LYS  69 -17.009   7.216   8.197
  568   1HE   LYS  69          HE2       LYS  69 -14.705   7.658   8.350
  569   2HE   LYS  69          HE1       LYS  69 -14.887   9.309   7.724
  570   1HZ   LYS  69          HZ1       LYS  69 -14.636   9.011  10.246
  571   2HZ   LYS  69          HZ2       LYS  69 -16.244   8.465  10.208
  572   3HZ   LYS  69          HZ3       LYS  69 -15.865  10.035   9.685
  573    H    ALA  70           HN       ALA  70 -19.176   4.935   5.991
  574    HA   ALA  70           HA       ALA  70 -21.440   6.881   6.279
  575   1HB   ALA  70          HB1       ALA  70 -21.687   4.988   4.580
  576   2HB   ALA  70          HB2       ALA  70 -22.947   5.069   5.813
  577   3HB   ALA  70          HB3       ALA  70 -21.653   3.879   5.951
  578    H    SER  71           HN       SER  71 -19.770   4.053   7.629
  579    HA   SER  71           HA       SER  71 -20.307   5.005  10.364
  580   1HB   SER  71          HB2       SER  71 -21.527   2.924  10.961
  581   2HB   SER  71          HB1       SER  71 -22.382   3.842   9.726
  582    HG   SER  71           HG       SER  71 -21.236   1.363   9.609
  583    HA   PRO  72           HA       PRO  72 -16.543   2.835  11.042
  584   1HB   PRO  72          HB2       PRO  72 -16.740   2.183  13.683
  585   2HB   PRO  72          HB1       PRO  72 -16.438   3.836  13.113
  586   1HG   PRO  72          HG2       PRO  72 -18.961   2.592  14.055
  587   2HG   PRO  72          HG1       PRO  72 -18.342   4.228  14.316
  588   1HD   PRO  72          HD2       PRO  72 -20.282   3.609  12.493
  589   2HD   PRO  72          HD1       PRO  72 -19.186   4.999  12.340
  590    H    ARG  73           HN       ARG  73 -17.357   1.000   9.629
  591    HA   ARG  73           HA       ARG  73 -18.048  -1.421  11.266
  592   1HB   ARG  73          HB2       ARG  73 -19.778  -0.606   9.670
  593   2HB   ARG  73          HB1       ARG  73 -18.618  -0.782   8.352
  594   1HG   ARG  73          HG2       ARG  73 -18.471  -3.173   8.717
  595   2HG   ARG  73          HG1       ARG  73 -19.462  -3.053  10.171
  596   1HD   ARG  73          HD2       ARG  73 -20.631  -1.963   7.645
  597   2HD   ARG  73          HD1       ARG  73 -20.548  -3.729   7.817
  598    HE   ARG  73           HE       ARG  73 -21.487  -2.781  10.282
  599   1HH1  ARG  73          HH2       ARG  73 -23.113  -4.661   8.697
  600   2HH1  ARG  73          HH2       ARG  73 -24.502  -3.718   8.277
  601   1HH2  ARG  73          HH1       ARG  73 -22.986  -0.682   8.997
  602   2HH2  ARG  73          HH1       ARG  73 -24.430  -1.464   8.445
  Start of MODEL    6
    1   1H    VAL   1          HT1       VAL   1  -5.267  14.538   2.636
    2   2H    VAL   1          HT2       VAL   1  -3.840  14.939   1.805
    3   3H    VAL   1          HT3       VAL   1  -3.904  15.064   3.496
    4    HA   VAL   1           HA       VAL   1  -3.664  12.828   3.836
    5    HB   VAL   1           HB       VAL   1  -4.458  11.220   2.053
    6   1HG1  VAL   1          HG1       VAL   1  -6.939  12.480   2.255
    7   2HG1  VAL   1          HG1       VAL   1  -6.046  13.063   3.660
    8   3HG1  VAL   1          HG1       VAL   1  -6.259  11.329   3.407
    9   1HG2  VAL   1          HG2       VAL   1  -6.110  13.055   0.607
   10   2HG2  VAL   1          HG2       VAL   1  -4.850  11.997  -0.023
   11   3HG2  VAL   1          HG2       VAL   1  -4.444  13.627   0.510
   12    H    VAL   2           HN       VAL   2  -1.409  12.987   3.812
   13    HA   VAL   2           HA       VAL   2  -0.052  12.121   1.336
   14    HB   VAL   2           HB       VAL   2  -0.295  14.587   1.139
   15   1HG1  VAL   2          HG1       VAL   2   0.584  16.079   2.767
   16   2HG1  VAL   2          HG1       VAL   2   1.457  14.788   3.593
   17   3HG1  VAL   2          HG1       VAL   2  -0.302  14.869   3.696
   18   1HG2  VAL   2          HG2       VAL   2   2.031  13.077   0.863
   19   2HG2  VAL   2          HG2       VAL   2   2.561  14.498   1.762
   20   3HG2  VAL   2          HG2       VAL   2   1.763  14.690   0.201
   21    H    ILE   3           HN       ILE   3   1.530  10.754   1.919
   22    HA   ILE   3           HA       ILE   3   2.702  10.948   4.665
   23    HB   ILE   3           HB       ILE   3   1.040   9.186   4.364
   24   1HG1  ILE   3          HG1       ILE   3   3.888   8.140   4.358
   25   2HG1  ILE   3          HG1       ILE   3   2.944   8.601   5.771
   26   1HG2  ILE   3          HG2       ILE   3   0.780   8.530   2.215
   27   2HG2  ILE   3          HG2       ILE   3   2.083   7.390   2.544
   28   3HG2  ILE   3          HG2       ILE   3   2.439   8.945   1.795
   29   1HD1  ILE   3          HD1       ILE   3   2.888   6.178   5.511
   30   2HD1  ILE   3          HD1       ILE   3   2.315   6.349   3.851
   31   3HD1  ILE   3          HD1       ILE   3   1.285   6.844   5.194
   32    HA   PRO   4           HA       PRO   4   6.109  10.733   1.514
   33   1HB   PRO   4          HB2       PRO   4   7.105  13.260   1.766
   34   2HB   PRO   4          HB1       PRO   4   5.772  12.861   0.667
   35   1HG   PRO   4          HG2       PRO   4   5.722  14.343   3.190
   36   2HG   PRO   4          HG1       PRO   4   4.554  14.330   1.866
   37   1HD   PRO   4          HD2       PRO   4   4.407  12.932   4.371
   38   2HD   PRO   4          HD1       PRO   4   3.232  12.943   3.043
   39    H    SER   5           HN       SER   5   5.800  11.166   4.833
   40    HA   SER   5           HA       SER   5   8.549  11.737   5.553
   41   1HB   SER   5          HB2       SER   5   5.974  11.436   6.761
   42   2HB   SER   5          HB1       SER   5   7.118  10.420   7.633
   43    HG   SER   5           HG       SER   5   7.379  13.185   7.025
   44    HA   PRO   6           HA       PRO   6   8.784   7.095   6.578
   45   1HB   PRO   6          HB2       PRO   6   6.738   5.459   5.817
   46   2HB   PRO   6          HB1       PRO   6   6.781   6.298   7.381
   47   1HG   PRO   6          HG2       PRO   6   5.287   6.972   4.913
   48   2HG   PRO   6          HG1       PRO   6   4.804   7.136   6.606
   49   1HD   PRO   6          HD2       PRO   6   5.659   9.221   5.043
   50   2HD   PRO   6          HD1       PRO   6   5.781   9.192   6.815
   51    H    CYS   7           HN       CYS   7   9.928   5.644   5.266
   52    HA   CYS   7           HA       CYS   7   9.343   5.725   2.326
   53   1HB   CYS   7          HB2       CYS   7  11.432   6.957   3.551
   54   2HB   CYS   7          HB1       CYS   7  12.139   5.366   3.264
   55    H    CYS   8           HN       CYS   8  11.278   3.857   1.555
   56    HA   CYS   8           HA       CYS   8  10.722   1.425   3.199
   57   1HB   CYS   8          HB2       CYS   8   9.648   2.184   0.588
   58   2HB   CYS   8          HB1       CYS   8  10.470   0.624   0.537
   59    H    MET   9           HN       MET   9  12.374  -0.132   3.061
   60    HA   MET   9           HA       MET   9  14.832   0.736   1.596
   61   1HB   MET   9          HB2       MET   9  15.939  -0.785   3.255
   62   2HB   MET   9          HB1       MET   9  15.018   0.511   4.018
   63   1HG   MET   9          HG2       MET   9  13.410  -1.884   3.486
   64   2HG   MET   9          HG1       MET   9  14.752  -2.180   4.591
   65   1HE   MET   9          HE1       MET   9  12.869  -1.634   7.645
   66   2HE   MET   9          HE2       MET   9  14.247  -2.327   6.795
   67   3HE   MET   9          HE3       MET   9  12.611  -2.784   6.327
   68    H    PHE  10           HN       PHE  10  12.336  -1.642   1.569
   69    HA   PHE  10           HA       PHE  10  13.846  -3.161  -0.500
   70   1HB   PHE  10          HB2       PHE  10  13.573  -5.212   0.630
   71   2HB   PHE  10          HB1       PHE  10  13.935  -4.098   1.944
   72    HD1  PHE  10           HD1      PHE  10  11.747  -2.870   2.944
   73    HD2  PHE  10           HD2      PHE  10  11.761  -6.646   0.894
   74    HE1  PHE  10           HE1      PHE  10   9.595  -3.463   4.020
   75    HE2  PHE  10           HE2      PHE  10   9.610  -7.239   1.974
   76    HZ   PHE  10           HZ       PHE  10   8.526  -5.647   3.536
   77    H    PHE  11           HN       PHE  11  12.260  -4.712  -1.660
   78    HA   PHE  11           HA       PHE  11   9.578  -3.386  -1.860
   79   1HB   PHE  11          HB2       PHE  11  11.663  -3.990  -3.761
   80   2HB   PHE  11          HB1       PHE  11  10.197  -4.868  -4.202
   81    HD1  PHE  11           HD1      PHE  11  11.791  -2.110  -5.159
   82    HD2  PHE  11           HD2      PHE  11   8.049  -3.123  -3.308
   83    HE1  PHE  11           HE1      PHE  11  10.790  -0.013  -6.028
   84    HE2  PHE  11           HE2      PHE  11   7.053  -1.028  -4.177
   85    HZ   PHE  11           HZ       PHE  11   8.422   0.527  -5.538
   86    H    VAL  12           HN       VAL  12   7.756  -4.781  -2.022
   87    HA   VAL  12           HA       VAL  12   7.687  -7.167  -0.584
   88    HB   VAL  12           HB       VAL  12   5.603  -7.597  -1.989
   89   1HG1  VAL  12          HG1       VAL  12   6.254  -5.304  -0.305
   90   2HG1  VAL  12          HG1       VAL  12   4.833  -6.350  -0.283
   91   3HG1  VAL  12          HG1       VAL  12   4.902  -4.982  -1.393
   92   1HG2  VAL  12          HG2       VAL  12   5.299  -6.522  -3.952
   93   2HG2  VAL  12          HG2       VAL  12   6.975  -5.987  -3.826
   94   3HG2  VAL  12          HG2       VAL  12   5.675  -4.961  -3.222
   95    H    SER  13           HN       SER  13   8.146  -9.314  -1.044
   96    HA   SER  13           HA       SER  13   9.833 -10.007  -3.257
   97   1HB   SER  13          HB2       SER  13   8.163 -11.532  -1.247
   98   2HB   SER  13          HB1       SER  13   9.141 -12.367  -2.452
   99    HG   SER  13           HG       SER  13  10.611 -12.107  -0.941
  100    H    LYS  14           HN       LYS  14   6.360  -9.936  -2.797
  101    HA   LYS  14           HA       LYS  14   5.925 -10.359  -5.669
  102   1HB   LYS  14          HB2       LYS  14   5.350 -12.394  -3.536
  103   2HB   LYS  14          HB1       LYS  14   4.283 -12.299  -4.937
  104   1HG   LYS  14          HG2       LYS  14   6.675 -12.236  -6.193
  105   2HG   LYS  14          HG1       LYS  14   7.111 -13.188  -4.772
  106   1HD   LYS  14          HD2       LYS  14   4.549 -14.004  -5.926
  107   2HD   LYS  14          HD1       LYS  14   5.888 -14.174  -7.060
  108   1HE   LYS  14          HE2       LYS  14   6.341 -15.122  -4.258
  109   2HE   LYS  14          HE1       LYS  14   5.324 -16.118  -5.316
  110   1HZ   LYS  14          HZ1       LYS  14   7.004 -16.251  -6.924
  111   2HZ   LYS  14          HZ2       LYS  14   7.813 -16.511  -5.453
  112   3HZ   LYS  14          HZ3       LYS  14   7.909 -15.000  -6.224
  113    H    ARG  15           HN       ARG  15   3.243 -10.842  -5.685
  114    HA   ARG  15           HA       ARG  15   2.099  -8.300  -4.855
  115   1HB   ARG  15          HB2       ARG  15   1.418  -9.350  -6.899
  116   2HB   ARG  15          HB1       ARG  15   1.113 -10.887  -6.096
  117   1HG   ARG  15          HG2       ARG  15  -0.833 -10.022  -4.993
  118   2HG   ARG  15          HG1       ARG  15  -0.450  -8.373  -5.480
  119   1HD   ARG  15          HD2       ARG  15  -0.958  -8.804  -7.762
  120   2HD   ARG  15          HD1       ARG  15  -0.933 -10.560  -7.511
  121    HE   ARG  15           HE       ARG  15  -2.867  -9.732  -5.743
  122   1HH1  ARG  15          HH1       ARG  15  -2.480 -10.157  -9.076
  123   2HH1  ARG  15          HH1       ARG  15  -4.037  -9.534  -9.504
  124   1HH2  ARG  15          HH2       ARG  15  -4.795  -8.489  -6.286
  125   2HH2  ARG  15          HH2       ARG  15  -5.347  -8.588  -7.924
  126    H    ILE  16           HN       ILE  16  -0.057  -8.338  -3.602
  127    HA   ILE  16           HA       ILE  16   0.158 -10.173  -1.232
  128    HB   ILE  16           HB       ILE  16  -1.381  -7.623  -1.068
  129   1HG1  ILE  16          HG1       ILE  16   1.641  -7.659  -1.371
  130   2HG1  ILE  16          HG1       ILE  16   0.485  -6.778  -2.364
  131   1HG2  ILE  16          HG2       ILE  16   0.519  -7.850   0.990
  132   2HG2  ILE  16          HG2       ILE  16   0.004  -9.496   0.646
  133   3HG2  ILE  16          HG2       ILE  16  -1.191  -8.273   1.067
  134   1HD1  ILE  16          HD1       ILE  16   1.649  -5.339  -0.661
  135   2HD1  ILE  16          HD1       ILE  16   0.878  -6.292   0.605
  136   3HD1  ILE  16          HD1       ILE  16  -0.107  -5.338  -0.503
  137    HA   PRO  17           HA       PRO  17  -4.009 -11.276  -2.248
  138   1HB   PRO  17          HB2       PRO  17  -4.804 -12.354   0.131
  139   2HB   PRO  17          HB1       PRO  17  -3.667 -13.160  -0.965
  140   1HG   PRO  17          HG2       PRO  17  -3.173 -11.882   1.606
  141   2HG   PRO  17          HG1       PRO  17  -2.188 -13.044   0.714
  142   1HD   PRO  17          HD2       PRO  17  -1.844 -10.207   0.913
  143   2HD   PRO  17          HD1       PRO  17  -0.829 -11.377   0.045
  144    H    GLU  18           HN       GLU  18  -5.352  -9.500  -2.541
  145    HA   GLU  18           HA       GLU  18  -5.825  -7.284  -0.980
  146   1HB   GLU  18          HB2       GLU  18  -8.035  -7.220  -2.131
  147   2HB   GLU  18          HB1       GLU  18  -6.722  -7.666  -3.222
  148   1HG   GLU  18          HG2       GLU  18  -7.325  -9.968  -3.174
  149   2HG   GLU  18          HG1       GLU  18  -8.386  -9.737  -1.785
  150    H    ASN  19           HN       ASN  19  -7.068 -10.521  -0.334
  151    HA   ASN  19           HA       ASN  19  -9.107  -9.685   1.559
  152   1HB   ASN  19          HB2       ASN  19  -8.007 -12.094   0.376
  153   2HB   ASN  19          HB1       ASN  19  -8.264 -12.318   2.107
  154   1HD2  ASN  19          HD2       ASN  19  -9.908 -11.611  -0.957
  155   2HD2  ASN  19          HD2       ASN  19 -11.482 -11.860  -0.370
  156    H    ARG  20           HN       ARG  20  -5.750  -9.539   1.762
  157    HA   ARG  20           HA       ARG  20  -5.779  -9.893   4.733
  158   1HB   ARG  20          HB2       ARG  20  -3.715 -10.291   2.563
  159   2HB   ARG  20          HB1       ARG  20  -3.276 -10.234   4.265
  160   1HG   ARG  20          HG2       ARG  20  -5.372 -11.976   4.337
  161   2HG   ARG  20          HG1       ARG  20  -4.685 -12.343   2.754
  162   1HD   ARG  20          HD2       ARG  20  -2.468 -12.696   3.776
  163   2HD   ARG  20          HD1       ARG  20  -3.136 -12.300   5.372
  164    HE   ARG  20           HE       ARG  20  -4.269 -14.392   5.380
  165   1HH1  ARG  20          HH2       ARG  20  -1.906 -15.419   3.845
  166   2HH1  ARG  20          HH2       ARG  20  -2.662 -16.184   2.486
  167   1HH2  ARG  20          HH1       ARG  20  -5.714 -14.610   2.959
  168   2HH2  ARG  20          HH1       ARG  20  -4.817 -15.726   1.984
  169    H    VAL  21           HN       VAL  21  -4.837  -7.848   2.028
  170    HA   VAL  21           HA       VAL  21  -3.299  -5.916   3.528
  171    HB   VAL  21           HB       VAL  21  -4.864  -5.642   0.938
  172   1HG1  VAL  21          HG1       VAL  21  -3.589  -3.683   2.391
  173   2HG1  VAL  21          HG1       VAL  21  -3.847  -3.633   0.647
  174   3HG1  VAL  21          HG1       VAL  21  -2.313  -4.216   1.297
  175   1HG2  VAL  21          HG2       VAL  21  -2.015  -6.554   1.463
  176   2HG2  VAL  21          HG2       VAL  21  -2.702  -6.250  -0.133
  177   3HG2  VAL  21          HG2       VAL  21  -3.331  -7.563   0.860
  178    H    VAL  22           HN       VAL  22  -3.988  -3.830   4.292
  179    HA   VAL  22           HA       VAL  22  -6.944  -3.539   4.608
  180    HB   VAL  22           HB       VAL  22  -6.263  -2.420   6.783
  181   1HG1  VAL  22          HG1       VAL  22  -5.955  -5.295   6.115
  182   2HG1  VAL  22          HG1       VAL  22  -7.099  -4.509   7.205
  183   3HG1  VAL  22          HG1       VAL  22  -5.431  -4.774   7.717
  184   1HG2  VAL  22          HG2       VAL  22  -3.603  -3.725   6.158
  185   2HG2  VAL  22          HG2       VAL  22  -4.032  -2.915   7.663
  186   3HG2  VAL  22          HG2       VAL  22  -3.899  -1.986   6.171
  187    H    SER  23           HN       SER  23  -3.843  -1.838   4.285
  188    HA   SER  23           HA       SER  23  -5.011   0.308   2.728
  189   1HB   SER  23          HB2       SER  23  -5.927   0.721   5.011
  190   2HB   SER  23          HB1       SER  23  -4.281   0.823   5.628
  191    HG   SER  23           HG       SER  23  -5.734   2.741   4.542
  192    H    TYR  24           HN       TYR  24  -3.325   1.638   1.859
  193    HA   TYR  24           HA       TYR  24  -0.608   0.615   2.398
  194   1HB   TYR  24          HB2       TYR  24  -0.136   1.534   0.218
  195   2HB   TYR  24          HB1       TYR  24  -1.673   0.691   0.132
  196    HD1  TYR  24           HD1      TYR  24  -0.133   4.067   0.499
  197    HD2  TYR  24           HD2      TYR  24  -3.680   1.834  -0.440
  198    HE1  TYR  24           HE1      TYR  24  -1.244   6.148  -0.250
  199    HE2  TYR  24           HE2      TYR  24  -4.790   3.916  -1.193
  200    HH   TYR  24           HH       TYR  24  -4.379   6.557  -0.534
  201    H    GLN  25           HN       GLN  25   1.058   2.442   1.822
  202    HA   GLN  25           HA       GLN  25   0.467   5.033   3.156
  203   1HB   GLN  25          HB2       GLN  25   2.345   2.843   3.991
  204   2HB   GLN  25          HB1       GLN  25   2.881   4.510   4.209
  205   1HG   GLN  25          HG2       GLN  25   1.682   4.556   6.117
  206   2HG   GLN  25          HG1       GLN  25   0.225   4.474   5.125
  207   1HE2  GLN  25          HE2       GLN  25   2.566   2.463   6.921
  208   2HE2  GLN  25          HE2       GLN  25   1.554   1.107   7.044
  209    H    LEU  26           HN       LEU  26   0.761   6.083   1.129
  210    HA   LEU  26           HA       LEU  26   2.692   5.356  -0.814
  211   1HB   LEU  26          HB2       LEU  26   0.842   7.557  -0.224
  212   2HB   LEU  26          HB1       LEU  26   2.242   8.057  -1.172
  213    HG   LEU  26           HG       LEU  26   0.329   5.800  -1.842
  214   1HD1  LEU  26          HD1       LEU  26  -0.828   7.436  -2.870
  215   2HD1  LEU  26          HD1       LEU  26   0.559   7.677  -3.934
  216   3HD1  LEU  26          HD1       LEU  26   0.407   8.627  -2.457
  217   1HD2  LEU  26          HD2       LEU  26   2.972   6.663  -3.005
  218   2HD2  LEU  26          HD2       LEU  26   1.747   5.944  -4.049
  219   3HD2  LEU  26          HD2       LEU  26   2.383   5.033  -2.681
  220    H    SER  27           HN       SER  27   4.609   6.515  -1.476
  221    HA   SER  27           HA       SER  27   5.947   8.295   0.450
  222   1HB   SER  27          HB2       SER  27   6.267   5.937   1.271
  223   2HB   SER  27          HB1       SER  27   7.077   5.567  -0.249
  224    HG   SER  27           HG       SER  27   7.849   7.370   1.791
  225    H    SER  28           HN       SER  28   6.558   9.831  -1.059
  226    HA   SER  28           HA       SER  28   7.293   9.108  -3.793
  227   1HB   SER  28          HB2       SER  28   7.528  11.525  -4.022
  228   2HB   SER  28          HB1       SER  28   6.083  11.177  -3.078
  229    HG   SER  28           HG       SER  28   7.039  11.924  -1.314
  230    H    ARG  29           HN       ARG  29   9.418  10.995  -4.153
  231    HA   ARG  29           HA       ARG  29  11.686   9.353  -3.225
  232   1HB   ARG  29          HB2       ARG  29  11.171  10.419  -5.563
  233   2HB   ARG  29          HB1       ARG  29  11.831  11.889  -4.843
  234   1HG   ARG  29          HG2       ARG  29  13.747  10.927  -5.760
  235   2HG   ARG  29          HG1       ARG  29  13.800  10.302  -4.111
  236   1HD   ARG  29          HD2       ARG  29  14.148   8.374  -5.463
  237   2HD   ARG  29          HD1       ARG  29  12.417   8.300  -5.072
  238    HE   ARG  29           HE       ARG  29  11.964   9.336  -7.285
  239   1HH1  ARG  29          HH2       ARG  29  14.585  10.506  -7.940
  240   2HH1  ARG  29          HH2       ARG  29  15.269   9.348  -9.032
  241   1HH2  ARG  29          HH1       ARG  29  13.075   6.816  -8.143
  242   2HH2  ARG  29          HH1       ARG  29  14.414   7.259  -9.148
  243    H    SER  30           HN       SER  30  10.817  10.359  -0.921
  244    HA   SER  30           HA       SER  30  12.013  13.014  -0.394
  245   1HB   SER  30          HB2       SER  30  10.274  11.024   1.027
  246   2HB   SER  30          HB1       SER  30  11.121  12.238   1.981
  247    HG   SER  30           HG       SER  30   9.490  12.783  -0.281
  248    H    THR  31           HN       THR  31  14.238  12.914  -0.232
  249    HA   THR  31           HA       THR  31  16.387  12.163   0.414
  250    HB   THR  31           HB       THR  31  16.499  11.865   2.843
  251    HG1  THR  31           HG1      THR  31  13.691  11.845   2.939
  252   1HG2  THR  31          HG2       THR  31  14.248  13.799   2.286
  253   2HG2  THR  31          HG2       THR  31  15.904  14.114   1.764
  254   3HG2  THR  31          HG2       THR  31  15.539  13.941   3.480
  255    H    CYS  32           HN       CYS  32  14.770  10.120  -0.952
  256    HA   CYS  32           HA       CYS  32  15.885   7.663   0.363
  257   1HB   CYS  32          HB2       CYS  32  13.217   8.429  -0.413
  258   2HB   CYS  32          HB1       CYS  32  13.713   7.027  -1.361
  259    H    LEU  33           HN       LEU  33  15.430   5.890  -1.740
  260    HA   LEU  33           HA       LEU  33  17.110   7.035  -3.932
  261   1HB   LEU  33          HB2       LEU  33  17.102   4.408  -2.461
  262   2HB   LEU  33          HB1       LEU  33  17.831   4.532  -4.063
  263    HG   LEU  33           HG       LEU  33  18.967   6.687  -2.955
  264   1HD1  LEU  33          HD1       LEU  33  18.607   6.811  -0.734
  265   2HD1  LEU  33          HD1       LEU  33  19.495   5.298  -0.556
  266   3HD1  LEU  33          HD1       LEU  33  17.742   5.275  -0.746
  267   1HD2  LEU  33          HD2       LEU  33  19.766   4.121  -3.669
  268   2HD2  LEU  33          HD2       LEU  33  20.341   4.280  -2.009
  269   3HD2  LEU  33          HD2       LEU  33  20.843   5.448  -3.232
  270    H    LYS  34           HN       LYS  34  14.185   5.371  -3.126
  271    HA   LYS  34           HA       LYS  34  13.615   5.022  -6.047
  272   1HB   LYS  34          HB2       LYS  34  13.125   3.115  -3.739
  273   2HB   LYS  34          HB1       LYS  34  12.453   2.889  -5.354
  274   1HG   LYS  34          HG2       LYS  34  14.951   3.191  -6.125
  275   2HG   LYS  34          HG1       LYS  34  15.314   2.736  -4.458
  276   1HD   LYS  34          HD2       LYS  34  13.898   0.701  -4.746
  277   2HD   LYS  34          HD1       LYS  34  13.671   1.136  -6.442
  278   1HE   LYS  34          HE2       LYS  34  15.533  -0.162  -6.770
  279   2HE   LYS  34          HE1       LYS  34  16.412   1.270  -6.199
  280   1HZ   LYS  34          HZ1       LYS  34  17.082  -0.437  -4.764
  281   2HZ   LYS  34          HZ2       LYS  34  15.512  -1.073  -4.631
  282   3HZ   LYS  34          HZ3       LYS  34  15.901   0.404  -3.884
  283    H    ALA  35           HN       ALA  35  11.044   4.350  -6.059
  284    HA   ALA  35           HA       ALA  35   9.562   6.070  -4.128
  285   1HB   ALA  35          HB1       ALA  35   8.689   7.448  -5.834
  286   2HB   ALA  35          HB2       ALA  35   9.110   6.295  -7.100
  287   3HB   ALA  35          HB3       ALA  35  10.374   7.242  -6.315
  288    H    GLY  36           HN       GLY  36   8.469   4.208  -3.328
  289   1HA   GLY  36          HA2       GLY  36   6.569   2.987  -5.273
  290   2HA   GLY  36          HA1       GLY  36   7.466   1.956  -4.157
  291    H    VAL  37           HN       VAL  37   5.006   1.484  -3.627
  292    HA   VAL  37           HA       VAL  37   4.019   3.516  -1.652
  293    HB   VAL  37           HB       VAL  37   2.585   1.154  -2.907
  294   1HG1  VAL  37          HG1       VAL  37   1.321   1.834  -1.055
  295   2HG1  VAL  37          HG1       VAL  37   0.626   2.812  -2.348
  296   3HG1  VAL  37          HG1       VAL  37   1.792   3.525  -1.233
  297   1HG2  VAL  37          HG2       VAL  37   2.739   2.353  -4.833
  298   2HG2  VAL  37          HG2       VAL  37   3.287   3.800  -3.988
  299   3HG2  VAL  37          HG2       VAL  37   1.565   3.433  -4.078
  300    H    ILE  38           HN       ILE  38   2.856   2.339   0.277
  301    HA   ILE  38           HA       ILE  38   4.432  -0.099   1.049
  302    HB   ILE  38           HB       ILE  38   3.694   2.387   2.624
  303   1HG1  ILE  38          HG1       ILE  38   6.351   2.020   2.950
  304   2HG1  ILE  38          HG1       ILE  38   6.147   1.260   1.371
  305   1HG2  ILE  38          HG2       ILE  38   4.851  -0.263   3.532
  306   2HG2  ILE  38          HG2       ILE  38   3.389   0.527   4.123
  307   3HG2  ILE  38          HG2       ILE  38   4.971   1.215   4.486
  308   1HD1  ILE  38          HD1       ILE  38   5.005   3.316   0.556
  309   2HD1  ILE  38          HD1       ILE  38   6.658   3.636   1.079
  310   3HD1  ILE  38          HD1       ILE  38   5.303   4.076   2.118
  311    H    PHE  39           HN       PHE  39   3.021  -1.802   1.405
  312    HA   PHE  39           HA       PHE  39   0.221  -1.094   2.196
  313   1HB   PHE  39          HB2       PHE  39   1.464  -3.239   0.496
  314   2HB   PHE  39          HB1       PHE  39  -0.136  -3.484   1.196
  315    HD1  PHE  39           HD1      PHE  39   1.860  -1.018  -0.786
  316    HD2  PHE  39           HD2      PHE  39  -2.033  -2.557   0.173
  317    HE1  PHE  39           HE1      PHE  39   0.854   0.425  -2.534
  318    HE2  PHE  39           HE2      PHE  39  -3.029  -1.106  -1.571
  319    HZ   PHE  39           HZ       PHE  39  -1.588   0.376  -2.925
  320    H    THR  40           HN       THR  40  -0.552  -1.871   4.089
  321    HA   THR  40           HA       THR  40   1.180  -3.685   5.688
  322    HB   THR  40           HB       THR  40  -1.000  -1.675   6.298
  323    HG1  THR  40           HG1      THR  40   0.862  -0.633   6.191
  324   1HG2  THR  40          HG2       THR  40  -0.613  -2.225   8.702
  325   2HG2  THR  40          HG2       THR  40   0.371  -3.598   8.197
  326   3HG2  THR  40          HG2       THR  40  -1.348  -3.556   7.809
  327    H    THR  41           HN       THR  41   0.286  -5.611   6.550
  328    HA   THR  41           HA       THR  41  -2.181  -6.562   5.216
  329    HB   THR  41           HB       THR  41  -0.588  -8.289   7.034
  330    HG1  THR  41           HG1      THR  41   1.001  -8.475   5.318
  331   1HG2  THR  41          HG2       THR  41  -1.750  -9.777   5.821
  332   2HG2  THR  41          HG2       THR  41  -0.784  -9.318   4.417
  333   3HG2  THR  41          HG2       THR  41  -2.317  -8.507   4.737
  334    H    LYS  42           HN       LYS  42  -3.702  -7.890   6.612
  335    HA   LYS  42           HA       LYS  42  -4.557  -6.349   8.920
  336   1HB   LYS  42          HB2       LYS  42  -6.312  -8.099   8.985
  337   2HB   LYS  42          HB1       LYS  42  -6.067  -7.507   7.342
  338   1HG   LYS  42          HG2       LYS  42  -5.540  -9.577   6.644
  339   2HG   LYS  42          HG1       LYS  42  -4.241  -9.670   7.834
  340   1HD   LYS  42          HD2       LYS  42  -6.344 -10.053   9.472
  341   2HD   LYS  42          HD1       LYS  42  -7.024 -10.712   7.984
  342   1HE   LYS  42          HE2       LYS  42  -5.476 -12.446   7.880
  343   2HE   LYS  42          HE1       LYS  42  -4.246 -11.534   8.780
  344   1HZ   LYS  42          HZ1       LYS  42  -5.189 -13.143  10.255
  345   2HZ   LYS  42          HZ2       LYS  42  -6.771 -12.672   9.855
  346   3HZ   LYS  42          HZ3       LYS  42  -5.761 -11.617  10.725
  347    H    LYS  43           HN       LYS  43  -2.467  -9.098   8.461
  348    HA   LYS  43           HA       LYS  43  -2.736 -10.211  11.139
  349   1HB   LYS  43          HB2       LYS  43  -1.992 -11.491   9.167
  350   2HB   LYS  43          HB1       LYS  43  -0.587 -10.438   9.003
  351   1HG   LYS  43          HG2       LYS  43   0.329 -12.224  10.187
  352   2HG   LYS  43          HG1       LYS  43  -0.134 -11.146  11.503
  353   1HD   LYS  43          HD2       LYS  43  -1.946 -12.453  12.124
  354   2HD   LYS  43          HD1       LYS  43  -2.148 -13.127  10.506
  355   1HE   LYS  43          HE2       LYS  43  -0.103 -14.480  10.797
  356   2HE   LYS  43          HE1       LYS  43   0.119 -13.797  12.420
  357   1HZ   LYS  43          HZ1       LYS  43  -1.133 -15.960  12.334
  358   2HZ   LYS  43          HZ2       LYS  43  -2.391 -15.120  11.558
  359   3HZ   LYS  43          HZ3       LYS  43  -1.928 -14.696  13.136
  360    H    GLY  44           HN       GLY  44  -0.963  -7.558   9.752
  361   1HA   GLY  44          HA2       GLY  44  -0.102  -5.898  11.411
  362   2HA   GLY  44          HA1       GLY  44   0.529  -7.272  12.318
  363    H    GLN  45           HN       GLN  45   0.755  -7.421   8.867
  364    HA   GLN  45           HA       GLN  45   3.710  -7.262   9.076
  365   1HB   GLN  45          HB2       GLN  45   1.645  -8.368   7.218
  366   2HB   GLN  45          HB1       GLN  45   3.216  -7.955   6.529
  367   1HG   GLN  45          HG2       GLN  45   3.893  -9.274   8.870
  368   2HG   GLN  45          HG1       GLN  45   2.486 -10.173   8.301
  369   1HE2  GLN  45          HE2       GLN  45   4.938 -11.494   8.217
  370   2HE2  GLN  45          HE2       GLN  45   5.473 -11.632   6.611
  371    H    GLN  46           HN       GLN  46   4.755  -6.159   7.048
  372    HA   GLN  46           HA       GLN  46   3.253  -3.822   6.026
  373   1HB   GLN  46          HB2       GLN  46   5.257  -3.808   8.203
  374   2HB   GLN  46          HB1       GLN  46   5.531  -2.601   6.946
  375   1HG   GLN  46          HG2       GLN  46   3.058  -1.990   7.195
  376   2HG   GLN  46          HG1       GLN  46   3.072  -2.963   8.668
  377   1HE2  GLN  46          HE2       GLN  46   2.619  -0.807   9.775
  378   2HE2  GLN  46          HE2       GLN  46   3.933   0.208  10.128
  379    H    SER  47           HN       SER  47   3.685  -4.495   3.894
  380    HA   SER  47           HA       SER  47   6.570  -4.839   3.153
  381   1HB   SER  47          HB2       SER  47   5.751  -6.309   1.436
  382   2HB   SER  47          HB1       SER  47   4.885  -6.732   2.909
  383    HG   SER  47           HG       SER  47   3.128  -6.246   1.885
  384    H    CYS  48           HN       CYS  48   7.346  -3.696   1.333
  385    HA   CYS  48           HA       CYS  48   5.972  -1.192   0.695
  386   1HB   CYS  48          HB2       CYS  48   8.460  -2.463  -0.493
  387   2HB   CYS  48          HB1       CYS  48   8.027  -0.755  -0.551
  388    H    GLY  49           HN       GLY  49   4.411  -1.086  -0.903
  389   1HA   GLY  49          HA2       GLY  49   4.292  -3.254  -2.911
  390   2HA   GLY  49          HA1       GLY  49   3.054  -2.031  -2.651
  391    H    ASP  50           HN       ASP  50   4.805  -2.973  -5.005
  392    HA   ASP  50           HA       ASP  50   6.122  -0.441  -5.779
  393   1HB   ASP  50          HB2       ASP  50   6.923  -1.807  -7.659
  394   2HB   ASP  50          HB1       ASP  50   7.146  -2.685  -6.145
  395    HA   PRO  51           HA       PRO  51   2.415   0.887  -7.847
  396   1HB   PRO  51          HB2       PRO  51   3.536   2.895  -9.355
  397   2HB   PRO  51          HB1       PRO  51   3.176   3.063  -7.624
  398   1HG   PRO  51          HG2       PRO  51   5.770   2.445  -8.963
  399   2HG   PRO  51          HG1       PRO  51   5.434   3.523  -7.595
  400   1HD   PRO  51          HD2       PRO  51   6.464   1.050  -7.255
  401   2HD   PRO  51          HD1       PRO  51   5.358   1.788  -6.075
  402    H    LYS  52           HN       LYS  52   5.332  -0.220  -9.394
  403    HA   LYS  52           HA       LYS  52   4.426  -0.206 -12.130
  404   1HB   LYS  52          HB2       LYS  52   6.547  -1.510 -10.468
  405   2HB   LYS  52          HB1       LYS  52   6.227  -2.189 -12.064
  406   1HG   LYS  52          HG2       LYS  52   6.273   0.495 -12.617
  407   2HG   LYS  52          HG1       LYS  52   7.479   0.379 -11.334
  408   1HD   LYS  52          HD2       LYS  52   8.047  -1.819 -12.926
  409   2HD   LYS  52          HD1       LYS  52   7.608  -0.578 -14.100
  410   1HE   LYS  52          HE2       LYS  52   9.267   0.956 -13.189
  411   2HE   LYS  52          HE1       LYS  52   9.641  -0.178 -11.875
  412   1HZ   LYS  52          HZ1       LYS  52  11.181  -0.389 -13.776
  413   2HZ   LYS  52          HZ2       LYS  52   9.870  -0.815 -14.770
  414   3HZ   LYS  52          HZ3       LYS  52  10.319  -1.817 -13.473
  415    H    GLN  53           HN       GLN  53   3.765  -2.247  -9.379
  416    HA   GLN  53           HA       GLN  53   2.760  -4.504 -10.975
  417   1HB   GLN  53          HB2       GLN  53   3.214  -3.763  -8.135
  418   2HB   GLN  53          HB1       GLN  53   1.893  -4.896  -8.422
  419   1HG   GLN  53          HG2       GLN  53   4.614  -5.297  -9.667
  420   2HG   GLN  53          HG1       GLN  53   4.237  -5.905  -8.055
  421   1HE2  GLN  53          HE2       GLN  53   4.642  -8.069  -9.294
  422   2HE2  GLN  53          HE2       GLN  53   3.295  -8.771 -10.054
  423    H    GLU  54           HN       GLU  54   0.455  -5.141 -10.873
  424    HA   GLU  54           HA       GLU  54  -1.318  -2.773 -11.022
  425   1HB   GLU  54          HB2       GLU  54  -1.346  -5.659 -11.851
  426   2HB   GLU  54          HB1       GLU  54  -2.881  -4.799 -11.732
  427   1HG   GLU  54          HG2       GLU  54  -2.344  -3.319 -13.440
  428   2HG   GLU  54          HG1       GLU  54  -0.608  -3.499 -13.188
  429    H    TRP  55           HN       TRP  55  -0.463  -5.030  -8.584
  430    HA   TRP  55           HA       TRP  55  -3.166  -5.095  -7.419
  431   1HB   TRP  55          HB2       TRP  55  -2.126  -6.517  -5.754
  432   2HB   TRP  55          HB1       TRP  55  -1.642  -7.036  -7.358
  433    HD1  TRP  55           HD1      TRP  55   0.869  -7.085  -7.896
  434    HE1  TRP  55           HE1      TRP  55   2.999  -6.556  -6.534
  435    HE3  TRP  55           HE3      TRP  55  -1.201  -4.746  -3.858
  436    HZ2  TRP  55           HZ2      TRP  55   3.713  -5.349  -4.094
  437    HZ3  TRP  55           HZ3      TRP  55   0.240  -3.907  -2.023
  438    HH2  TRP  55           HH2      TRP  55   2.701  -4.198  -2.136
  439    H    VAL  56           HN       VAL  56  -0.128  -3.296  -6.969
  440    HA   VAL  56           HA       VAL  56  -0.958  -2.042  -4.474
  441    HB   VAL  56           HB       VAL  56   0.876  -1.088  -6.725
  442   1HG1  VAL  56          HG1       VAL  56   0.824   0.892  -5.631
  443   2HG1  VAL  56          HG1       VAL  56   1.613   0.082  -4.278
  444   3HG1  VAL  56          HG1       VAL  56  -0.145   0.210  -4.325
  445   1HG2  VAL  56          HG2       VAL  56   1.525  -2.328  -4.029
  446   2HG2  VAL  56          HG2       VAL  56   2.694  -1.807  -5.242
  447   3HG2  VAL  56          HG2       VAL  56   1.626  -3.170  -5.576
  448    H    GLN  57           HN       GLN  57  -0.885  -0.977  -7.870
  449    HA   GLN  57           HA       GLN  57  -2.450   1.345  -7.716
  450   1HB   GLN  57          HB2       GLN  57  -1.299  -0.307  -9.649
  451   2HB   GLN  57          HB1       GLN  57  -3.021  -0.381 -10.026
  452   1HG   GLN  57          HG2       GLN  57  -2.790   2.273  -9.592
  453   2HG   GLN  57          HG1       GLN  57  -1.153   1.934 -10.155
  454   1HE2  GLN  57          HE2       GLN  57  -3.946   3.044 -11.374
  455   2HE2  GLN  57          HE2       GLN  57  -3.922   2.348 -12.922
  456    H    ARG  58           HN       ARG  58  -3.566  -2.000  -8.357
  457    HA   ARG  58           HA       ARG  58  -6.344  -1.539  -8.439
  458   1HB   ARG  58          HB2       ARG  58  -5.327  -3.662  -9.010
  459   2HB   ARG  58          HB1       ARG  58  -4.670  -3.841  -7.384
  460   1HG   ARG  58          HG2       ARG  58  -6.989  -3.925  -6.486
  461   2HG   ARG  58          HG1       ARG  58  -7.610  -3.832  -8.133
  462   1HD   ARG  58          HD2       ARG  58  -5.720  -5.905  -8.221
  463   2HD   ARG  58          HD1       ARG  58  -6.602  -6.153  -6.701
  464    HE   ARG  58           HE       ARG  58  -8.575  -5.509  -8.561
  465   1HH1  ARG  58          HH2       ARG  58  -6.031  -7.268  -9.684
  466   2HH1  ARG  58          HH2       ARG  58  -6.894  -8.750  -9.932
  467   1HH2  ARG  58          HH1       ARG  58  -9.739  -7.679  -8.261
  468   2HH2  ARG  58          HH1       ARG  58  -8.993  -8.982  -9.126
  469    H    TYR  59           HN       TYR  59  -4.314  -2.316  -5.579
  470    HA   TYR  59           HA       TYR  59  -6.489  -2.042  -3.682
  471   1HB   TYR  59          HB2       TYR  59  -3.482  -1.806  -3.329
  472   2HB   TYR  59          HB1       TYR  59  -4.642  -2.096  -2.044
  473    HD1  TYR  59           HD1      TYR  59  -5.950  -3.939  -4.699
  474    HD2  TYR  59           HD2      TYR  59  -2.607  -3.934  -1.994
  475    HE1  TYR  59           HE1      TYR  59  -5.666  -6.382  -5.017
  476    HE2  TYR  59           HE2      TYR  59  -2.333  -6.376  -2.317
  477    HH   TYR  59           HH       TYR  59  -3.521  -8.266  -3.063
  478    H    MET  60           HN       MET  60  -3.574  -0.036  -4.043
  479    HA   MET  60           HA       MET  60  -4.303   2.203  -2.583
  480   1HB   MET  60          HB2       MET  60  -2.251   2.720  -3.293
  481   2HB   MET  60          HB1       MET  60  -2.321   1.369  -4.391
  482   1HG   MET  60          HG2       MET  60  -1.827   3.119  -5.824
  483   2HG   MET  60          HG1       MET  60  -3.581   3.038  -5.965
  484   1HE   MET  60          HE1       MET  60  -0.716   5.724  -4.032
  485   2HE   MET  60          HE2       MET  60  -0.851   3.973  -3.890
  486   3HE   MET  60          HE3       MET  60  -1.602   5.008  -2.682
  487    H    LYS  61           HN       LYS  61  -5.467   1.314  -5.792
  488    HA   LYS  61           HA       LYS  61  -6.651   3.900  -6.399
  489   1HB   LYS  61          HB2       LYS  61  -6.061   2.235  -8.114
  490   2HB   LYS  61          HB1       LYS  61  -7.197   1.086  -7.407
  491   1HG   LYS  61          HG2       LYS  61  -9.079   2.393  -8.026
  492   2HG   LYS  61          HG1       LYS  61  -8.086   3.814  -8.349
  493   1HD   LYS  61          HD2       LYS  61  -6.937   2.230 -10.123
  494   2HD   LYS  61          HD1       LYS  61  -8.460   1.347 -10.012
  495   1HE   LYS  61          HE2       LYS  61  -9.729   3.217 -10.759
  496   2HE   LYS  61          HE1       LYS  61  -8.386   4.340 -10.472
  497   1HZ   LYS  61          HZ1       LYS  61  -8.699   3.562 -12.847
  498   2HZ   LYS  61          HZ2       LYS  61  -8.154   2.040 -12.324
  499   3HZ   LYS  61          HZ3       LYS  61  -7.138   3.398 -12.204
  500    H    ASN  62           HN       ASN  62  -7.938   0.796  -5.166
  501    HA   ASN  62           HA       ASN  62 -10.630   1.805  -4.770
  502   1HB   ASN  62          HB2       ASN  62  -9.015  -0.590  -3.871
  503   2HB   ASN  62          HB1       ASN  62 -10.679  -0.357  -3.332
  504   1HD2  ASN  62          HD2       ASN  62 -12.236  -1.249  -4.691
  505   2HD2  ASN  62          HD2       ASN  62 -12.013  -1.590  -6.338
  506    H    LEU  63           HN       LEU  63  -7.760   1.408  -2.714
  507    HA   LEU  63           HA       LEU  63  -8.933   2.096  -0.208
  508   1HB   LEU  63          HB2       LEU  63  -6.265   1.923  -1.488
  509   2HB   LEU  63          HB1       LEU  63  -6.343   2.954  -0.055
  510    HG   LEU  63           HG       LEU  63  -7.580   0.208  -0.040
  511   1HD1  LEU  63          HD1       LEU  63  -5.527  -0.775   0.687
  512   2HD1  LEU  63          HD1       LEU  63  -4.738   0.796   0.816
  513   3HD1  LEU  63          HD1       LEU  63  -5.132   0.135  -0.772
  514   1HD2  LEU  63          HD2       LEU  63  -7.164   0.427   2.379
  515   2HD2  LEU  63          HD2       LEU  63  -8.085   1.810   1.787
  516   3HD2  LEU  63          HD2       LEU  63  -6.358   1.972   2.109
  517    H    ASP  64           HN       ASP  64  -7.778   4.062  -2.900
  518    HA   ASP  64           HA       ASP  64  -7.824   6.589  -1.451
  519   1HB   ASP  64          HB2       ASP  64  -6.604   5.787  -3.651
  520   2HB   ASP  64          HB1       ASP  64  -8.100   6.302  -4.432
  521    H    ALA  65           HN       ALA  65 -10.173   4.628  -3.132
  522    HA   ALA  65           HA       ALA  65 -12.128   6.817  -3.411
  523   1HB   ALA  65          HB1       ALA  65 -13.392   4.395  -3.888
  524   2HB   ALA  65          HB2       ALA  65 -11.711   4.047  -4.294
  525   3HB   ALA  65          HB3       ALA  65 -12.561   5.363  -5.105
  526    H    LYS  66           HN       LYS  66 -11.053   5.341  -0.737
  527    HA   LYS  66           HA       LYS  66 -13.719   4.722   0.441
  528   1HB   LYS  66          HB2       LYS  66 -10.923   3.908   0.791
  529   2HB   LYS  66          HB1       LYS  66 -11.740   4.233   2.321
  530   1HG   LYS  66          HG2       LYS  66 -13.677   2.826   1.067
  531   2HG   LYS  66          HG1       LYS  66 -12.255   2.102   0.318
  532   1HD   LYS  66          HD2       LYS  66 -12.836   0.858   2.341
  533   2HD   LYS  66          HD1       LYS  66 -11.304   1.698   2.582
  534   1HE   LYS  66          HE2       LYS  66 -13.387   3.498   3.344
  535   2HE   LYS  66          HE1       LYS  66 -13.693   1.940   4.139
  536   1HZ   LYS  66          HZ1       LYS  66 -11.493   1.877   4.969
  537   2HZ   LYS  66          HZ2       LYS  66 -12.079   3.431   5.324
  538   3HZ   LYS  66          HZ3       LYS  66 -11.010   3.201   4.024
  539    H    GLN  67           HN       GLN  67 -10.842   6.067   2.005
  540    HA   GLN  67           HA       GLN  67 -12.433   7.945   3.558
  541   1HB   GLN  67          HB2       GLN  67  -9.558   7.170   3.215
  542   2HB   GLN  67          HB1       GLN  67  -9.923   8.681   4.049
  543   1HG   GLN  67          HG2       GLN  67 -11.724   6.904   5.175
  544   2HG   GLN  67          HG1       GLN  67 -10.275   5.921   4.964
  545   1HE2  GLN  67          HE2       GLN  67 -10.025   5.967   7.370
  546   2HE2  GLN  67          HE2       GLN  67  -9.373   7.344   8.119
  547    H    LYS  68           HN       LYS  68 -13.165   8.721   1.123
  548    HA   LYS  68           HA       LYS  68 -11.528  11.173   0.569
  549   1HB   LYS  68          HB2       LYS  68 -12.046   8.885  -1.059
  550   2HB   LYS  68          HB1       LYS  68 -12.919  10.246  -1.763
  551   1HG   LYS  68          HG2       LYS  68 -10.554  11.447  -1.171
  552   2HG   LYS  68          HG1       LYS  68 -10.001   9.806  -1.510
  553   1HD   LYS  68          HD2       LYS  68 -10.650   9.892  -3.720
  554   2HD   LYS  68          HD1       LYS  68 -11.974  11.010  -3.396
  555   1HE   LYS  68          HE2       LYS  68 -10.539  12.532  -4.359
  556   2HE   LYS  68          HE1       LYS  68  -9.835  12.572  -2.731
  557   1HZ   LYS  68          HZ1       LYS  68  -8.445  10.647  -3.404
  558   2HZ   LYS  68          HZ2       LYS  68  -8.093  12.067  -4.266
  559   3HZ   LYS  68          HZ3       LYS  68  -9.007  10.834  -4.992
  560    H    LYS  69           HN       LYS  69 -13.232  12.307  -1.318
  561    HA   LYS  69           HA       LYS  69 -15.678  12.855   0.322
  562   1HB   LYS  69          HB2       LYS  69 -13.673  14.435  -1.021
  563   2HB   LYS  69          HB1       LYS  69 -15.258  14.800  -1.704
  564   1HG   LYS  69          HG2       LYS  69 -15.913  15.886   0.162
  565   2HG   LYS  69          HG1       LYS  69 -15.357  14.573   1.202
  566   1HD   LYS  69          HD2       LYS  69 -14.076  16.570   1.731
  567   2HD   LYS  69          HD1       LYS  69 -13.014  15.417   0.921
  568   1HE   LYS  69          HE2       LYS  69 -12.840  16.711  -0.985
  569   2HE   LYS  69          HE1       LYS  69 -14.477  17.375  -0.805
  570   1HZ   LYS  69          HZ1       LYS  69 -12.083  18.040   0.824
  571   2HZ   LYS  69          HZ2       LYS  69 -13.661  18.529   1.222
  572   3HZ   LYS  69          HZ3       LYS  69 -12.934  19.079  -0.211
  573    H    ALA  70           HN       ALA  70 -15.722  10.566  -1.344
  574    HA   ALA  70           HA       ALA  70 -16.981  11.290  -3.908
  575   1HB   ALA  70          HB1       ALA  70 -15.721   9.030  -2.628
  576   2HB   ALA  70          HB2       ALA  70 -16.072   9.269  -4.340
  577   3HB   ALA  70          HB3       ALA  70 -17.283   8.540  -3.284
  578    H    SER  71           HN       SER  71 -19.061   9.648  -4.241
  579    HA   SER  71           HA       SER  71 -20.942  10.255  -1.983
  580   1HB   SER  71          HB2       SER  71 -20.961  10.833  -4.881
  581   2HB   SER  71          HB1       SER  71 -22.480  10.197  -4.255
  582    HG   SER  71           HG       SER  71 -22.162  12.547  -4.135
  583    HA   PRO  72           HA       PRO  72 -22.154   6.037  -2.120
  584   1HB   PRO  72          HB2       PRO  72 -24.869   6.139  -1.832
  585   2HB   PRO  72          HB1       PRO  72 -23.739   6.480  -0.506
  586   1HG   PRO  72          HG2       PRO  72 -25.242   8.365  -2.243
  587   2HG   PRO  72          HG1       PRO  72 -24.886   8.461  -0.512
  588   1HD   PRO  72          HD2       PRO  72 -23.529   9.874  -2.404
  589   2HD   PRO  72          HD1       PRO  72 -22.817   9.377  -0.852
  590    H    ARG  73           HN       ARG  73 -24.008   4.561  -3.251
  591    HA   ARG  73           HA       ARG  73 -24.804   5.569  -5.910
  592   1HB   ARG  73          HB2       ARG  73 -22.291   4.655  -5.684
  593   2HB   ARG  73          HB1       ARG  73 -23.111   3.108  -5.898
  594   1HG   ARG  73          HG2       ARG  73 -23.629   3.539  -8.071
  595   2HG   ARG  73          HG1       ARG  73 -23.998   5.234  -7.745
  596   1HD   ARG  73          HD2       ARG  73 -21.369   5.400  -7.380
  597   2HD   ARG  73          HD1       ARG  73 -21.368   3.973  -8.436
  598    HE   ARG  73           HE       ARG  73 -22.707   5.331 -10.071
  599   1HH1  ARG  73          HH1       ARG  73 -22.594   7.348  -7.493
  600   2HH1  ARG  73          HH1       ARG  73 -21.825   8.678  -8.291
  601   1HH2  ARG  73          HH2       ARG  73 -21.025   6.854 -11.131
  602   2HH2  ARG  73          HH2       ARG  73 -20.936   8.399 -10.353
  Start of MODEL    7
    1   1H    VAL   1          HT1       VAL   1  -5.678  11.179   8.169
    2   2H    VAL   1          HT2       VAL   1  -6.811   9.970   7.801
    3   3H    VAL   1          HT3       VAL   1  -6.199  10.969   6.570
    4    HA   VAL   1           HA       VAL   1  -4.355   9.288   8.152
    5    HB   VAL   1           HB       VAL   1  -6.212   7.857   7.420
    6   1HG1  VAL   1          HG1       VAL   1  -7.351   8.365   5.549
    7   2HG1  VAL   1          HG1       VAL   1  -5.924   7.989   4.585
    8   3HG1  VAL   1          HG1       VAL   1  -6.184   9.631   5.172
    9   1HG2  VAL   1          HG2       VAL   1  -4.933   6.261   6.132
   10   2HG2  VAL   1          HG2       VAL   1  -3.815   7.076   7.225
   11   3HG2  VAL   1          HG2       VAL   1  -3.871   7.529   5.521
   12    H    VAL   2           HN       VAL   2  -2.713  10.839   7.631
   13    HA   VAL   2           HA       VAL   2  -1.992  10.913   4.722
   14    HB   VAL   2           HB       VAL   2  -3.079  13.018   5.389
   15   1HG1  VAL   2          HG1       VAL   2  -2.855  13.756   7.501
   16   2HG1  VAL   2          HG1       VAL   2  -1.153  14.098   7.187
   17   3HG1  VAL   2          HG1       VAL   2  -1.634  12.523   7.821
   18   1HG2  VAL   2          HG2       VAL   2  -0.645  14.358   5.334
   19   2HG2  VAL   2          HG2       VAL   2  -1.552  13.823   3.920
   20   3HG2  VAL   2          HG2       VAL   2  -0.270  12.810   4.579
   21    H    ILE   3           HN       ILE   3  -0.424   9.328   5.089
   22    HA   ILE   3           HA       ILE   3   1.586   9.419   7.154
   23    HB   ILE   3           HB       ILE   3   0.956   7.383   5.984
   24   1HG1  ILE   3          HG1       ILE   3   3.754   8.344   5.311
   25   2HG1  ILE   3          HG1       ILE   3   3.257   7.387   6.706
   26   1HG2  ILE   3          HG2       ILE   3   0.940   9.104   3.720
   27   2HG2  ILE   3          HG2       ILE   3   0.468   7.406   3.783
   28   3HG2  ILE   3          HG2       ILE   3   2.131   7.845   3.392
   29   1HD1  ILE   3          HD1       ILE   3   3.939   6.501   4.021
   30   2HD1  ILE   3          HD1       ILE   3   2.352   5.916   4.517
   31   3HD1  ILE   3          HD1       ILE   3   3.770   5.558   5.502
   32    HA   PRO   4           HA       PRO   4   4.219  12.531   5.436
   33   1HB   PRO   4          HB2       PRO   4   6.608  11.763   6.546
   34   2HB   PRO   4          HB1       PRO   4   5.331  12.590   7.460
   35   1HG   PRO   4          HG2       PRO   4   6.002   9.686   7.353
   36   2HG   PRO   4          HG1       PRO   4   5.545  10.688   8.741
   37   1HD   PRO   4          HD2       PRO   4   3.802   9.029   7.515
   38   2HD   PRO   4          HD1       PRO   4   3.295  10.554   8.270
   39    H    SER   5           HN       SER   5   6.725  10.050   5.588
   40    HA   SER   5           HA       SER   5   6.396   9.076   2.889
   41   1HB   SER   5          HB2       SER   5   7.341  11.703   3.180
   42   2HB   SER   5          HB1       SER   5   8.770  10.746   2.806
   43    HG   SER   5           HG       SER   5   7.569   9.875   1.029
   44    HA   PRO   6           HA       PRO   6   9.701   7.178   5.634
   45   1HB   PRO   6          HB2       PRO   6   8.364   4.947   6.444
   46   2HB   PRO   6          HB1       PRO   6   8.327   6.474   7.349
   47   1HG   PRO   6          HG2       PRO   6   6.298   5.302   5.535
   48   2HG   PRO   6          HG1       PRO   6   6.084   6.242   7.018
   49   1HD   PRO   6          HD2       PRO   6   5.791   7.249   4.473
   50   2HD   PRO   6          HD1       PRO   6   6.158   8.227   5.911
   51    H    CYS   7           HN       CYS   7  10.502   6.916   3.345
   52    HA   CYS   7           HA       CYS   7   9.574   4.898   1.561
   53   1HB   CYS   7          HB2       CYS   7  11.815   5.215   0.536
   54   2HB   CYS   7          HB1       CYS   7  11.073   6.756   0.967
   55    H    CYS   8           HN       CYS   8   9.903   2.707   1.503
   56    HA   CYS   8           HA       CYS   8  11.039   1.348   3.810
   57   1HB   CYS   8          HB2       CYS   8  10.347  -0.648   2.520
   58   2HB   CYS   8          HB1       CYS   8   9.078   0.575   2.505
   59    H    MET   9           HN       MET   9  12.243  -0.867   2.346
   60    HA   MET   9           HA       MET   9  14.769   0.432   1.378
   61   1HB   MET   9          HB2       MET   9  14.989  -0.513   3.622
   62   2HB   MET   9          HB1       MET   9  14.312  -2.045   3.072
   63   1HG   MET   9          HG2       MET   9  16.331  -2.738   2.361
   64   2HG   MET   9          HG1       MET   9  16.514  -1.295   1.365
   65   1HE   MET   9          HE1       MET   9  16.207  -2.596   4.737
   66   2HE   MET   9          HE2       MET   9  17.182  -1.601   5.814
   67   3HE   MET   9          HE3       MET   9  17.936  -2.920   4.921
   68    H    PHE  10           HN       PHE  10  13.347  -2.867   1.446
   69    HA   PHE  10           HA       PHE  10  14.245  -3.230  -1.378
   70   1HB   PHE  10          HB2       PHE  10  14.069  -5.600  -0.839
   71   2HB   PHE  10          HB1       PHE  10  14.924  -4.794   0.476
   72    HD1  PHE  10           HD1      PHE  10  13.978  -4.647   2.681
   73    HD2  PHE  10           HD2      PHE  10  11.656  -6.219  -0.576
   74    HE1  PHE  10           HE1      PHE  10  12.268  -5.444   4.288
   75    HE2  PHE  10           HE2      PHE  10   9.947  -7.015   1.032
   76    HZ   PHE  10           HZ       PHE  10  10.251  -6.629   3.463
   77    H    PHE  11           HN       PHE  11  12.610  -4.878  -2.549
   78    HA   PHE  11           HA       PHE  11   9.880  -3.675  -2.285
   79   1HB   PHE  11          HB2       PHE  11  11.694  -4.204  -4.483
   80   2HB   PHE  11          HB1       PHE  11  10.173  -5.053  -4.742
   81    HD1  PHE  11           HD1      PHE  11   8.297  -3.168  -3.328
   82    HD2  PHE  11           HD2      PHE  11  11.549  -2.427  -6.033
   83    HE1  PHE  11           HE1      PHE  11   7.234  -1.044  -4.024
   84    HE2  PHE  11           HE2      PHE  11  10.483  -0.303  -6.729
   85    HZ   PHE  11           HZ       PHE  11   8.325   0.392  -5.726
   86    H    VAL  12           HN       VAL  12   8.093  -5.086  -2.202
   87    HA   VAL  12           HA       VAL  12   8.293  -7.561  -0.918
   88    HB   VAL  12           HB       VAL  12   5.978  -7.907  -1.952
   89   1HG1  VAL  12          HG1       VAL  12   5.669  -6.840   0.027
   90   2HG1  VAL  12          HG1       VAL  12   5.325  -5.442  -0.991
   91   3HG1  VAL  12          HG1       VAL  12   6.934  -5.655  -0.303
   92   1HG2  VAL  12          HG2       VAL  12   5.121  -6.401  -3.507
   93   2HG2  VAL  12          HG2       VAL  12   6.809  -6.446  -4.015
   94   3HG2  VAL  12          HG2       VAL  12   6.223  -5.114  -3.022
   95    H    SER  13           HN       SER  13   8.453  -9.717  -1.632
   96    HA   SER  13           HA       SER  13   9.866 -10.283  -4.051
   97   1HB   SER  13          HB2       SER  13   8.161 -11.969  -2.192
   98   2HB   SER  13          HB1       SER  13   9.190 -12.646  -3.451
   99    HG   SER  13           HG       SER  13  10.007 -10.990  -1.289
  100    H    LYS  14           HN       LYS  14   6.467  -9.922  -3.328
  101    HA   LYS  14           HA       LYS  14   5.792 -10.053  -6.179
  102   1HB   LYS  14          HB2       LYS  14   4.234 -11.946  -5.881
  103   2HB   LYS  14          HB1       LYS  14   5.873 -12.426  -5.440
  104   1HG   LYS  14          HG2       LYS  14   5.329 -11.947  -3.050
  105   2HG   LYS  14          HG1       LYS  14   3.667 -11.601  -3.530
  106   1HD   LYS  14          HD2       LYS  14   5.106 -14.235  -3.975
  107   2HD   LYS  14          HD1       LYS  14   3.905 -13.929  -2.720
  108   1HE   LYS  14          HE2       LYS  14   2.539 -13.080  -4.930
  109   2HE   LYS  14          HE1       LYS  14   3.508 -14.399  -5.616
  110   1HZ   LYS  14          HZ1       LYS  14   1.353 -15.090  -4.539
  111   2HZ   LYS  14          HZ2       LYS  14   2.044 -14.650  -3.051
  112   3HZ   LYS  14          HZ3       LYS  14   2.739 -15.891  -3.980
  113    H    ARG  15           HN       ARG  15   2.969 -10.482  -5.702
  114    HA   ARG  15           HA       ARG  15   2.293  -7.825  -4.602
  115   1HB   ARG  15          HB2       ARG  15   0.085  -8.383  -5.597
  116   2HB   ARG  15          HB1       ARG  15   1.396  -8.625  -6.752
  117   1HG   ARG  15          HG2       ARG  15   0.932 -11.010  -5.155
  118   2HG   ARG  15          HG1       ARG  15  -0.523 -10.516  -6.021
  119   1HD   ARG  15          HD2       ARG  15   1.824 -10.265  -7.722
  120   2HD   ARG  15          HD1       ARG  15   1.639 -11.923  -7.116
  121    HE   ARG  15           HE       ARG  15  -0.942 -11.048  -7.844
  122   1HH1  ARG  15          HH2       ARG  15   0.316 -13.500  -8.990
  123   2HH1  ARG  15          HH2       ARG  15   0.455 -13.094 -10.668
  124   1HH2  ARG  15          HH1       ARG  15   0.015  -9.692 -10.156
  125   2HH2  ARG  15          HH1       ARG  15   0.285 -10.938 -11.328
  126    H    ILE  16           HN       ILE  16  -0.365  -8.504  -3.729
  127    HA   ILE  16           HA       ILE  16   0.054 -10.380  -1.447
  128    HB   ILE  16           HB       ILE  16  -1.313  -7.835  -0.765
  129   1HG1  ILE  16          HG1       ILE  16   1.664  -7.881  -1.371
  130   2HG1  ILE  16          HG1       ILE  16   0.450  -6.863  -2.138
  131   1HG2  ILE  16          HG2       ILE  16   0.825  -8.425   0.977
  132   2HG2  ILE  16          HG2       ILE  16   0.158  -9.977   0.484
  133   3HG2  ILE  16          HG2       ILE  16  -0.886  -8.766   1.229
  134   1HD1  ILE  16          HD1       ILE  16   0.062  -5.655  -0.083
  135   2HD1  ILE  16          HD1       ILE  16   1.803  -5.690  -0.358
  136   3HD1  ILE  16          HD1       ILE  16   1.076  -6.774   0.827
  137    HA   PRO  17           HA       PRO  17  -4.233 -11.075  -2.281
  138   1HB   PRO  17          HB2       PRO  17  -4.968 -12.323   0.028
  139   2HB   PRO  17          HB1       PRO  17  -3.923 -13.081  -1.189
  140   1HG   PRO  17          HG2       PRO  17  -3.256 -12.090   1.463
  141   2HG   PRO  17          HG1       PRO  17  -2.346 -13.169   0.401
  142   1HD   PRO  17          HD2       PRO  17  -1.958 -10.349   0.868
  143   2HD   PRO  17          HD1       PRO  17  -0.960 -11.462  -0.093
  144    H    GLU  18           HN       GLU  18  -5.659  -9.347  -2.310
  145    HA   GLU  18           HA       GLU  18  -5.911  -7.218  -0.557
  146   1HB   GLU  18          HB2       GLU  18  -7.024  -7.639  -2.790
  147   2HB   GLU  18          HB1       GLU  18  -8.216  -8.621  -1.937
  148   1HG   GLU  18          HG2       GLU  18  -7.623  -5.795  -1.064
  149   2HG   GLU  18          HG1       GLU  18  -8.784  -6.125  -2.352
  150    H    ASN  19           HN       ASN  19  -7.322 -10.450  -0.149
  151    HA   ASN  19           HA       ASN  19  -9.148  -9.851   1.959
  152   1HB   ASN  19          HB2       ASN  19  -8.875 -12.298   2.431
  153   2HB   ASN  19          HB1       ASN  19  -9.120 -11.952   0.718
  154   1HD2  ASN  19          HD2       ASN  19  -7.862 -13.539  -0.315
  155   2HD2  ASN  19          HD2       ASN  19  -6.216 -13.805  -0.002
  156    H    ARG  20           HN       ARG  20  -5.685  -9.890   1.940
  157    HA   ARG  20           HA       ARG  20  -5.592 -10.068   4.923
  158   1HB   ARG  20          HB2       ARG  20  -3.633 -10.474   2.662
  159   2HB   ARG  20          HB1       ARG  20  -3.086 -10.304   4.327
  160   1HG   ARG  20          HG2       ARG  20  -5.204 -12.133   4.456
  161   2HG   ARG  20          HG1       ARG  20  -4.284 -12.602   3.024
  162   1HD   ARG  20          HD2       ARG  20  -2.348 -13.060   4.250
  163   2HD   ARG  20          HD1       ARG  20  -2.805 -11.963   5.568
  164    HE   ARG  20           HE       ARG  20  -4.731 -13.675   5.953
  165   1HH1  ARG  20          HH2       ARG  20  -2.181 -14.460   7.275
  166   2HH1  ARG  20          HH2       ARG  20  -1.941 -16.075   6.694
  167   1HH2  ARG  20          HH1       ARG  20  -4.183 -15.749   4.070
  168   2HH2  ARG  20          HH1       ARG  20  -3.074 -16.804   4.881
  169    H    VAL  21           HN       VAL  21  -4.632  -8.086   2.153
  170    HA   VAL  21           HA       VAL  21  -3.214  -6.072   3.657
  171    HB   VAL  21           HB       VAL  21  -4.662  -5.862   0.998
  172   1HG1  VAL  21          HG1       VAL  21  -2.954  -4.167   0.514
  173   2HG1  VAL  21          HG1       VAL  21  -2.230  -4.420   2.102
  174   3HG1  VAL  21          HG1       VAL  21  -3.847  -3.727   1.969
  175   1HG2  VAL  21          HG2       VAL  21  -2.501  -7.569   1.794
  176   2HG2  VAL  21          HG2       VAL  21  -1.856  -6.328   0.720
  177   3HG2  VAL  21          HG2       VAL  21  -3.184  -7.355   0.183
  178    H    VAL  22           HN       VAL  22  -3.971  -3.921   4.206
  179    HA   VAL  22           HA       VAL  22  -6.942  -3.658   4.378
  180    HB   VAL  22           HB       VAL  22  -6.428  -2.551   6.588
  181   1HG1  VAL  22          HG1       VAL  22  -7.247  -4.713   6.827
  182   2HG1  VAL  22          HG1       VAL  22  -5.693  -4.821   7.654
  183   3HG1  VAL  22          HG1       VAL  22  -5.860  -5.429   6.006
  184   1HG2  VAL  22          HG2       VAL  22  -4.066  -2.013   6.174
  185   2HG2  VAL  22          HG2       VAL  22  -3.687  -3.735   6.087
  186   3HG2  VAL  22          HG2       VAL  22  -4.228  -3.025   7.605
  187    H    SER  23           HN       SER  23  -3.816  -1.983   4.274
  188    HA   SER  23           HA       SER  23  -4.877   0.178   2.646
  189   1HB   SER  23          HB2       SER  23  -5.871   0.616   4.879
  190   2HB   SER  23          HB1       SER  23  -4.258   0.639   5.581
  191    HG   SER  23           HG       SER  23  -5.537   2.492   3.926
  192    H    TYR  24           HN       TYR  24  -3.117   1.568   1.924
  193    HA   TYR  24           HA       TYR  24  -0.457   0.409   2.482
  194   1HB   TYR  24          HB2       TYR  24   0.127   1.428   0.375
  195   2HB   TYR  24          HB1       TYR  24  -1.414   0.606   0.190
  196    HD1  TYR  24           HD1      TYR  24  -3.455   1.831  -0.215
  197    HD2  TYR  24           HD2      TYR  24   0.213   3.915   0.590
  198    HE1  TYR  24           HE1      TYR  24  -4.512   3.959  -0.921
  199    HE2  TYR  24           HE2      TYR  24  -0.843   6.043  -0.118
  200    HH   TYR  24           HH       TYR  24  -2.697   6.808  -1.489
  201    H    GLN  25           HN       GLN  25   1.301   2.176   2.041
  202    HA   GLN  25           HA       GLN  25   0.782   4.683   3.566
  203   1HB   GLN  25          HB2       GLN  25   2.522   2.339   4.196
  204   2HB   GLN  25          HB1       GLN  25   3.224   3.927   4.490
  205   1HG   GLN  25          HG2       GLN  25   2.158   3.699   6.506
  206   2HG   GLN  25          HG1       GLN  25   0.777   4.300   5.587
  207   1HE2  GLN  25          HE2       GLN  25  -0.569   3.004   7.174
  208   2HE2  GLN  25          HE2       GLN  25  -0.762   1.338   6.908
  209    H    LEU  26           HN       LEU  26   0.998   5.746   1.475
  210    HA   LEU  26           HA       LEU  26   3.057   5.215  -0.405
  211   1HB   LEU  26          HB2       LEU  26   1.015   7.239   0.153
  212   2HB   LEU  26          HB1       LEU  26   2.422   7.898  -0.680
  213    HG   LEU  26           HG       LEU  26   0.779   5.508  -1.570
  214   1HD1  LEU  26          HD1       LEU  26  -0.449   7.458  -2.104
  215   2HD1  LEU  26          HD1       LEU  26   0.452   7.102  -3.579
  216   3HD1  LEU  26          HD1       LEU  26   1.008   8.373  -2.490
  217   1HD2  LEU  26          HD2       LEU  26   3.372   6.709  -2.522
  218   2HD2  LEU  26          HD2       LEU  26   2.291   5.926  -3.676
  219   3HD2  LEU  26          HD2       LEU  26   2.946   5.010  -2.320
  220    H    SER  27           HN       SER  27   4.991   6.370  -0.870
  221    HA   SER  27           HA       SER  27   6.084   8.206   1.179
  222   1HB   SER  27          HB2       SER  27   6.483   5.695   1.710
  223   2HB   SER  27          HB1       SER  27   7.600   5.731   0.348
  224    HG   SER  27           HG       SER  27   8.611   7.540   1.432
  225    H    SER  28           HN       SER  28   5.359   8.720  -1.530
  226    HA   SER  28           HA       SER  28   7.694   8.497  -3.266
  227   1HB   SER  28          HB2       SER  28   5.005   8.835  -3.579
  228   2HB   SER  28          HB1       SER  28   5.571  10.484  -3.826
  229    HG   SER  28           HG       SER  28   5.848   8.265  -5.398
  230    H    ARG  29           HN       ARG  29   8.977   9.626  -1.296
  231    HA   ARG  29           HA       ARG  29   8.750  12.584  -1.402
  232   1HB   ARG  29          HB2       ARG  29   9.307  10.752   0.571
  233   2HB   ARG  29          HB1       ARG  29  10.924  11.305   0.131
  234   1HG   ARG  29          HG2       ARG  29   9.989  12.726   1.909
  235   2HG   ARG  29          HG1       ARG  29  10.192  13.652   0.422
  236   1HD   ARG  29          HD2       ARG  29   7.617  12.539   0.219
  237   2HD   ARG  29          HD1       ARG  29   7.750  13.107   1.895
  238    HE   ARG  29           HE       ARG  29   8.873  15.168   0.442
  239   1HH1  ARG  29          HH1       ARG  29   7.090  14.276  -1.812
  240   2HH1  ARG  29          HH1       ARG  29   5.660  15.211  -1.526
  241   1HH2  ARG  29          HH2       ARG  29   6.516  16.013   1.738
  242   2HH2  ARG  29          HH2       ARG  29   5.335  16.193   0.484
  243    H    SER  30           HN       SER  30  11.583  13.026  -0.908
  244    HA   SER  30           HA       SER  30  12.867  12.113  -3.446
  245   1HB   SER  30          HB2       SER  30  11.770  14.718  -2.814
  246   2HB   SER  30          HB1       SER  30  13.502  14.840  -3.103
  247    HG   SER  30           HG       SER  30  11.433  14.152  -4.817
  248    H    THR  31           HN       THR  31  13.467  11.251  -0.790
  249    HA   THR  31           HA       THR  31  16.224  12.364  -0.512
  250    HB   THR  31           HB       THR  31  14.836  13.553   1.084
  251    HG1  THR  31           HG1      THR  31  16.893  12.522   1.755
  252   1HG2  THR  31          HG2       THR  31  12.940  12.592   1.811
  253   2HG2  THR  31          HG2       THR  31  13.909  11.512   2.813
  254   3HG2  THR  31          HG2       THR  31  13.455  11.028   1.178
  255    H    CYS  32           HN       CYS  32  14.570   9.687  -1.205
  256    HA   CYS  32           HA       CYS  32  16.239   7.900   0.531
  257   1HB   CYS  32          HB2       CYS  32  13.530   7.992   0.233
  258   2HB   CYS  32          HB1       CYS  32  13.951   6.818  -1.014
  259    H    LEU  33           HN       LEU  33  15.857   5.588  -1.127
  260    HA   LEU  33           HA       LEU  33  17.758   6.250  -3.299
  261   1HB   LEU  33          HB2       LEU  33  17.477   4.208  -1.418
  262   2HB   LEU  33          HB1       LEU  33  17.008   3.455  -2.944
  263    HG   LEU  33           HG       LEU  33  19.433   3.237  -2.582
  264   1HD1  LEU  33          HD1       LEU  33  20.168   4.163  -4.723
  265   2HD1  LEU  33          HD1       LEU  33  18.791   5.264  -4.745
  266   3HD1  LEU  33          HD1       LEU  33  18.533   3.524  -4.889
  267   1HD2  LEU  33          HD2       LEU  33  20.861   5.089  -2.256
  268   2HD2  LEU  33          HD2       LEU  33  19.470   5.460  -1.239
  269   3HD2  LEU  33          HD2       LEU  33  19.644   6.237  -2.813
  270    H    LYS  34           HN       LYS  34  14.491   4.993  -2.824
  271    HA   LYS  34           HA       LYS  34  14.003   5.334  -5.743
  272   1HB   LYS  34          HB2       LYS  34  13.957   2.818  -4.122
  273   2HB   LYS  34          HB1       LYS  34  12.749   3.000  -5.397
  274   1HG   LYS  34          HG2       LYS  34  14.949   3.812  -6.744
  275   2HG   LYS  34          HG1       LYS  34  15.696   2.681  -5.612
  276   1HD   LYS  34          HD2       LYS  34  14.239   0.892  -6.333
  277   2HD   LYS  34          HD1       LYS  34  13.290   2.002  -7.323
  278   1HE   LYS  34          HE2       LYS  34  14.925   0.684  -8.687
  279   2HE   LYS  34          HE1       LYS  34  15.264   2.426  -8.754
  280   1HZ   LYS  34          HZ1       LYS  34  16.937   2.228  -7.135
  281   2HZ   LYS  34          HZ2       LYS  34  17.218   0.938  -8.206
  282   3HZ   LYS  34          HZ3       LYS  34  16.468   0.656  -6.707
  283    H    ALA  35           HN       ALA  35  11.481   4.692  -6.049
  284    HA   ALA  35           HA       ALA  35   9.966   5.919  -3.770
  285   1HB   ALA  35          HB1       ALA  35   9.731   7.647  -5.228
  286   2HB   ALA  35          HB2       ALA  35   8.613   6.594  -6.091
  287   3HB   ALA  35          HB3       ALA  35  10.303   6.678  -6.586
  288    H    GLY  36           HN       GLY  36   8.592   4.373  -3.000
  289   1HA   GLY  36          HA2       GLY  36   6.933   2.859  -4.930
  290   2HA   GLY  36          HA1       GLY  36   7.886   1.916  -3.781
  291    H    VAL  37           HN       VAL  37   5.313   1.425  -3.385
  292    HA   VAL  37           HA       VAL  37   4.358   3.392  -1.326
  293    HB   VAL  37           HB       VAL  37   2.877   1.129  -2.703
  294   1HG1  VAL  37          HG1       VAL  37   1.462   1.700  -1.002
  295   2HG1  VAL  37          HG1       VAL  37   1.044   3.034  -2.076
  296   3HG1  VAL  37          HG1       VAL  37   2.209   3.281  -0.774
  297   1HG2  VAL  37          HG2       VAL  37   1.968   3.563  -3.741
  298   2HG2  VAL  37          HG2       VAL  37   2.978   2.389  -4.585
  299   3HG2  VAL  37          HG2       VAL  37   3.724   3.733  -3.722
  300    H    ILE  38           HN       ILE  38   3.200   2.232   0.561
  301    HA   ILE  38           HA       ILE  38   4.623  -0.325   1.223
  302    HB   ILE  38           HB       ILE  38   3.989   2.154   2.841
  303   1HG1  ILE  38          HG1       ILE  38   6.445   1.739   3.480
  304   2HG1  ILE  38          HG1       ILE  38   6.465   0.549   2.179
  305   1HG2  ILE  38          HG2       ILE  38   4.433  -0.667   3.788
  306   2HG2  ILE  38          HG2       ILE  38   3.306   0.544   4.399
  307   3HG2  ILE  38          HG2       ILE  38   5.028   0.683   4.755
  308   1HD1  ILE  38          HD1       ILE  38   6.662   2.164   0.624
  309   2HD1  ILE  38          HD1       ILE  38   6.865   3.325   1.936
  310   3HD1  ILE  38          HD1       ILE  38   5.263   3.021   1.266
  311    H    PHE  39           HN       PHE  39   3.258  -1.978   2.032
  312    HA   PHE  39           HA       PHE  39   0.373  -1.234   2.360
  313   1HB   PHE  39          HB2       PHE  39   1.734  -3.374   0.762
  314   2HB   PHE  39          HB1       PHE  39   0.106  -3.655   1.369
  315    HD1  PHE  39           HD1      PHE  39  -1.774  -2.649   0.343
  316    HD2  PHE  39           HD2      PHE  39   2.178  -1.271  -0.613
  317    HE1  PHE  39           HE1      PHE  39  -2.703  -1.255  -1.480
  318    HE2  PHE  39           HE2      PHE  39   1.246   0.124  -2.439
  319    HZ   PHE  39           HZ       PHE  39  -1.197   0.130  -2.872
  320    H    THR  40           HN       THR  40  -0.481  -1.909   4.273
  321    HA   THR  40           HA       THR  40   1.128  -3.741   5.967
  322    HB   THR  40           HB       THR  40  -1.162  -1.822   6.478
  323    HG1  THR  40           HG1      THR  40   0.558  -0.816   7.713
  324   1HG2  THR  40          HG2       THR  40  -0.962  -2.338   8.827
  325   2HG2  THR  40          HG2       THR  40   0.416  -3.398   8.527
  326   3HG2  THR  40          HG2       THR  40  -1.191  -3.862   7.971
  327    H    THR  41           HN       THR  41   0.205  -5.637   6.828
  328    HA   THR  41           HA       THR  41  -2.145  -6.682   5.374
  329    HB   THR  41           HB       THR  41  -0.639  -8.259   7.408
  330    HG1  THR  41           HG1      THR  41   0.452  -7.464   4.914
  331   1HG2  THR  41          HG2       THR  41  -1.142  -8.999   4.544
  332   2HG2  THR  41          HG2       THR  41  -2.476  -9.005   5.697
  333   3HG2  THR  41          HG2       THR  41  -1.073 -10.038   5.966
  334    H    LYS  42           HN       LYS  42  -3.780  -7.927   6.728
  335    HA   LYS  42           HA       LYS  42  -4.815  -6.257   8.849
  336   1HB   LYS  42          HB2       LYS  42  -5.671  -8.307   7.123
  337   2HB   LYS  42          HB1       LYS  42  -5.879  -8.957   8.751
  338   1HG   LYS  42          HG2       LYS  42  -6.785  -6.337   8.977
  339   2HG   LYS  42          HG1       LYS  42  -7.378  -6.844   7.396
  340   1HD   LYS  42          HD2       LYS  42  -7.999  -9.057   8.773
  341   2HD   LYS  42          HD1       LYS  42  -8.058  -7.896  10.103
  342   1HE   LYS  42          HE2       LYS  42  -9.440  -7.208   7.520
  343   2HE   LYS  42          HE1       LYS  42 -10.230  -8.311   8.662
  344   1HZ   LYS  42          HZ1       LYS  42  -9.313  -5.539   9.125
  345   2HZ   LYS  42          HZ2       LYS  42  -9.560  -6.614  10.418
  346   3HZ   LYS  42          HZ3       LYS  42 -10.852  -6.198   9.396
  347    H    LYS  43           HN       LYS  43  -2.941  -9.253   8.767
  348    HA   LYS  43           HA       LYS  43  -3.246 -10.065  11.472
  349   1HB   LYS  43          HB2       LYS  43  -1.704 -10.700   9.165
  350   2HB   LYS  43          HB1       LYS  43  -0.582 -10.533  10.514
  351   1HG   LYS  43          HG2       LYS  43  -2.784 -11.947  11.550
  352   2HG   LYS  43          HG1       LYS  43  -2.468 -12.663   9.969
  353   1HD   LYS  43          HD2       LYS  43   0.055 -12.219  11.210
  354   2HD   LYS  43          HD1       LYS  43  -0.985 -12.998  12.403
  355   1HE   LYS  43          HE2       LYS  43  -1.524 -14.365  10.010
  356   2HE   LYS  43          HE1       LYS  43   0.239 -14.156  10.034
  357   1HZ   LYS  43          HZ1       LYS  43   0.363 -15.057  12.204
  358   2HZ   LYS  43          HZ2       LYS  43  -0.610 -16.125  11.312
  359   3HZ   LYS  43          HZ3       LYS  43  -1.322 -15.032  12.399
  360    H    GLY  44           HN       GLY  44  -0.487  -8.277  10.077
  361   1HA   GLY  44          HA2       GLY  44  -0.286  -6.098  11.706
  362   2HA   GLY  44          HA1       GLY  44   0.337  -7.382  12.742
  363    H    GLN  45           HN       GLN  45   0.735  -7.044   9.219
  364    HA   GLN  45           HA       GLN  45   3.697  -6.902   9.691
  365   1HB   GLN  45          HB2       GLN  45   2.191  -8.841   8.439
  366   2HB   GLN  45          HB1       GLN  45   2.697  -7.835   7.080
  367   1HG   GLN  45          HG2       GLN  45   5.055  -7.989   7.908
  368   2HG   GLN  45          HG1       GLN  45   4.504  -9.114   9.151
  369   1HE2  GLN  45          HE2       GLN  45   6.094 -10.611   7.920
  370   2HE2  GLN  45          HE2       GLN  45   5.475 -11.470   6.593
  371    H    GLN  46           HN       GLN  46   4.807  -5.893   7.640
  372    HA   GLN  46           HA       GLN  46   3.169  -3.878   6.236
  373   1HB   GLN  46          HB2       GLN  46   4.531  -3.368   8.707
  374   2HB   GLN  46          HB1       GLN  46   5.341  -2.458   7.428
  375   1HG   GLN  46          HG2       GLN  46   2.936  -1.784   6.697
  376   2HG   GLN  46          HG1       GLN  46   2.466  -2.305   8.314
  377   1HE2  GLN  46          HE2       GLN  46   2.896   0.488   6.877
  378   2HE2  GLN  46          HE2       GLN  46   3.760   1.366   8.044
  379    H    SER  47           HN       SER  47   3.948  -4.657   4.247
  380    HA   SER  47           HA       SER  47   6.912  -4.717   3.853
  381   1HB   SER  47          HB2       SER  47   5.309  -6.687   3.374
  382   2HB   SER  47          HB1       SER  47   4.756  -5.739   1.997
  383    HG   SER  47           HG       SER  47   6.741  -7.318   1.958
  384    H    CYS  48           HN       CYS  48   7.312  -4.165   1.311
  385    HA   CYS  48           HA       CYS  48   6.135  -1.442   0.913
  386   1HB   CYS  48          HB2       CYS  48   8.678  -2.054   1.223
  387   2HB   CYS  48          HB1       CYS  48   8.572  -2.530  -0.472
  388    H    GLY  49           HN       GLY  49   4.699  -1.242  -0.786
  389   1HA   GLY  49          HA2       GLY  49   4.669  -3.407  -2.831
  390   2HA   GLY  49          HA1       GLY  49   3.333  -2.310  -2.500
  391    H    ASP  50           HN       ASP  50   4.953  -2.928  -4.982
  392    HA   ASP  50           HA       ASP  50   6.200  -0.314  -5.585
  393   1HB   ASP  50          HB2       ASP  50   7.093  -2.623  -6.220
  394   2HB   ASP  50          HB1       ASP  50   5.765  -2.723  -7.376
  395    HA   PRO  51           HA       PRO  51   2.359   1.218  -7.236
  396   1HB   PRO  51          HB2       PRO  51   3.389   3.312  -8.683
  397   2HB   PRO  51          HB1       PRO  51   3.179   3.357  -6.920
  398   1HG   PRO  51          HG2       PRO  51   5.636   2.764  -8.514
  399   2HG   PRO  51          HG1       PRO  51   5.448   3.784  -7.077
  400   1HD   PRO  51          HD2       PRO  51   6.440   1.301  -6.896
  401   2HD   PRO  51          HD1       PRO  51   5.386   1.973  -5.632
  402    H    LYS  52           HN       LYS  52   5.111   0.233  -9.142
  403    HA   LYS  52           HA       LYS  52   3.860   0.441 -11.749
  404   1HB   LYS  52          HB2       LYS  52   6.325  -0.490 -10.507
  405   2HB   LYS  52          HB1       LYS  52   5.799  -1.592 -11.779
  406   1HG   LYS  52          HG2       LYS  52   5.429   0.582 -13.174
  407   2HG   LYS  52          HG1       LYS  52   6.491   1.331 -11.981
  408   1HD   LYS  52          HD2       LYS  52   8.315   0.382 -12.902
  409   2HD   LYS  52          HD1       LYS  52   7.568  -1.215 -12.867
  410   1HE   LYS  52          HE2       LYS  52   6.209  -0.399 -14.930
  411   2HE   LYS  52          HE1       LYS  52   7.447   0.865 -15.053
  412   1HZ   LYS  52          HZ1       LYS  52   7.850  -2.074 -15.052
  413   2HZ   LYS  52          HZ2       LYS  52   9.120  -0.973 -14.802
  414   3HZ   LYS  52          HZ3       LYS  52   8.265  -0.972 -16.272
  415    H    GLN  53           HN       GLN  53   3.785  -1.896  -9.144
  416    HA   GLN  53           HA       GLN  53   2.829  -4.155 -10.676
  417   1HB   GLN  53          HB2       GLN  53   3.005  -3.305  -7.805
  418   2HB   GLN  53          HB1       GLN  53   2.021  -4.712  -8.211
  419   1HG   GLN  53          HG2       GLN  53   4.855  -4.420  -9.209
  420   2HG   GLN  53          HG1       GLN  53   4.491  -5.158  -7.648
  421   1HE2  GLN  53          HE2       GLN  53   5.669  -6.755  -9.653
  422   2HE2  GLN  53          HE2       GLN  53   4.528  -7.876 -10.221
  423    H    GLU  54           HN       GLU  54   0.573  -5.049 -10.355
  424    HA   GLU  54           HA       GLU  54  -1.403  -2.896 -10.813
  425   1HB   GLU  54          HB2       GLU  54  -2.777  -4.779 -11.579
  426   2HB   GLU  54          HB1       GLU  54  -1.162  -4.892 -12.280
  427   1HG   GLU  54          HG2       GLU  54  -0.857  -6.276  -9.921
  428   2HG   GLU  54          HG1       GLU  54  -2.509  -6.690 -10.379
  429    H    TRP  55           HN       TRP  55  -0.524  -5.109  -8.229
  430    HA   TRP  55           HA       TRP  55  -3.156  -5.000  -6.969
  431   1HB   TRP  55          HB2       TRP  55  -2.045  -6.241  -5.196
  432   2HB   TRP  55          HB1       TRP  55  -1.590  -6.900  -6.757
  433    HD1  TRP  55           HD1      TRP  55   0.915  -6.573  -7.555
  434    HE1  TRP  55           HE1      TRP  55   3.065  -6.000  -6.240
  435    HE3  TRP  55           HE3      TRP  55  -1.125  -4.781  -3.238
  436    HZ2  TRP  55           HZ2      TRP  55   3.803  -4.957  -3.723
  437    HZ3  TRP  55           HZ3      TRP  55   0.328  -4.009  -1.394
  438    HH2  TRP  55           HH2      TRP  55   2.795  -4.081  -1.628
  439    H    VAL  56           HN       VAL  56  -0.152  -3.125  -6.751
  440    HA   VAL  56           HA       VAL  56  -0.982  -1.668  -4.362
  441    HB   VAL  56           HB       VAL  56   0.905  -0.963  -6.651
  442   1HG1  VAL  56          HG1       VAL  56   1.660   0.385  -4.309
  443   2HG1  VAL  56          HG1       VAL  56  -0.092   0.560  -4.372
  444   3HG1  VAL  56          HG1       VAL  56   0.895   1.105  -5.726
  445   1HG2  VAL  56          HG2       VAL  56   2.664  -1.595  -5.030
  446   2HG2  VAL  56          HG2       VAL  56   1.593  -2.953  -5.371
  447   3HG2  VAL  56          HG2       VAL  56   1.421  -2.051  -3.865
  448    H    GLN  57           HN       GLN  57  -0.992  -1.024  -7.870
  449    HA   GLN  57           HA       GLN  57  -2.496   1.399  -7.835
  450   1HB   GLN  57          HB2       GLN  57  -1.291  -0.335  -9.666
  451   2HB   GLN  57          HB1       GLN  57  -3.002  -0.426 -10.083
  452   1HG   GLN  57          HG2       GLN  57  -1.471   2.168  -9.736
  453   2HG   GLN  57          HG1       GLN  57  -1.794   1.405 -11.293
  454   1HE2  GLN  57          HE2       GLN  57  -2.886   3.859 -11.159
  455   2HE2  GLN  57          HE2       GLN  57  -4.553   3.806 -10.843
  456    H    ARG  58           HN       ARG  58  -3.526  -2.016  -8.160
  457    HA   ARG  58           HA       ARG  58  -6.325  -1.592  -8.394
  458   1HB   ARG  58          HB2       ARG  58  -5.231  -3.743  -8.763
  459   2HB   ARG  58          HB1       ARG  58  -4.683  -3.788  -7.085
  460   1HG   ARG  58          HG2       ARG  58  -7.031  -3.843  -6.322
  461   2HG   ARG  58          HG1       ARG  58  -7.575  -3.815  -8.001
  462   1HD   ARG  58          HD2       ARG  58  -5.755  -5.969  -6.870
  463   2HD   ARG  58          HD1       ARG  58  -7.516  -6.137  -7.018
  464    HE   ARG  58           HE       ARG  58  -6.581  -5.233  -9.523
  465   1HH1  ARG  58          HH1       ARG  58  -5.064  -7.596  -7.699
  466   2HH1  ARG  58          HH1       ARG  58  -5.289  -8.878  -8.843
  467   1HH2  ARG  58          HH2       ARG  58  -7.381  -7.031 -10.902
  468   2HH2  ARG  58          HH2       ARG  58  -6.602  -8.559 -10.656
  469    H    TYR  59           HN       TYR  59  -4.470  -2.418  -5.434
  470    HA   TYR  59           HA       TYR  59  -6.533  -1.959  -3.540
  471   1HB   TYR  59          HB2       TYR  59  -3.521  -1.558  -3.434
  472   2HB   TYR  59          HB1       TYR  59  -4.550  -1.571  -2.009
  473    HD1  TYR  59           HD1      TYR  59  -2.692  -3.422  -1.550
  474    HD2  TYR  59           HD2      TYR  59  -5.932  -3.870  -4.344
  475    HE1  TYR  59           HE1      TYR  59  -2.475  -5.885  -1.398
  476    HE2  TYR  59           HE2      TYR  59  -5.706  -6.335  -4.185
  477    HH   TYR  59           HH       TYR  59  -3.428  -7.933  -3.426
  478    H    MET  60           HN       MET  60  -4.053   0.207  -4.826
  479    HA   MET  60           HA       MET  60  -4.738   2.594  -3.428
  480   1HB   MET  60          HB2       MET  60  -3.417   1.910  -6.058
  481   2HB   MET  60          HB1       MET  60  -3.545   3.577  -5.499
  482   1HG   MET  60          HG2       MET  60  -2.502   1.509  -3.599
  483   2HG   MET  60          HG1       MET  60  -1.429   2.106  -4.865
  484   1HE   MET  60          HE1       MET  60  -1.221   4.307  -5.514
  485   2HE   MET  60          HE2       MET  60  -0.974   5.673  -4.427
  486   3HE   MET  60          HE3       MET  60  -2.584   5.340  -5.063
  487    H    LYS  61           HN       LYS  61  -6.134   1.022  -6.247
  488    HA   LYS  61           HA       LYS  61  -7.636   3.304  -7.219
  489   1HB   LYS  61          HB2       LYS  61  -6.938   1.061  -8.347
  490   2HB   LYS  61          HB1       LYS  61  -8.369   0.395  -7.558
  491   1HG   LYS  61          HG2       LYS  61  -9.642   1.230  -9.211
  492   2HG   LYS  61          HG1       LYS  61  -9.148   2.857  -8.741
  493   1HD   LYS  61          HD2       LYS  61  -7.303   2.844 -10.248
  494   2HD   LYS  61          HD1       LYS  61  -7.429   1.102 -10.502
  495   1HE   LYS  61          HE2       LYS  61  -9.331   1.309 -11.869
  496   2HE   LYS  61          HE1       LYS  61  -9.738   2.909 -11.220
  497   1HZ   LYS  61          HZ1       LYS  61  -8.561   2.802 -13.483
  498   2HZ   LYS  61          HZ2       LYS  61  -7.163   2.432 -12.587
  499   3HZ   LYS  61          HZ3       LYS  61  -7.977   3.904 -12.334
  500    H    ASN  62           HN       ASN  62  -8.504   0.436  -5.244
  501    HA   ASN  62           HA       ASN  62 -11.205   1.386  -4.710
  502   1HB   ASN  62          HB2       ASN  62  -9.430  -0.879  -4.086
  503   2HB   ASN  62          HB1       ASN  62 -10.535  -0.476  -2.771
  504   1HD2  ASN  62          HD2       ASN  62 -12.876   0.227  -3.957
  505   2HD2  ASN  62          HD2       ASN  62 -13.456  -0.999  -4.977
  506    H    LEU  63           HN       LEU  63  -8.053   1.719  -3.211
  507    HA   LEU  63           HA       LEU  63  -8.971   2.683  -0.636
  508   1HB   LEU  63          HB2       LEU  63  -6.427   2.566  -2.224
  509   2HB   LEU  63          HB1       LEU  63  -6.474   3.571  -0.771
  510    HG   LEU  63           HG       LEU  63  -7.618   0.848  -0.497
  511   1HD1  LEU  63          HD1       LEU  63  -5.819  -0.219  -1.339
  512   2HD1  LEU  63          HD1       LEU  63  -4.887   0.471  -0.010
  513   3HD1  LEU  63          HD1       LEU  63  -4.950   1.298  -1.567
  514   1HD2  LEU  63          HD2       LEU  63  -5.590   1.588   1.405
  515   2HD2  LEU  63          HD2       LEU  63  -7.326   1.418   1.663
  516   3HD2  LEU  63          HD2       LEU  63  -6.660   2.965   1.142
  517    H    ASP  64           HN       ASP  64  -7.825   4.253  -3.618
  518    HA   ASP  64           HA       ASP  64  -7.988   6.956  -2.692
  519   1HB   ASP  64          HB2       ASP  64  -7.898   5.478  -5.289
  520   2HB   ASP  64          HB1       ASP  64  -8.384   7.173  -5.343
  521    H    ALA  65           HN       ALA  65 -10.399   4.693  -3.879
  522    HA   ALA  65           HA       ALA  65 -12.466   6.739  -4.276
  523   1HB   ALA  65          HB1       ALA  65 -12.876   3.763  -4.019
  524   2HB   ALA  65          HB2       ALA  65 -12.084   4.438  -5.443
  525   3HB   ALA  65          HB3       ALA  65 -13.738   4.906  -5.048
  526    H    LYS  66           HN       LYS  66 -11.163   5.139  -1.560
  527    HA   LYS  66           HA       LYS  66 -13.329   4.519   0.100
  528   1HB   LYS  66          HB2       LYS  66 -10.887   4.233   0.551
  529   2HB   LYS  66          HB1       LYS  66 -10.764   5.970   0.825
  530   1HG   LYS  66          HG2       LYS  66 -11.107   5.293   3.000
  531   2HG   LYS  66          HG1       LYS  66 -12.790   5.455   2.497
  532   1HD   LYS  66          HD2       LYS  66 -13.013   3.112   2.124
  533   2HD   LYS  66          HD1       LYS  66 -11.268   2.862   2.204
  534   1HE   LYS  66          HE2       LYS  66 -11.595   3.918   4.643
  535   2HE   LYS  66          HE1       LYS  66 -13.222   3.244   4.431
  536   1HZ   LYS  66          HZ1       LYS  66 -10.633   1.819   4.177
  537   2HZ   LYS  66          HZ2       LYS  66 -12.107   1.168   3.640
  538   3HZ   LYS  66          HZ3       LYS  66 -11.876   1.508   5.290
  539    H    GLN  67           HN       GLN  67 -12.145   7.682  -0.885
  540    HA   GLN  67           HA       GLN  67 -13.780   9.118   1.103
  541   1HB   GLN  67          HB2       GLN  67 -11.520   9.581  -0.572
  542   2HB   GLN  67          HB1       GLN  67 -12.757  10.754  -1.030
  543   1HG   GLN  67          HG2       GLN  67 -11.749  10.249   1.788
  544   2HG   GLN  67          HG1       GLN  67 -11.357  11.646   0.786
  545   1HE2  GLN  67          HE2       GLN  67 -13.403  12.904  -0.017
  546   2HE2  GLN  67          HE2       GLN  67 -14.674  13.068   1.097
  547    H    LYS  68           HN       LYS  68 -13.694   8.899  -2.483
  548    HA   LYS  68           HA       LYS  68 -15.407   9.289  -4.068
  549   1HB   LYS  68          HB2       LYS  68 -16.159   7.393  -2.273
  550   2HB   LYS  68          HB1       LYS  68 -17.461   8.564  -2.048
  551   1HG   LYS  68          HG2       LYS  68 -18.070   8.475  -4.360
  552   2HG   LYS  68          HG1       LYS  68 -16.605   7.586  -4.781
  553   1HD   LYS  68          HD2       LYS  68 -18.019   6.156  -2.721
  554   2HD   LYS  68          HD1       LYS  68 -19.125   6.510  -4.048
  555   1HE   LYS  68          HE2       LYS  68 -18.184   4.831  -5.239
  556   2HE   LYS  68          HE1       LYS  68 -16.633   5.694  -5.198
  557   1HZ   LYS  68          HZ1       LYS  68 -17.713   3.860  -3.124
  558   2HZ   LYS  68          HZ2       LYS  68 -16.331   4.825  -2.912
  559   3HZ   LYS  68          HZ3       LYS  68 -16.344   3.606  -4.095
  560    H    LYS  69           HN       LYS  69 -15.217  11.618  -4.091
  561    HA   LYS  69           HA       LYS  69 -16.533  13.320  -2.157
  562   1HB   LYS  69          HB2       LYS  69 -14.601  13.632  -3.985
  563   2HB   LYS  69          HB1       LYS  69 -15.962  14.195  -4.958
  564   1HG   LYS  69          HG2       LYS  69 -15.968  16.159  -3.866
  565   2HG   LYS  69          HG1       LYS  69 -16.161  15.327  -2.323
  566   1HD   LYS  69          HD2       LYS  69 -13.923  15.413  -1.840
  567   2HD   LYS  69          HD1       LYS  69 -13.447  15.239  -3.532
  568   1HE   LYS  69          HE2       LYS  69 -12.863  17.483  -2.981
  569   2HE   LYS  69          HE1       LYS  69 -14.414  17.639  -3.829
  570   1HZ   LYS  69          HZ1       LYS  69 -14.674  18.831  -1.830
  571   2HZ   LYS  69          HZ2       LYS  69 -13.926  17.618  -0.906
  572   3HZ   LYS  69          HZ3       LYS  69 -15.469  17.355  -1.569
  573    H    ALA  70           HN       ALA  70 -18.668  13.890  -2.089
  574    HA   ALA  70           HA       ALA  70 -20.937  14.090  -2.715
  575   1HB   ALA  70          HB1       ALA  70 -21.048  15.434  -4.542
  576   2HB   ALA  70          HB2       ALA  70 -20.335  14.203  -5.586
  577   3HB   ALA  70          HB3       ALA  70 -19.296  15.251  -4.620
  578    H    SER  71           HN       SER  71 -21.947  12.110  -2.399
  579    HA   SER  71           HA       SER  71 -21.366   9.721  -3.884
  580   1HB   SER  71          HB2       SER  71 -23.262  10.707  -1.862
  581   2HB   SER  71          HB1       SER  71 -23.914   9.427  -2.883
  582    HG   SER  71           HG       SER  71 -22.352   9.125  -0.844
  583    HA   PRO  72           HA       PRO  72 -25.279  10.722  -6.403
  584   1HB   PRO  72          HB2       PRO  72 -26.505  13.138  -6.042
  585   2HB   PRO  72          HB1       PRO  72 -26.919  11.684  -5.116
  586   1HG   PRO  72          HG2       PRO  72 -25.297  14.027  -4.321
  587   2HG   PRO  72          HG1       PRO  72 -26.367  13.007  -3.355
  588   1HD   PRO  72          HD2       PRO  72 -23.613  12.843  -3.357
  589   2HD   PRO  72          HD1       PRO  72 -24.712  11.545  -2.850
  590    H    ARG  73           HN       ARG  73 -24.634  14.195  -6.073
  591    HA   ARG  73           HA       ARG  73 -22.613  14.254  -8.174
  592   1HB   ARG  73          HB2       ARG  73 -24.142  15.415  -9.799
  593   2HB   ARG  73          HB1       ARG  73 -24.588  13.736  -9.502
  594   1HG   ARG  73          HG2       ARG  73 -25.838  15.529  -7.577
  595   2HG   ARG  73          HG1       ARG  73 -26.260  15.958  -9.236
  596   1HD   ARG  73          HD2       ARG  73 -26.459  13.136  -8.127
  597   2HD   ARG  73          HD1       ARG  73 -27.828  14.259  -8.248
  598    HE   ARG  73           HE       ARG  73 -26.297  13.179 -10.572
  599   1HH1  ARG  73          HH2       ARG  73 -29.168  12.495 -10.226
  600   2HH1  ARG  73          HH2       ARG  73 -29.957  13.654 -11.243
  601   1HH2  ARG  73          HH1       ARG  73 -27.197  15.745 -11.448
  602   2HH2  ARG  73          HH1       ARG  73 -28.841  15.495 -11.934
  Start of MODEL    8
    1   1H    VAL   1          HT1       VAL   1  -4.183   5.027   9.037
    2   2H    VAL   1          HT2       VAL   1  -4.807   5.949  10.321
    3   3H    VAL   1          HT3       VAL   1  -4.231   4.375  10.601
    4    HA   VAL   1           HA       VAL   1  -2.713   6.309  11.266
    5    HB   VAL   1           HB       VAL   1  -2.155   3.896  11.143
    6   1HG1  VAL   1          HG1       VAL   1  -1.273   2.926   9.104
    7   2HG1  VAL   1          HG1       VAL   1  -1.356   4.481   8.277
    8   3HG1  VAL   1          HG1       VAL   1  -2.840   3.644   8.734
    9   1HG2  VAL   1          HG2       VAL   1   0.058   5.473   9.817
   10   2HG2  VAL   1          HG2       VAL   1   0.205   4.174  11.001
   11   3HG2  VAL   1          HG2       VAL   1  -0.409   5.752  11.495
   12    H    VAL   2           HN       VAL   2  -0.901   7.582  10.310
   13    HA   VAL   2           HA       VAL   2  -1.449   8.371   7.464
   14    HB   VAL   2           HB       VAL   2  -2.219   9.996   9.182
   15   1HG1  VAL   2          HG1       VAL   2  -0.580   9.394  10.932
   16   2HG1  VAL   2          HG1       VAL   2  -0.540  11.124  10.594
   17   3HG1  VAL   2          HG1       VAL   2   0.717  10.070   9.947
   18   1HG2  VAL   2          HG2       VAL   2  -0.116  10.552   7.175
   19   2HG2  VAL   2          HG2       VAL   2  -0.353  11.822   8.375
   20   3HG2  VAL   2          HG2       VAL   2  -1.706  11.291   7.375
   21    H    ILE   3           HN       ILE   3   0.293   8.422   6.139
   22    HA   ILE   3           HA       ILE   3   2.984   7.899   7.329
   23    HB   ILE   3           HB       ILE   3   2.172   6.063   6.047
   24   1HG1  ILE   3          HG1       ILE   3   4.545   7.154   5.512
   25   2HG1  ILE   3          HG1       ILE   3   3.975   5.753   4.624
   26   1HG2  ILE   3          HG2       ILE   3   1.201   8.182   4.178
   27   2HG2  ILE   3          HG2       ILE   3   0.362   6.764   4.804
   28   3HG2  ILE   3          HG2       ILE   3   1.568   6.582   3.531
   29   1HD1  ILE   3          HD1       ILE   3   3.861   8.651   3.712
   30   2HD1  ILE   3          HD1       ILE   3   3.101   7.317   2.849
   31   3HD1  ILE   3          HD1       ILE   3   4.850   7.362   3.031
   32    HA   PRO   4           HA       PRO   4   4.044  11.794   5.467
   33   1HB   PRO   4          HB2       PRO   4   6.692  11.791   6.135
   34   2HB   PRO   4          HB1       PRO   4   5.402  12.142   7.298
   35   1HG   PRO   4          HG2       PRO   4   7.053   9.724   7.000
   36   2HG   PRO   4          HG1       PRO   4   6.241  10.372   8.428
   37   1HD   PRO   4          HD2       PRO   4   5.373   8.229   6.824
   38   2HD   PRO   4          HD1       PRO   4   4.449   9.042   8.101
   39    H    SER   5           HN       SER   5   7.092  10.026   5.102
   40    HA   SER   5           HA       SER   5   6.640   9.233   2.351
   41   1HB   SER   5          HB2       SER   5   8.249  11.026   1.466
   42   2HB   SER   5          HB1       SER   5   6.640  11.577   1.922
   43    HG   SER   5           HG       SER   5   7.514  12.741   3.434
   44    HA   PRO   6           HA       PRO   6  10.543   7.800   4.606
   45   1HB   PRO   6          HB2       PRO   6   9.745   5.267   5.243
   46   2HB   PRO   6          HB1       PRO   6   9.517   6.652   6.328
   47   1HG   PRO   6          HG2       PRO   6   7.571   5.321   4.524
   48   2HG   PRO   6          HG1       PRO   6   7.338   5.984   6.149
   49   1HD   PRO   6          HD2       PRO   6   6.563   7.262   3.866
   50   2HD   PRO   6          HD1       PRO   6   6.985   8.104   5.372
   51    H    CYS   7           HN       CYS   7  11.259   5.120   4.058
   52    HA   CYS   7           HA       CYS   7  10.663   4.670   1.177
   53   1HB   CYS   7          HB2       CYS   7  13.112   4.648   0.703
   54   2HB   CYS   7          HB1       CYS   7  12.564   6.225   1.265
   55    H    CYS   8           HN       CYS   8  11.838   2.573   0.460
   56    HA   CYS   8           HA       CYS   8  11.898   0.628   2.749
   57   1HB   CYS   8          HB2       CYS   8  10.000   0.771   0.865
   58   2HB   CYS   8          HB1       CYS   8  11.179  -0.179  -0.040
   59    H    MET   9           HN       MET   9  13.385  -1.183   2.462
   60    HA   MET   9           HA       MET   9  15.813  -0.439   0.952
   61   1HB   MET   9          HB2       MET   9  15.913  -1.233   3.282
   62   2HB   MET   9          HB1       MET   9  15.129  -2.741   2.809
   63   1HG   MET   9          HG2       MET   9  17.196  -3.568   2.437
   64   2HG   MET   9          HG1       MET   9  17.267  -2.506   1.031
   65   1HE   MET   9          HE1       MET   9  20.465  -2.833   2.448
   66   2HE   MET   9          HE2       MET   9  20.401  -1.350   1.499
   67   3HE   MET   9          HE3       MET   9  19.423  -2.736   1.021
   68    H    PHE  10           HN       PHE  10  13.340  -2.998   0.965
   69    HA   PHE  10           HA       PHE  10  14.329  -3.836  -1.736
   70   1HB   PHE  10          HB2       PHE  10  14.121  -6.141  -1.068
   71   2HB   PHE  10          HB1       PHE  10  15.012  -5.332   0.217
   72    HD1  PHE  10           HD1      PHE  10  13.837  -4.687   2.339
   73    HD2  PHE  10           HD2      PHE  10  11.942  -7.074  -0.688
   74    HE1  PHE  10           HE1      PHE  10  12.111  -5.389   3.974
   75    HE2  PHE  10           HE2      PHE  10  10.215  -7.775   0.946
   76    HZ   PHE  10           HZ       PHE  10  10.298  -6.933   3.277
   77    H    PHE  11           HN       PHE  11  12.547  -5.164  -2.880
   78    HA   PHE  11           HA       PHE  11   9.919  -3.852  -2.343
   79   1HB   PHE  11          HB2       PHE  11  11.500  -4.533  -4.679
   80   2HB   PHE  11          HB1       PHE  11   9.897  -5.257  -4.797
   81    HD1  PHE  11           HD1      PHE  11  11.451  -2.650  -6.093
   82    HD2  PHE  11           HD2      PHE  11   8.216  -3.331  -3.352
   83    HE1  PHE  11           HE1      PHE  11  10.488  -0.441  -6.675
   84    HE2  PHE  11           HE2      PHE  11   7.259  -1.124  -3.931
   85    HZ   PHE  11           HZ       PHE  11   8.393   0.325  -5.593
   86    H    VAL  12           HN       VAL  12   8.016  -5.178  -2.274
   87    HA   VAL  12           HA       VAL  12   8.078  -7.550  -0.819
   88    HB   VAL  12           HB       VAL  12   5.789  -7.909  -1.942
   89   1HG1  VAL  12          HG1       VAL  12   6.695  -5.452  -0.495
   90   2HG1  VAL  12          HG1       VAL  12   5.634  -6.750   0.055
   91   3HG1  VAL  12          HG1       VAL  12   5.030  -5.531  -1.068
   92   1HG2  VAL  12          HG2       VAL  12   6.956  -6.172  -3.856
   93   2HG2  VAL  12          HG2       VAL  12   5.693  -5.240  -3.052
   94   3HG2  VAL  12          HG2       VAL  12   5.298  -6.773  -3.831
   95    H    SER  13           HN       SER  13   8.260  -9.749  -1.325
   96    HA   SER  13           HA       SER  13   9.710 -10.573  -3.637
   97   1HB   SER  13          HB2       SER  13   9.635 -11.860  -1.574
   98   2HB   SER  13          HB1       SER  13   7.886 -12.035  -1.697
   99    HG   SER  13           HG       SER  13   8.400 -13.810  -2.713
  100    H    LYS  14           HN       LYS  14   6.305 -10.060  -3.072
  101    HA   LYS  14           HA       LYS  14   5.695 -10.328  -5.912
  102   1HB   LYS  14          HB2       LYS  14   4.151 -12.238  -5.608
  103   2HB   LYS  14          HB1       LYS  14   5.795 -12.688  -5.150
  104   1HG   LYS  14          HG2       LYS  14   5.206 -13.039  -2.995
  105   2HG   LYS  14          HG1       LYS  14   4.270 -11.545  -2.924
  106   1HD   LYS  14          HD2       LYS  14   2.476 -12.942  -2.825
  107   2HD   LYS  14          HD1       LYS  14   2.705 -13.065  -4.570
  108   1HE   LYS  14          HE2       LYS  14   3.786 -15.145  -4.415
  109   2HE   LYS  14          HE1       LYS  14   4.228 -14.894  -2.715
  110   1HZ   LYS  14          HZ1       LYS  14   1.750 -14.776  -2.291
  111   2HZ   LYS  14          HZ2       LYS  14   2.374 -16.312  -2.658
  112   3HZ   LYS  14          HZ3       LYS  14   1.541 -15.425  -3.842
  113    H    ARG  15           HN       ARG  15   2.938 -10.563  -5.764
  114    HA   ARG  15           HA       ARG  15   2.151  -7.973  -4.728
  115   1HB   ARG  15          HB2       ARG  15   0.422 -10.325  -5.577
  116   2HB   ARG  15          HB1       ARG  15  -0.017  -8.618  -5.616
  117   1HG   ARG  15          HG2       ARG  15   2.058  -8.372  -7.184
  118   2HG   ARG  15          HG1       ARG  15   1.893 -10.115  -7.397
  119   1HD   ARG  15          HD2       ARG  15  -0.644  -8.604  -7.638
  120   2HD   ARG  15          HD1       ARG  15   0.546  -8.292  -8.918
  121    HE   ARG  15           HE       ARG  15   0.239 -11.128  -8.261
  122   1HH1  ARG  15          HH1       ARG  15  -1.687  -8.719  -9.659
  123   2HH1  ARG  15          HH1       ARG  15  -1.950  -9.565 -11.147
  124   1HH2  ARG  15          HH2       ARG  15   0.270 -12.116 -10.398
  125   2HH2  ARG  15          HH2       ARG  15  -0.845 -11.487 -11.564
  126    H    ILE  16           HN       ILE  16  -0.416  -8.665  -3.633
  127    HA   ILE  16           HA       ILE  16   0.227 -10.213  -1.154
  128    HB   ILE  16           HB       ILE  16  -1.313  -7.664  -0.858
  129   1HG1  ILE  16          HG1       ILE  16   1.692  -7.703  -1.315
  130   2HG1  ILE  16          HG1       ILE  16   0.493  -6.850  -2.283
  131   1HG2  ILE  16          HG2       ILE  16   0.224  -9.534   0.753
  132   2HG2  ILE  16          HG2       ILE  16  -0.987  -8.354   1.255
  133   3HG2  ILE  16          HG2       ILE  16   0.695  -7.869   1.074
  134   1HD1  ILE  16          HD1       ILE  16   0.962  -6.306   0.665
  135   2HD1  ILE  16          HD1       ILE  16  -0.035  -5.366  -0.445
  136   3HD1  ILE  16          HD1       ILE  16   1.719  -5.381  -0.630
  137    HA   PRO  17           HA       PRO  17  -3.997 -11.354  -1.815
  138   1HB   PRO  17          HB2       PRO  17  -4.632 -12.373   0.639
  139   2HB   PRO  17          HB1       PRO  17  -3.554 -13.192  -0.506
  140   1HG   PRO  17          HG2       PRO  17  -2.919 -11.874   2.003
  141   2HG   PRO  17          HG1       PRO  17  -1.952 -12.998   1.045
  142   1HD   PRO  17          HD2       PRO  17  -1.751 -10.129   1.198
  143   2HD   PRO  17          HD1       PRO  17  -0.691 -11.267   0.338
  144    H    GLU  18           HN       GLU  18  -5.430  -9.673  -2.080
  145    HA   GLU  18           HA       GLU  18  -5.873  -7.378  -0.642
  146   1HB   GLU  18          HB2       GLU  18  -6.927  -8.244  -2.794
  147   2HB   GLU  18          HB1       GLU  18  -8.097  -9.087  -1.777
  148   1HG   GLU  18          HG2       GLU  18  -7.795  -6.321  -0.942
  149   2HG   GLU  18          HG1       GLU  18  -8.256  -6.425  -2.643
  150    H    ASN  19           HN       ASN  19  -7.264 -10.566   0.151
  151    HA   ASN  19           HA       ASN  19  -9.044  -9.692   2.207
  152   1HB   ASN  19          HB2       ASN  19  -7.956 -12.128   1.085
  153   2HB   ASN  19          HB1       ASN  19  -8.057 -12.261   2.842
  154   1HD2  ASN  19          HD2       ASN  19  -9.796 -13.658   0.893
  155   2HD2  ASN  19          HD2       ASN  19 -11.379 -13.136   1.206
  156    H    ARG  20           HN       ARG  20  -5.604  -9.774   2.163
  157    HA   ARG  20           HA       ARG  20  -5.455  -9.816   5.142
  158   1HB   ARG  20          HB2       ARG  20  -3.515 -10.259   2.870
  159   2HB   ARG  20          HB1       ARG  20  -2.979 -10.116   4.542
  160   1HG   ARG  20          HG2       ARG  20  -5.042 -11.910   4.774
  161   2HG   ARG  20          HG1       ARG  20  -4.367 -12.340   3.202
  162   1HD   ARG  20          HD2       ARG  20  -2.058 -12.254   4.405
  163   2HD   ARG  20          HD1       ARG  20  -3.012 -12.371   5.898
  164    HE   ARG  20           HE       ARG  20  -3.765 -14.304   3.818
  165   1HH1  ARG  20          HH2       ARG  20  -4.009 -14.534   6.874
  166   2HH1  ARG  20          HH2       ARG  20  -2.834 -15.765   7.197
  167   1HH2  ARG  20          HH1       ARG  20  -1.305 -15.494   4.101
  168   2HH2  ARG  20          HH1       ARG  20  -1.304 -16.307   5.629
  169    H    VAL  21           HN       VAL  21  -4.602  -7.903   2.285
  170    HA   VAL  21           HA       VAL  21  -3.134  -5.854   3.693
  171    HB   VAL  21           HB       VAL  21  -4.683  -5.719   1.088
  172   1HG1  VAL  21          HG1       VAL  21  -3.062  -3.834   2.543
  173   2HG1  VAL  21          HG1       VAL  21  -3.897  -3.613   1.005
  174   3HG1  VAL  21          HG1       VAL  21  -2.254  -4.255   1.031
  175   1HG2  VAL  21          HG2       VAL  21  -2.715  -7.538   1.675
  176   2HG2  VAL  21          HG2       VAL  21  -1.765  -6.191   1.051
  177   3HG2  VAL  21          HG2       VAL  21  -3.033  -6.910   0.059
  178    H    VAL  22           HN       VAL  22  -3.873  -3.768   4.379
  179    HA   VAL  22           HA       VAL  22  -6.841  -3.513   4.615
  180    HB   VAL  22           HB       VAL  22  -6.236  -2.259   6.729
  181   1HG1  VAL  22          HG1       VAL  22  -6.535  -4.955   6.257
  182   2HG1  VAL  22          HG1       VAL  22  -6.538  -4.192   7.847
  183   3HG1  VAL  22          HG1       VAL  22  -5.049  -4.885   7.203
  184   1HG2  VAL  22          HG2       VAL  22  -4.010  -2.586   7.668
  185   2HG2  VAL  22          HG2       VAL  22  -3.872  -1.785   6.106
  186   3HG2  VAL  22          HG2       VAL  22  -3.523  -3.506   6.250
  187    H    SER  23           HN       SER  23  -3.770  -1.791   4.204
  188    HA   SER  23           HA       SER  23  -4.971   0.240   2.519
  189   1HB   SER  23          HB2       SER  23  -5.915   0.851   4.697
  190   2HB   SER  23          HB1       SER  23  -4.308   0.851   5.416
  191    HG   SER  23           HG       SER  23  -3.802   2.654   4.305
  192    H    TYR  24           HN       TYR  24  -3.312   1.593   1.602
  193    HA   TYR  24           HA       TYR  24  -0.566   0.633   2.161
  194   1HB   TYR  24          HB2       TYR  24  -0.124   1.440  -0.064
  195   2HB   TYR  24          HB1       TYR  24  -1.658   0.581  -0.112
  196    HD1  TYR  24           HD1      TYR  24  -0.097   3.957   0.019
  197    HD2  TYR  24           HD2      TYR  24  -3.699   1.711  -0.636
  198    HE1  TYR  24           HE1      TYR  24  -1.214   5.995  -0.843
  199    HE2  TYR  24           HE2      TYR  24  -4.815   3.747  -1.498
  200    HH   TYR  24           HH       TYR  24  -4.561   6.213  -1.259
  201    H    GLN  25           HN       GLN  25   1.077   2.473   1.560
  202    HA   GLN  25           HA       GLN  25   0.356   5.090   2.765
  203   1HB   GLN  25          HB2       GLN  25   2.632   3.272   3.641
  204   2HB   GLN  25          HB1       GLN  25   2.305   4.879   4.281
  205   1HG   GLN  25          HG2       GLN  25  -0.096   3.868   4.733
  206   2HG   GLN  25          HG1       GLN  25   0.778   2.337   4.688
  207   1HE2  GLN  25          HE2       GLN  25   2.686   2.156   6.229
  208   2HE2  GLN  25          HE2       GLN  25   2.632   3.022   7.688
  209    H    LEU  26           HN       LEU  26   0.647   5.856   0.580
  210    HA   LEU  26           HA       LEU  26   2.793   5.266  -1.140
  211   1HB   LEU  26          HB2       LEU  26   0.750   7.376  -0.784
  212   2HB   LEU  26          HB1       LEU  26   2.133   7.825  -1.786
  213    HG   LEU  26           HG       LEU  26   0.414   5.356  -2.174
  214   1HD1  LEU  26          HD1       LEU  26  -0.951   6.978  -3.059
  215   2HD1  LEU  26          HD1       LEU  26   0.130   6.786  -4.439
  216   3HD1  LEU  26          HD1       LEU  26   0.378   8.111  -3.303
  217   1HD2  LEU  26          HD2       LEU  26   2.868   6.441  -3.555
  218   2HD2  LEU  26          HD2       LEU  26   1.741   5.381  -4.402
  219   3HD2  LEU  26          HD2       LEU  26   2.578   4.810  -2.960
  220    H    SER  27           HN       SER  27   4.880   5.832  -1.198
  221    HA   SER  27           HA       SER  27   5.831   8.068   0.543
  222   1HB   SER  27          HB2       SER  27   6.763   5.249   0.113
  223   2HB   SER  27          HB1       SER  27   7.961   6.480   0.502
  224    HG   SER  27           HG       SER  27   7.291   5.837   2.450
  225    H    SER  28           HN       SER  28   8.132   8.782  -0.314
  226    HA   SER  28           HA       SER  28   8.517   8.359  -3.212
  227   1HB   SER  28          HB2       SER  28   7.796  11.059  -2.032
  228   2HB   SER  28          HB1       SER  28   8.195  10.749  -3.720
  229    HG   SER  28           HG       SER  28   6.064  10.544  -3.759
  230    H    ARG  29           HN       ARG  29  10.359  10.012  -3.930
  231    HA   ARG  29           HA       ARG  29  12.658   9.493  -2.242
  232   1HB   ARG  29          HB2       ARG  29  12.472   9.665  -4.792
  233   2HB   ARG  29          HB1       ARG  29  12.419  11.414  -4.571
  234   1HG   ARG  29          HG2       ARG  29  14.594  10.006  -3.128
  235   2HG   ARG  29          HG1       ARG  29  14.730  10.026  -4.888
  236   1HD   ARG  29          HD2       ARG  29  13.986  12.631  -4.334
  237   2HD   ARG  29          HD1       ARG  29  15.064  12.235  -2.979
  238    HE   ARG  29           HE       ARG  29  15.912  11.570  -5.762
  239   1HH1  ARG  29          HH1       ARG  29  16.032  13.980  -3.383
  240   2HH1  ARG  29          HH1       ARG  29  17.750  14.190  -3.454
  241   1HH2  ARG  29          HH2       ARG  29  18.256  11.517  -5.606
  242   2HH2  ARG  29          HH2       ARG  29  19.009  12.797  -4.712
  243    H    SER  30           HN       SER  30  11.351  10.739  -0.383
  244    HA   SER  30           HA       SER  30  11.865  13.676  -0.529
  245   1HB   SER  30          HB2       SER  30   9.727  12.172   0.314
  246   2HB   SER  30          HB1       SER  30  10.560  12.476   1.835
  247    HG   SER  30           HG       SER  30   9.519  14.314   1.679
  248    H    THR  31           HN       THR  31  12.681  10.763   1.322
  249    HA   THR  31           HA       THR  31  14.778  12.354   2.766
  250    HB   THR  31           HB       THR  31  14.383  10.274   4.399
  251    HG1  THR  31           HG1      THR  31  11.993   9.970   4.283
  252   1HG2  THR  31          HG2       THR  31  13.200  12.938   4.128
  253   2HG2  THR  31          HG2       THR  31  13.878  12.150   5.552
  254   3HG2  THR  31          HG2       THR  31  12.207  11.838   5.082
  255    H    CYS  32           HN       CYS  32  13.965   9.327   1.133
  256    HA   CYS  32           HA       CYS  32  16.824   8.468   1.289
  257   1HB   CYS  32          HB2       CYS  32  14.285   7.005   0.488
  258   2HB   CYS  32          HB1       CYS  32  15.876   6.268   0.672
  259    H    LEU  33           HN       LEU  33  16.733   6.790  -1.012
  260    HA   LEU  33           HA       LEU  33  16.493   8.806  -3.207
  261   1HB   LEU  33          HB2       LEU  33  18.786   7.870  -2.220
  262   2HB   LEU  33          HB1       LEU  33  18.426   6.527  -3.306
  263    HG   LEU  33           HG       LEU  33  17.992   9.143  -4.552
  264   1HD1  LEU  33          HD1       LEU  33  20.703   8.401  -3.438
  265   2HD1  LEU  33          HD1       LEU  33  19.839   9.930  -3.271
  266   3HD1  LEU  33          HD1       LEU  33  20.522   9.469  -4.830
  267   1HD2  LEU  33          HD2       LEU  33  18.137   7.560  -6.181
  268   2HD2  LEU  33          HD2       LEU  33  19.058   6.460  -5.157
  269   3HD2  LEU  33          HD2       LEU  33  19.879   7.770  -6.004
  270    H    LYS  34           HN       LYS  34  14.518   6.732  -2.296
  271    HA   LYS  34           HA       LYS  34  14.270   5.298  -4.908
  272   1HB   LYS  34          HB2       LYS  34  14.531   4.241  -2.134
  273   2HB   LYS  34          HB1       LYS  34  13.372   3.426  -3.185
  274   1HG   LYS  34          HG2       LYS  34  15.004   2.506  -4.458
  275   2HG   LYS  34          HG1       LYS  34  15.929   4.008  -4.508
  276   1HD   LYS  34          HD2       LYS  34  17.210   2.291  -3.321
  277   2HD   LYS  34          HD1       LYS  34  16.728   3.559  -2.193
  278   1HE   LYS  34          HE2       LYS  34  15.636   2.035  -0.925
  279   2HE   LYS  34          HE1       LYS  34  14.644   1.565  -2.319
  280   1HZ   LYS  34          HZ1       LYS  34  15.881  -0.342  -1.790
  281   2HZ   LYS  34          HZ2       LYS  34  17.312   0.539  -1.544
  282   3HZ   LYS  34          HZ3       LYS  34  16.693   0.338  -3.113
  283    H    ALA  35           HN       ALA  35  11.950   4.205  -4.907
  284    HA   ALA  35           HA       ALA  35   9.959   5.865  -3.437
  285   1HB   ALA  35          HB1       ALA  35   9.038   6.750  -5.393
  286   2HB   ALA  35          HB2       ALA  35   9.673   5.445  -6.397
  287   3HB   ALA  35          HB3       ALA  35  10.750   6.713  -5.812
  288    H    GLY  36           HN       GLY  36   7.659   4.991  -4.111
  289   1HA   GLY  36          HA2       GLY  36   6.784   2.741  -5.182
  290   2HA   GLY  36          HA1       GLY  36   7.789   2.028  -3.920
  291    H    VAL  37           HN       VAL  37   5.118   1.428  -3.760
  292    HA   VAL  37           HA       VAL  37   3.953   3.370  -1.806
  293    HB   VAL  37           HB       VAL  37   2.723   0.920  -3.115
  294   1HG1  VAL  37          HG1       VAL  37   1.605   1.827  -1.084
  295   2HG1  VAL  37          HG1       VAL  37   0.613   2.014  -2.530
  296   3HG1  VAL  37          HG1       VAL  37   1.489   3.398  -1.874
  297   1HG2  VAL  37          HG2       VAL  37   2.616   2.071  -5.050
  298   2HG2  VAL  37          HG2       VAL  37   3.503   3.407  -4.312
  299   3HG2  VAL  37          HG2       VAL  37   1.741   3.362  -4.225
  300    H    ILE  38           HN       ILE  38   3.184   2.492   0.270
  301    HA   ILE  38           HA       ILE  38   4.588  -0.054   1.020
  302    HB   ILE  38           HB       ILE  38   3.995   2.513   2.511
  303   1HG1  ILE  38          HG1       ILE  38   6.518   2.228   2.951
  304   2HG1  ILE  38          HG1       ILE  38   6.473   0.979   1.706
  305   1HG2  ILE  38          HG2       ILE  38   3.610   1.124   4.298
  306   2HG2  ILE  38          HG2       ILE  38   5.372   1.030   4.317
  307   3HG2  ILE  38          HG2       ILE  38   4.428  -0.243   3.540
  308   1HD1  ILE  38          HD1       ILE  38   5.138   3.504   0.957
  309   2HD1  ILE  38          HD1       ILE  38   6.238   2.490   0.023
  310   3HD1  ILE  38          HD1       ILE  38   6.880   3.636   1.199
  311    H    PHE  39           HN       PHE  39   3.112  -1.699   1.260
  312    HA   PHE  39           HA       PHE  39   0.332  -0.988   2.034
  313   1HB   PHE  39          HB2       PHE  39   1.681  -3.302   0.672
  314   2HB   PHE  39          HB1       PHE  39   0.065  -3.494   1.350
  315    HD1  PHE  39           HD1      PHE  39  -1.849  -2.474   0.342
  316    HD2  PHE  39           HD2      PHE  39   2.099  -1.578  -1.090
  317    HE1  PHE  39           HE1      PHE  39  -2.823  -1.337  -1.633
  318    HE2  PHE  39           HE2      PHE  39   1.126  -0.440  -3.063
  319    HZ   PHE  39           HZ       PHE  39  -1.339  -0.320  -3.333
  320    H    THR  40           HN       THR  40  -0.680  -1.986   3.806
  321    HA   THR  40           HA       THR  40   1.166  -3.338   5.724
  322    HB   THR  40           HB       THR  40  -1.145  -1.410   6.058
  323    HG1  THR  40           HG1      THR  40   1.452  -1.313   7.151
  324   1HG2  THR  40          HG2       THR  40   0.002  -1.975   8.576
  325   2HG2  THR  40          HG2       THR  40  -0.322  -3.539   7.828
  326   3HG2  THR  40          HG2       THR  40  -1.629  -2.372   8.032
  327    H    THR  41           HN       THR  41   0.430  -5.269   6.622
  328    HA   THR  41           HA       THR  41  -1.978  -6.459   5.405
  329    HB   THR  41           HB       THR  41  -0.357  -7.907   7.428
  330    HG1  THR  41           HG1      THR  41   1.411  -8.057   6.101
  331   1HG2  THR  41          HG2       THR  41  -0.790  -9.731   6.074
  332   2HG2  THR  41          HG2       THR  41  -0.801  -8.765   4.599
  333   3HG2  THR  41          HG2       THR  41  -2.182  -8.718   5.695
  334    H    LYS  42           HN       LYS  42  -3.649  -7.437   6.773
  335    HA   LYS  42           HA       LYS  42  -4.542  -5.793   8.935
  336   1HB   LYS  42          HB2       LYS  42  -6.167  -7.683   9.226
  337   2HB   LYS  42          HB1       LYS  42  -6.008  -7.171   7.545
  338   1HG   LYS  42          HG2       LYS  42  -5.501  -9.302   7.022
  339   2HG   LYS  42          HG1       LYS  42  -3.998  -9.102   7.924
  340   1HD   LYS  42          HD2       LYS  42  -4.789 -10.759   9.254
  341   2HD   LYS  42          HD1       LYS  42  -5.836  -9.514   9.937
  342   1HE   LYS  42          HE2       LYS  42  -7.706 -10.297   8.840
  343   2HE   LYS  42          HE1       LYS  42  -6.777 -10.826   7.423
  344   1HZ   LYS  42          HZ1       LYS  42  -6.482 -12.103  10.081
  345   2HZ   LYS  42          HZ2       LYS  42  -5.954 -12.684   8.574
  346   3HZ   LYS  42          HZ3       LYS  42  -7.614 -12.649   8.942
  347    H    LYS  43           HN       LYS  43  -2.342  -8.492   8.816
  348    HA   LYS  43           HA       LYS  43  -2.557  -9.337  11.570
  349   1HB   LYS  43          HB2       LYS  43  -1.505 -10.414   9.413
  350   2HB   LYS  43          HB1       LYS  43  -0.062  -9.521   9.896
  351   1HG   LYS  43          HG2       LYS  43   0.382 -11.305  11.222
  352   2HG   LYS  43          HG1       LYS  43  -0.876 -10.657  12.275
  353   1HD   LYS  43          HD2       LYS  43  -2.316 -12.024  10.335
  354   2HD   LYS  43          HD1       LYS  43  -0.912 -13.058  10.604
  355   1HE   LYS  43          HE2       LYS  43  -1.363 -12.853  13.099
  356   2HE   LYS  43          HE1       LYS  43  -2.907 -12.090  12.673
  357   1HZ   LYS  43          HZ1       LYS  43  -2.003 -14.679  11.538
  358   2HZ   LYS  43          HZ2       LYS  43  -3.546 -13.977  11.419
  359   3HZ   LYS  43          HZ3       LYS  43  -2.993 -14.571  12.911
  360    H    GLY  44           HN       GLY  44  -0.895  -6.715   9.954
  361   1HA   GLY  44          HA2       GLY  44  -0.262  -4.781  11.377
  362   2HA   GLY  44          HA1       GLY  44   0.307  -5.947  12.570
  363    H    GLN  45           HN       GLN  45   0.879  -6.378   9.133
  364    HA   GLN  45           HA       GLN  45   3.808  -6.114   9.672
  365   1HB   GLN  45          HB2       GLN  45   2.262  -8.081   8.515
  366   2HB   GLN  45          HB1       GLN  45   2.865  -7.210   7.105
  367   1HG   GLN  45          HG2       GLN  45   4.714  -8.511   7.366
  368   2HG   GLN  45          HG1       GLN  45   5.125  -7.362   8.639
  369   1HE2  GLN  45          HE2       GLN  45   6.246  -9.633   9.291
  370   2HE2  GLN  45          HE2       GLN  45   5.336 -10.578  10.366
  371    H    GLN  46           HN       GLN  46   4.687  -5.705   7.064
  372    HA   GLN  46           HA       GLN  46   3.297  -3.356   5.939
  373   1HB   GLN  46          HB2       GLN  46   4.947  -2.865   7.982
  374   2HB   GLN  46          HB1       GLN  46   6.165  -2.977   6.711
  375   1HG   GLN  46          HG2       GLN  46   5.123  -1.224   5.440
  376   2HG   GLN  46          HG1       GLN  46   3.702  -1.233   6.484
  377   1HE2  GLN  46          HE2       GLN  46   3.916  -0.288   8.647
  378   2HE2  GLN  46          HE2       GLN  46   5.226   0.721   9.035
  379    H    SER  47           HN       SER  47   3.243  -4.324   3.903
  380    HA   SER  47           HA       SER  47   5.784  -5.398   2.766
  381   1HB   SER  47          HB2       SER  47   4.047  -6.171   0.998
  382   2HB   SER  47          HB1       SER  47   3.974  -6.915   2.594
  383    HG   SER  47           HG       SER  47   2.148  -5.910   2.982
  384    H    CYS  48           HN       CYS  48   6.940  -3.916   1.589
  385    HA   CYS  48           HA       CYS  48   5.829  -1.436   0.607
  386   1HB   CYS  48          HB2       CYS  48   8.398  -2.973   0.135
  387   2HB   CYS  48          HB1       CYS  48   8.113  -1.362  -0.525
  388    H    GLY  49           HN       GLY  49   4.502  -1.295  -1.179
  389   1HA   GLY  49          HA2       GLY  49   4.751  -3.409  -3.263
  390   2HA   GLY  49          HA1       GLY  49   3.317  -2.430  -2.994
  391    H    ASP  50           HN       ASP  50   5.061  -2.852  -5.397
  392    HA   ASP  50           HA       ASP  50   6.158  -0.148  -5.891
  393   1HB   ASP  50          HB2       ASP  50   7.228  -2.376  -6.531
  394   2HB   ASP  50          HB1       ASP  50   5.949  -2.548  -7.732
  395    HA   PRO  51           HA       PRO  51   2.256   1.143  -7.615
  396   1HB   PRO  51          HB2       PRO  51   3.173   3.317  -9.023
  397   2HB   PRO  51          HB1       PRO  51   2.912   3.328  -7.267
  398   1HG   PRO  51          HG2       PRO  51   5.449   2.911  -8.793
  399   2HG   PRO  51          HG1       PRO  51   5.152   3.916  -7.361
  400   1HD   PRO  51          HD2       PRO  51   6.304   1.513  -7.142
  401   2HD   PRO  51          HD1       PRO  51   5.146   2.093  -5.921
  402    H    LYS  52           HN       LYS  52   5.055   0.201  -9.426
  403    HA   LYS  52           HA       LYS  52   3.931   0.436 -12.084
  404   1HB   LYS  52          HB2       LYS  52   6.055  -1.431 -10.974
  405   2HB   LYS  52          HB1       LYS  52   5.840  -0.994 -12.669
  406   1HG   LYS  52          HG2       LYS  52   6.257   1.388 -12.082
  407   2HG   LYS  52          HG1       LYS  52   6.562   0.903 -10.415
  408   1HD   LYS  52          HD2       LYS  52   8.704   0.510 -10.968
  409   2HD   LYS  52          HD1       LYS  52   8.153  -0.790 -12.026
  410   1HE   LYS  52          HE2       LYS  52   7.936   0.752 -13.901
  411   2HE   LYS  52          HE1       LYS  52   8.326   2.130 -12.853
  412   1HZ   LYS  52          HZ1       LYS  52  10.412   0.873 -12.269
  413   2HZ   LYS  52          HZ2       LYS  52  10.350   1.495 -13.849
  414   3HZ   LYS  52          HZ3       LYS  52  10.069  -0.157 -13.571
  415    H    GLN  53           HN       GLN  53   3.653  -1.877  -9.474
  416    HA   GLN  53           HA       GLN  53   2.597  -4.067 -11.088
  417   1HB   GLN  53          HB2       GLN  53   2.570  -3.402  -8.124
  418   2HB   GLN  53          HB1       GLN  53   2.043  -4.946  -8.792
  419   1HG   GLN  53          HG2       GLN  53   4.761  -3.863  -9.484
  420   2HG   GLN  53          HG1       GLN  53   4.511  -4.710  -7.957
  421   1HE2  GLN  53          HE2       GLN  53   4.457  -5.105 -11.489
  422   2HE2  GLN  53          HE2       GLN  53   4.432  -6.803 -11.471
  423    H    GLU  54           HN       GLU  54   0.311  -4.800 -10.898
  424    HA   GLU  54           HA       GLU  54  -1.546  -2.496 -10.990
  425   1HB   GLU  54          HB2       GLU  54  -1.433  -5.336 -11.890
  426   2HB   GLU  54          HB1       GLU  54  -3.036  -4.660 -11.596
  427   1HG   GLU  54          HG2       GLU  54  -2.359  -2.691 -13.042
  428   2HG   GLU  54          HG1       GLU  54  -0.912  -3.601 -13.478
  429    H    TRP  55           HN       TRP  55  -0.637  -4.934  -8.668
  430    HA   TRP  55           HA       TRP  55  -3.259  -5.013  -7.380
  431   1HB   TRP  55          HB2       TRP  55  -2.120  -6.369  -5.735
  432   2HB   TRP  55          HB1       TRP  55  -1.620  -6.872  -7.338
  433    HD1  TRP  55           HD1      TRP  55   0.887  -6.641  -7.966
  434    HE1  TRP  55           HE1      TRP  55   2.998  -6.085  -6.585
  435    HE3  TRP  55           HE3      TRP  55  -1.264  -4.733  -3.750
  436    HZ2  TRP  55           HZ2      TRP  55   3.673  -5.014  -4.066
  437    HZ3  TRP  55           HZ3      TRP  55   0.144  -3.946  -1.870
  438    HH2  TRP  55           HH2      TRP  55   2.615  -4.075  -2.025
  439    H    VAL  56           HN       VAL  56  -0.483  -2.922  -7.281
  440    HA   VAL  56           HA       VAL  56  -1.203  -1.699  -4.708
  441    HB   VAL  56           HB       VAL  56   0.546  -0.834  -7.048
  442   1HG1  VAL  56          HG1       VAL  56  -0.449   0.642  -4.739
  443   2HG1  VAL  56          HG1       VAL  56   0.479   1.229  -6.118
  444   3HG1  VAL  56          HG1       VAL  56   1.312   0.544  -4.725
  445   1HG2  VAL  56          HG2       VAL  56   1.561  -2.686  -5.962
  446   2HG2  VAL  56          HG2       VAL  56   1.070  -2.119  -4.366
  447   3HG2  VAL  56          HG2       VAL  56   2.337  -1.270  -5.251
  448    H    GLN  57           HN       GLN  57  -1.342  -0.751  -8.146
  449    HA   GLN  57           HA       GLN  57  -3.019   1.529  -7.893
  450   1HB   GLN  57          HB2       GLN  57  -1.802  -0.048  -9.891
  451   2HB   GLN  57          HB1       GLN  57  -3.526  -0.119 -10.259
  452   1HG   GLN  57          HG2       GLN  57  -3.665   2.324 -10.232
  453   2HG   GLN  57          HG1       GLN  57  -1.966   2.436  -9.773
  454   1HE2  GLN  57          HE2       GLN  57  -3.871   2.820 -12.423
  455   2HE2  GLN  57          HE2       GLN  57  -2.795   2.326 -13.640
  456    H    ARG  58           HN       ARG  58  -3.841  -1.915  -8.441
  457    HA   ARG  58           HA       ARG  58  -6.660  -1.691  -8.569
  458   1HB   ARG  58          HB2       ARG  58  -5.382  -3.730  -9.050
  459   2HB   ARG  58          HB1       ARG  58  -4.858  -3.823  -7.369
  460   1HG   ARG  58          HG2       ARG  58  -7.168  -4.137  -6.631
  461   2HG   ARG  58          HG1       ARG  58  -7.745  -3.952  -8.287
  462   1HD   ARG  58          HD2       ARG  58  -5.643  -6.013  -7.922
  463   2HD   ARG  58          HD1       ARG  58  -7.211  -6.378  -7.175
  464    HE   ARG  58           HE       ARG  58  -6.767  -5.865 -10.072
  465   1HH1  ARG  58          HH1       ARG  58  -8.067  -8.251  -8.453
  466   2HH1  ARG  58          HH1       ARG  58  -9.709  -8.070  -8.971
  467   1HH2  ARG  58          HH2       ARG  58  -9.219  -4.906 -10.302
  468   2HH2  ARG  58          HH2       ARG  58 -10.363  -6.175 -10.017
  469    H    TYR  59           HN       TYR  59  -4.708  -2.548  -5.674
  470    HA   TYR  59           HA       TYR  59  -6.762  -2.300  -3.733
  471   1HB   TYR  59          HB2       TYR  59  -3.786  -1.686  -3.628
  472   2HB   TYR  59          HB1       TYR  59  -4.800  -1.875  -2.205
  473    HD1  TYR  59           HD1      TYR  59  -6.072  -4.120  -4.617
  474    HD2  TYR  59           HD2      TYR  59  -2.741  -3.588  -1.948
  475    HE1  TYR  59           HE1      TYR  59  -5.655  -6.562  -4.630
  476    HE2  TYR  59           HE2      TYR  59  -2.335  -6.035  -1.966
  477    HH   TYR  59           HH       TYR  59  -3.087  -7.990  -3.983
  478    H    MET  60           HN       MET  60  -4.281   0.066  -4.630
  479    HA   MET  60           HA       MET  60  -5.121   2.340  -3.237
  480   1HB   MET  60          HB2       MET  60  -3.834   1.837  -5.920
  481   2HB   MET  60          HB1       MET  60  -4.044   3.474  -5.308
  482   1HG   MET  60          HG2       MET  60  -2.913   2.676  -3.161
  483   2HG   MET  60          HG1       MET  60  -2.464   1.222  -4.048
  484   1HE   MET  60          HE1       MET  60  -1.420   5.152  -3.576
  485   2HE   MET  60          HE2       MET  60  -2.975   4.771  -4.313
  486   3HE   MET  60          HE3       MET  60  -1.691   5.470  -5.296
  487    H    LYS  61           HN       LYS  61  -6.418   0.972  -6.247
  488    HA   LYS  61           HA       LYS  61  -8.079   3.194  -6.996
  489   1HB   LYS  61          HB2       LYS  61  -7.536   0.458  -7.761
  490   2HB   LYS  61          HB1       LYS  61  -9.275   0.750  -7.788
  491   1HG   LYS  61          HG2       LYS  61  -9.128   2.121  -9.583
  492   2HG   LYS  61          HG1       LYS  61  -7.721   2.961  -8.930
  493   1HD   LYS  61          HD2       LYS  61  -6.425   1.852 -10.394
  494   2HD   LYS  61          HD1       LYS  61  -6.858   0.344  -9.588
  495   1HE   LYS  61          HE2       LYS  61  -8.621  -0.103 -11.099
  496   2HE   LYS  61          HE1       LYS  61  -8.695   1.584 -11.644
  497   1HZ   LYS  61          HZ1       LYS  61  -6.510   1.376 -12.594
  498   2HZ   LYS  61          HZ2       LYS  61  -7.493   0.137 -13.218
  499   3HZ   LYS  61          HZ3       LYS  61  -6.352  -0.207 -12.008
  500    H    ASN  62           HN       ASN  62  -8.784   0.207  -5.148
  501    HA   ASN  62           HA       ASN  62 -11.513   0.993  -4.518
  502   1HB   ASN  62          HB2       ASN  62  -9.746  -1.254  -4.264
  503   2HB   ASN  62          HB1       ASN  62 -10.436  -0.917  -2.678
  504   1HD2  ASN  62          HD2       ASN  62 -11.537  -3.121  -3.224
  505   2HD2  ASN  62          HD2       ASN  62 -13.010  -3.048  -4.063
  506    H    LEU  63           HN       LEU  63  -8.464   0.865  -2.652
  507    HA   LEU  63           HA       LEU  63  -9.408   1.898  -0.199
  508   1HB   LEU  63          HB2       LEU  63  -6.876   1.601  -1.691
  509   2HB   LEU  63          HB1       LEU  63  -6.846   2.847  -0.439
  510    HG   LEU  63           HG       LEU  63  -8.021   0.157   0.182
  511   1HD1  LEU  63          HD1       LEU  63  -5.852  -0.715   0.803
  512   2HD1  LEU  63          HD1       LEU  63  -5.070   0.812   0.398
  513   3HD1  LEU  63          HD1       LEU  63  -5.759  -0.190  -0.879
  514   1HD2  LEU  63          HD2       LEU  63  -7.730   2.495   1.595
  515   2HD2  LEU  63          HD2       LEU  63  -6.290   1.604   2.088
  516   3HD2  LEU  63          HD2       LEU  63  -7.889   0.900   2.334
  517    H    ASP  64           HN       ASP  64  -8.034   3.650  -2.989
  518    HA   ASP  64           HA       ASP  64  -8.336   6.279  -1.865
  519   1HB   ASP  64          HB2       ASP  64  -6.845   5.586  -3.750
  520   2HB   ASP  64          HB1       ASP  64  -8.276   5.372  -4.760
  521    H    ALA  65           HN       ALA  65 -10.547   4.129  -3.538
  522    HA   ALA  65           HA       ALA  65 -12.511   6.275  -4.053
  523   1HB   ALA  65          HB1       ALA  65 -13.640   4.588  -5.271
  524   2HB   ALA  65          HB2       ALA  65 -12.908   3.295  -4.321
  525   3HB   ALA  65          HB3       ALA  65 -11.935   4.193  -5.487
  526    H    LYS  66           HN       LYS  66 -11.618   5.054  -1.246
  527    HA   LYS  66           HA       LYS  66 -14.383   4.475  -0.254
  528   1HB   LYS  66          HB2       LYS  66 -12.608   2.736   0.005
  529   2HB   LYS  66          HB1       LYS  66 -11.657   3.884   0.949
  530   1HG   LYS  66          HG2       LYS  66 -12.781   3.246   2.790
  531   2HG   LYS  66          HG1       LYS  66 -14.262   3.880   2.070
  532   1HD   LYS  66          HD2       LYS  66 -13.151   1.086   1.670
  533   2HD   LYS  66          HD1       LYS  66 -14.547   1.510   2.659
  534   1HE   LYS  66          HE2       LYS  66 -14.744   2.570  -0.073
  535   2HE   LYS  66          HE1       LYS  66 -14.671   0.798  -0.015
  536   1HZ   LYS  66          HZ1       LYS  66 -16.924   1.376   0.332
  537   2HZ   LYS  66          HZ2       LYS  66 -16.525   2.584   1.456
  538   3HZ   LYS  66          HZ3       LYS  66 -16.315   0.948   1.855
  539    H    GLN  67           HN       GLN  67 -11.601   6.590   0.035
  540    HA   GLN  67           HA       GLN  67 -13.172   8.362   1.842
  541   1HB   GLN  67          HB2       GLN  67 -10.625   6.902   2.407
  542   2HB   GLN  67          HB1       GLN  67 -10.790   8.534   3.052
  543   1HG   GLN  67          HG2       GLN  67 -12.715   7.959   4.316
  544   2HG   GLN  67          HG1       GLN  67 -12.951   6.459   3.420
  545   1HE2  GLN  67          HE2       GLN  67  -9.827   7.646   4.690
  546   2HE2  GLN  67          HE2       GLN  67  -9.602   6.365   5.780
  547    H    LYS  68           HN       LYS  68 -13.277   9.851   0.054
  548    HA   LYS  68           HA       LYS  68 -10.806  10.749  -1.261
  549   1HB   LYS  68          HB2       LYS  68 -12.400  12.184  -2.484
  550   2HB   LYS  68          HB1       LYS  68 -13.000  10.529  -2.406
  551   1HG   LYS  68          HG2       LYS  68 -13.999  11.665  -0.081
  552   2HG   LYS  68          HG1       LYS  68 -14.136  12.972  -1.260
  553   1HD   LYS  68          HD2       LYS  68 -15.263  11.381  -2.825
  554   2HD   LYS  68          HD1       LYS  68 -15.224  10.157  -1.556
  555   1HE   LYS  68          HE2       LYS  68 -17.180  11.005  -0.785
  556   2HE   LYS  68          HE1       LYS  68 -16.305  12.489  -0.359
  557   1HZ   LYS  68          HZ1       LYS  68 -17.959  13.130  -1.899
  558   2HZ   LYS  68          HZ2       LYS  68 -17.615  11.829  -2.936
  559   3HZ   LYS  68          HZ3       LYS  68 -16.506  13.105  -2.773
  560    H    LYS  69           HN       LYS  69 -10.418  13.213  -1.317
  561    HA   LYS  69           HA       LYS  69 -10.231  14.196   1.449
  562   1HB   LYS  69          HB2       LYS  69  -9.407  15.340  -1.242
  563   2HB   LYS  69          HB1       LYS  69  -8.927  15.995   0.325
  564   1HG   LYS  69          HG2       LYS  69  -8.293  13.297   0.532
  565   2HG   LYS  69          HG1       LYS  69  -7.855  13.697  -1.129
  566   1HD   LYS  69          HD2       LYS  69  -6.186  15.127  -0.489
  567   2HD   LYS  69          HD1       LYS  69  -7.062  15.674   0.939
  568   1HE   LYS  69          HE2       LYS  69  -6.087  12.837   0.886
  569   2HE   LYS  69          HE1       LYS  69  -4.919  14.131   1.210
  570   1HZ   LYS  69          HZ1       LYS  69  -6.579  15.030   2.829
  571   2HZ   LYS  69          HZ2       LYS  69  -5.884  13.547   3.283
  572   3HZ   LYS  69          HZ3       LYS  69  -7.460  13.593   2.647
  573    H    ALA  70           HN       ALA  70 -10.593  16.866   1.323
  574    HA   ALA  70           HA       ALA  70 -12.286  18.513   1.441
  575   1HB   ALA  70          HB1       ALA  70 -12.798  17.075  -1.173
  576   2HB   ALA  70          HB2       ALA  70 -11.916  18.582  -0.926
  577   3HB   ALA  70          HB3       ALA  70 -13.666  18.541  -0.713
  578    H    SER  71           HN       SER  71 -13.085  16.975   3.295
  579    HA   SER  71           HA       SER  71 -15.941  16.791   3.140
  580   1HB   SER  71          HB2       SER  71 -15.450  14.066   3.514
  581   2HB   SER  71          HB1       SER  71 -16.123  14.811   2.071
  582    HG   SER  71           HG       SER  71 -13.982  13.469   2.117
  583    HA   PRO  72           HA       PRO  72 -14.555  14.883   7.270
  584   1HB   PRO  72          HB2       PRO  72 -11.929  14.210   7.609
  585   2HB   PRO  72          HB1       PRO  72 -13.146  13.090   6.970
  586   1HG   PRO  72          HG2       PRO  72 -11.097  14.678   5.524
  587   2HG   PRO  72          HG1       PRO  72 -11.690  13.042   5.213
  588   1HD   PRO  72          HD2       PRO  72 -12.470  15.236   3.782
  589   2HD   PRO  72          HD1       PRO  72 -13.461  13.777   3.983
  590    H    ARG  73           HN       ARG  73 -11.213  15.961   6.927
  591    HA   ARG  73           HA       ARG  73 -11.758  18.216   8.747
  592   1HB   ARG  73          HB2       ARG  73  -9.234  17.130   7.452
  593   2HB   ARG  73          HB1       ARG  73  -9.276  18.339   8.736
  594   1HG   ARG  73          HG2       ARG  73 -10.876  16.022   9.445
  595   2HG   ARG  73          HG1       ARG  73  -9.217  15.554   9.068
  596   1HD   ARG  73          HD2       ARG  73  -9.465  17.993  10.734
  597   2HD   ARG  73          HD1       ARG  73  -9.972  16.482  11.516
  598    HE   ARG  73           HE       ARG  73  -7.725  15.754  11.436
  599   1HH1  ARG  73          HH1       ARG  73  -6.880  18.633  11.395
  600   2HH1  ARG  73          HH1       ARG  73  -5.846  18.687  10.006
  601   1HH2  ARG  73          HH2       ARG  73  -6.996  15.686   8.704
  602   2HH2  ARG  73          HH2       ARG  73  -5.910  17.017   8.485
  Start of MODEL    9
    1   1H    VAL   1          HT1       VAL   1  -5.113   1.154  14.401
    2   2H    VAL   1          HT2       VAL   1  -5.987   1.289  12.950
    3   3H    VAL   1          HT3       VAL   1  -4.927   2.528  13.426
    4    HA   VAL   1           HA       VAL   1  -3.092   0.772  13.310
    5    HB   VAL   1           HB       VAL   1  -5.397  -0.507  11.805
    6   1HG1  VAL   1          HG1       VAL   1  -3.612  -1.214  10.531
    7   2HG1  VAL   1          HG1       VAL   1  -3.495  -2.397  11.834
    8   3HG1  VAL   1          HG1       VAL   1  -2.452  -0.976  11.836
    9   1HG2  VAL   1          HG2       VAL   1  -4.437  -2.335  13.614
   10   2HG2  VAL   1          HG2       VAL   1  -5.832  -1.293  13.898
   11   3HG2  VAL   1          HG2       VAL   1  -4.244  -0.824  14.503
   12    H    VAL   2           HN       VAL   2  -3.257   3.261  12.375
   13    HA   VAL   2           HA       VAL   2  -3.332   3.114   9.390
   14    HB   VAL   2           HB       VAL   2  -3.506   5.381  11.342
   15   1HG1  VAL   2          HG1       VAL   2  -3.709   5.389   8.324
   16   2HG1  VAL   2          HG1       VAL   2  -2.401   6.099   9.270
   17   3HG1  VAL   2          HG1       VAL   2  -4.025   6.777   9.364
   18   1HG2  VAL   2          HG2       VAL   2  -5.809   5.396   9.888
   19   2HG2  VAL   2          HG2       VAL   2  -5.638   4.578  11.441
   20   3HG2  VAL   2          HG2       VAL   2  -5.459   3.668   9.942
   21    H    ILE   3           HN       ILE   3  -1.388   2.839   8.520
   22    HA   ILE   3           HA       ILE   3   1.118   3.308   9.856
   23    HB   ILE   3           HB       ILE   3   0.845   1.630   8.131
   24   1HG1  ILE   3          HG1       ILE   3   2.505   3.945   7.081
   25   2HG1  ILE   3          HG1       ILE   3   3.054   2.709   8.211
   26   1HG2  ILE   3          HG2       ILE   3  -0.267   3.950   6.586
   27   2HG2  ILE   3          HG2       ILE   3  -0.886   2.306   6.734
   28   3HG2  ILE   3          HG2       ILE   3   0.499   2.636   5.698
   29   1HD1  ILE   3          HD1       ILE   3   2.830   0.982   6.566
   30   2HD1  ILE   3          HD1       ILE   3   3.701   2.307   5.797
   31   3HD1  ILE   3          HD1       ILE   3   1.988   2.065   5.458
   32    HA   PRO   4           HA       PRO   4   1.463   7.647   9.020
   33   1HB   PRO   4          HB2       PRO   4   4.159   7.936   9.404
   34   2HB   PRO   4          HB1       PRO   4   3.003   7.746  10.738
   35   1HG   PRO   4          HG2       PRO   4   4.815   5.737   9.505
   36   2HG   PRO   4          HG1       PRO   4   4.359   5.956  11.200
   37   1HD   PRO   4          HD2       PRO   4   3.292   4.033   9.584
   38   2HD   PRO   4          HD1       PRO   4   2.444   4.728  10.980
   39    H    SER   5           HN       SER   5   4.697   6.813   7.893
   40    HA   SER   5           HA       SER   5   4.071   6.470   5.103
   41   1HB   SER   5          HB2       SER   5   3.249   8.746   5.307
   42   2HB   SER   5          HB1       SER   5   4.726   9.251   6.124
   43    HG   SER   5           HG       SER   5   5.673   9.412   4.252
   44    HA   PRO   6           HA       PRO   6   8.510   6.047   6.596
   45   1HB   PRO   6          HB2       PRO   6   8.691   3.326   6.496
   46   2HB   PRO   6          HB1       PRO   6   8.177   4.208   7.948
   47   1HG   PRO   6          HG2       PRO   6   6.544   2.774   5.929
   48   2HG   PRO   6          HG1       PRO   6   6.332   2.888   7.682
   49   1HD   PRO   6          HD2       PRO   6   4.876   4.331   5.869
   50   2HD   PRO   6          HD1       PRO   6   5.178   4.853   7.541
   51    H    CYS   7           HN       CYS   7  10.249   5.656   5.111
   52    HA   CYS   7           HA       CYS   7   9.624   5.701   2.316
   53   1HB   CYS   7          HB2       CYS   7  11.811   6.116   3.993
   54   2HB   CYS   7          HB1       CYS   7  12.291   4.722   3.026
   55    H    CYS   8           HN       CYS   8  11.604   3.784   1.368
   56    HA   CYS   8           HA       CYS   8  10.204   1.199   1.975
   57   1HB   CYS   8          HB2       CYS   8  10.914   2.582  -0.602
   58   2HB   CYS   8          HB1       CYS   8  10.767   0.825  -0.563
   59    H    MET   9           HN       MET   9  11.712  -0.091   2.958
   60    HA   MET   9           HA       MET   9  14.592   0.245   2.453
   61   1HB   MET   9          HB2       MET   9  13.342  -0.299   4.656
   62   2HB   MET   9          HB1       MET   9  13.207  -1.938   4.019
   63   1HG   MET   9          HG2       MET   9  15.223  -2.190   5.080
   64   2HG   MET   9          HG1       MET   9  15.835  -1.507   3.574
   65   1HE   MET   9          HE1       MET   9  15.542  -0.747   7.568
   66   2HE   MET   9          HE2       MET   9  14.031  -0.698   6.663
   67   3HE   MET   9          HE3       MET   9  14.701   0.791   7.326
   68    H    PHE  10           HN       PHE  10  12.188  -2.377   2.044
   69    HA   PHE  10           HA       PHE  10  13.857  -3.443  -0.203
   70   1HB   PHE  10          HB2       PHE  10  13.510  -5.688   0.700
   71   2HB   PHE  10          HB1       PHE  10  14.190  -4.672   1.968
   72    HD1  PHE  10           HD1      PHE  10  12.810  -3.900   3.849
   73    HD2  PHE  10           HD2      PHE  10  11.193  -6.448   0.791
   74    HE1  PHE  10           HE1      PHE  10  10.847  -4.383   5.288
   75    HE2  PHE  10           HE2      PHE  10   9.232  -6.930   2.231
   76    HZ   PHE  10           HZ       PHE  10   9.059  -5.897   4.478
   77    H    PHE  11           HN       PHE  11  12.608  -4.029  -2.003
   78    HA   PHE  11           HA       PHE  11   9.783  -3.311  -1.986
   79   1HB   PHE  11          HB2       PHE  11  11.903  -3.854  -3.872
   80   2HB   PHE  11          HB1       PHE  11  10.467  -4.774  -4.320
   81    HD1  PHE  11           HD1      PHE  11  11.942  -2.075  -5.428
   82    HD2  PHE  11           HD2      PHE  11   8.312  -2.984  -3.322
   83    HE1  PHE  11           HE1      PHE  11  10.897  -0.017  -6.335
   84    HE2  PHE  11           HE2      PHE  11   7.272  -0.927  -4.223
   85    HZ   PHE  11           HZ       PHE  11   8.562   0.557  -5.734
   86    H    VAL  12           HN       VAL  12   8.025  -4.704  -1.965
   87    HA   VAL  12           HA       VAL  12   8.054  -7.159  -0.646
   88    HB   VAL  12           HB       VAL  12   5.853  -7.485  -1.860
   89   1HG1  VAL  12          HG1       VAL  12   6.710  -5.286  -0.178
   90   2HG1  VAL  12          HG1       VAL  12   5.189  -6.180  -0.149
   91   3HG1  VAL  12          HG1       VAL  12   5.375  -4.788  -1.217
   92   1HG2  VAL  12          HG2       VAL  12   7.149  -5.784  -3.747
   93   2HG2  VAL  12          HG2       VAL  12   5.774  -4.891  -3.097
   94   3HG2  VAL  12          HG2       VAL  12   5.527  -6.466  -3.846
   95    H    SER  13           HN       SER  13   8.463  -9.294  -1.254
   96    HA   SER  13           HA       SER  13  10.057  -9.894  -3.535
   97   1HB   SER  13          HB2       SER  13   8.300 -11.545  -1.701
   98   2HB   SER  13          HB1       SER  13   9.356 -12.270  -2.909
   99    HG   SER  13           HG       SER  13   9.983 -11.444  -0.484
  100    H    LYS  14           HN       LYS  14   6.602  -9.653  -3.110
  101    HA   LYS  14           HA       LYS  14   6.148  -9.823  -5.987
  102   1HB   LYS  14          HB2       LYS  14   4.706 -11.845  -5.820
  103   2HB   LYS  14          HB1       LYS  14   6.376 -12.197  -5.378
  104   1HG   LYS  14          HG2       LYS  14   5.880 -12.356  -3.098
  105   2HG   LYS  14          HG1       LYS  14   4.406 -11.396  -3.251
  106   1HD   LYS  14          HD2       LYS  14   3.234 -13.190  -4.313
  107   2HD   LYS  14          HD1       LYS  14   4.719 -14.110  -4.552
  108   1HE   LYS  14          HE2       LYS  14   4.736 -14.889  -2.389
  109   2HE   LYS  14          HE1       LYS  14   4.071 -13.377  -1.737
  110   1HZ   LYS  14          HZ1       LYS  14   2.602 -15.455  -3.270
  111   2HZ   LYS  14          HZ2       LYS  14   1.955 -13.938  -2.863
  112   3HZ   LYS  14          HZ3       LYS  14   2.371 -15.044  -1.641
  113    H    ARG  15           HN       ARG  15   3.361 -10.424  -5.825
  114    HA   ARG  15           HA       ARG  15   2.362  -7.884  -4.786
  115   1HB   ARG  15          HB2       ARG  15   0.241  -8.739  -5.740
  116   2HB   ARG  15          HB1       ARG  15   1.576  -8.954  -6.873
  117   1HG   ARG  15          HG2       ARG  15   1.315 -11.223  -5.064
  118   2HG   ARG  15          HG1       ARG  15  -0.160 -10.948  -5.990
  119   1HD   ARG  15          HD2       ARG  15   1.752 -10.616  -7.932
  120   2HD   ARG  15          HD1       ARG  15   2.483 -11.879  -6.922
  121    HE   ARG  15           HE       ARG  15  -0.369 -12.133  -7.766
  122   1HH1  ARG  15          HH2       ARG  15   2.273 -12.872  -9.434
  123   2HH1  ARG  15          HH2       ARG  15   2.191 -14.596  -9.281
  124   1HH2  ARG  15          HH1       ARG  15  -0.227 -14.525  -6.797
  125   2HH2  ARG  15          HH1       ARG  15   0.774 -15.532  -7.790
  126    H    ILE  16           HN       ILE  16  -0.192  -8.732  -3.846
  127    HA   ILE  16           HA       ILE  16   0.375 -10.410  -1.442
  128    HB   ILE  16           HB       ILE  16  -1.154  -7.905  -0.949
  129   1HG1  ILE  16          HG1       ILE  16   1.827  -7.840  -1.541
  130   2HG1  ILE  16          HG1       ILE  16   0.565  -6.916  -2.351
  131   1HG2  ILE  16          HG2       ILE  16   0.411  -9.869   0.471
  132   2HG2  ILE  16          HG2       ILE  16  -0.722  -8.678   1.108
  133   3HG2  ILE  16          HG2       ILE  16   0.970  -8.250   0.870
  134   1HD1  ILE  16          HD1       ILE  16   0.121  -5.643  -0.329
  135   2HD1  ILE  16          HD1       ILE  16   1.852  -5.576  -0.656
  136   3HD1  ILE  16          HD1       ILE  16   1.233  -6.650   0.598
  137    HA   PRO  17           HA       PRO  17  -3.875 -11.419  -2.194
  138   1HB   PRO  17          HB2       PRO  17  -4.530 -12.557   0.198
  139   2HB   PRO  17          HB1       PRO  17  -3.451 -13.330  -0.976
  140   1HG   PRO  17          HG2       PRO  17  -2.824 -12.143   1.598
  141   2HG   PRO  17          HG1       PRO  17  -1.859 -13.227   0.596
  142   1HD   PRO  17          HD2       PRO  17  -1.641 -10.366   0.887
  143   2HD   PRO  17          HD1       PRO  17  -0.577 -11.474  -0.006
  144    H    GLU  18           HN       GLU  18  -5.316  -9.716  -2.347
  145    HA   GLU  18           HA       GLU  18  -5.698  -7.504  -0.753
  146   1HB   GLU  18          HB2       GLU  18  -6.878  -8.623  -2.931
  147   2HB   GLU  18          HB1       GLU  18  -8.175  -8.790  -1.747
  148   1HG   GLU  18          HG2       GLU  18  -6.710  -6.175  -2.055
  149   2HG   GLU  18          HG1       GLU  18  -8.048  -6.588  -3.127
  150    H    ASN  19           HN       ASN  19  -7.139 -10.717  -0.169
  151    HA   ASN  19           HA       ASN  19  -8.915  -9.993   1.932
  152   1HB   ASN  19          HB2       ASN  19  -8.338 -12.223   0.558
  153   2HB   ASN  19          HB1       ASN  19  -7.421 -12.576   2.024
  154   1HD2  ASN  19          HD2       ASN  19  -8.704 -13.918   3.302
  155   2HD2  ASN  19          HD2       ASN  19 -10.353 -13.672   3.618
  156    H    ARG  20           HN       ARG  20  -5.453 -10.135   1.887
  157    HA   ARG  20           HA       ARG  20  -5.297 -10.261   4.859
  158   1HB   ARG  20          HB2       ARG  20  -3.352 -10.520   2.559
  159   2HB   ARG  20          HB1       ARG  20  -2.819 -10.454   4.238
  160   1HG   ARG  20          HG2       ARG  20  -4.667 -12.334   4.541
  161   2HG   ARG  20          HG1       ARG  20  -4.360 -12.584   2.822
  162   1HD   ARG  20          HD2       ARG  20  -1.835 -12.573   3.510
  163   2HD   ARG  20          HD1       ARG  20  -2.457 -12.906   5.139
  164    HE   ARG  20           HE       ARG  20  -3.855 -14.651   3.464
  165   1HH1  ARG  20          HH1       ARG  20  -1.389 -14.891   5.548
  166   2HH1  ARG  20          HH1       ARG  20  -0.478 -16.092   4.696
  167   1HH2  ARG  20          HH2       ARG  20  -2.328 -15.807   1.777
  168   2HH2  ARG  20          HH2       ARG  20  -1.010 -16.611   2.560
  169    H    VAL  21           HN       VAL  21  -4.519  -8.184   2.103
  170    HA   VAL  21           HA       VAL  21  -3.114  -6.155   3.598
  171    HB   VAL  21           HB       VAL  21  -4.677  -5.978   1.006
  172   1HG1  VAL  21          HG1       VAL  21  -3.681  -3.901   2.350
  173   2HG1  VAL  21          HG1       VAL  21  -3.570  -3.995   0.593
  174   3HG1  VAL  21          HG1       VAL  21  -2.184  -4.439   1.590
  175   1HG2  VAL  21          HG2       VAL  21  -1.959  -7.065   1.701
  176   2HG2  VAL  21          HG2       VAL  21  -2.225  -6.325   0.121
  177   3HG2  VAL  21          HG2       VAL  21  -3.175  -7.730   0.609
  178    H    VAL  22           HN       VAL  22  -3.919  -4.108   4.350
  179    HA   VAL  22           HA       VAL  22  -6.890  -3.959   4.616
  180    HB   VAL  22           HB       VAL  22  -6.308  -2.771   6.780
  181   1HG1  VAL  22          HG1       VAL  22  -6.613  -5.432   6.212
  182   2HG1  VAL  22          HG1       VAL  22  -6.567  -4.745   7.835
  183   3HG1  VAL  22          HG1       VAL  22  -5.101  -5.416   7.119
  184   1HG2  VAL  22          HG2       VAL  22  -3.958  -2.231   6.203
  185   2HG2  VAL  22          HG2       VAL  22  -3.577  -3.953   6.228
  186   3HG2  VAL  22          HG2       VAL  22  -4.072  -3.139   7.708
  187    H    SER  23           HN       SER  23  -3.868  -2.107   4.309
  188    HA   SER  23           HA       SER  23  -5.131  -0.065   2.692
  189   1HB   SER  23          HB2       SER  23  -6.153   0.434   4.845
  190   2HB   SER  23          HB1       SER  23  -4.574   0.455   5.622
  191    HG   SER  23           HG       SER  23  -5.760   2.305   3.882
  192    H    TYR  24           HN       TYR  24  -3.555   1.177   1.702
  193    HA   TYR  24           HA       TYR  24  -0.753   0.492   2.292
  194   1HB   TYR  24          HB2       TYR  24  -0.380   1.231   0.077
  195   2HB   TYR  24          HB1       TYR  24  -1.936   0.428   0.044
  196    HD1  TYR  24           HD1      TYR  24  -0.975   2.412  -2.014
  197    HD2  TYR  24           HD2      TYR  24  -3.242   3.004   1.591
  198    HE1  TYR  24           HE1      TYR  24  -1.974   4.469  -2.969
  199    HE2  TYR  24           HE2      TYR  24  -4.241   5.048   0.627
  200    HH   TYR  24           HH       TYR  24  -3.073   6.443  -2.340
  201    H    GLN  25           HN       GLN  25   0.330   2.836   1.088
  202    HA   GLN  25           HA       GLN  25  -0.373   5.285   2.388
  203   1HB   GLN  25          HB2       GLN  25   0.240   4.057   4.411
  204   2HB   GLN  25          HB1       GLN  25   1.765   3.553   3.678
  205   1HG   GLN  25          HG2       GLN  25   2.109   5.464   5.203
  206   2HG   GLN  25          HG1       GLN  25   2.477   5.913   3.536
  207   1HE2  GLN  25          HE2       GLN  25  -0.132   6.106   5.999
  208   2HE2  GLN  25          HE2       GLN  25  -0.854   7.497   5.346
  209    H    LEU  26           HN       LEU  26   0.353   6.484   0.638
  210    HA   LEU  26           HA       LEU  26   2.677   5.676  -0.917
  211   1HB   LEU  26          HB2       LEU  26   0.652   7.887  -0.900
  212   2HB   LEU  26          HB1       LEU  26   2.095   8.064  -1.899
  213    HG   LEU  26           HG       LEU  26   0.176   5.717  -1.993
  214   1HD1  LEU  26          HD1       LEU  26  -0.304   6.642  -4.289
  215   2HD1  LEU  26          HD1       LEU  26   0.620   8.076  -3.843
  216   3HD1  LEU  26          HD1       LEU  26  -0.859   7.671  -2.972
  217   1HD2  LEU  26          HD2       LEU  26   2.743   6.388  -3.436
  218   2HD2  LEU  26          HD2       LEU  26   1.550   5.297  -4.145
  219   3HD2  LEU  26          HD2       LEU  26   2.308   4.895  -2.606
  220    H    SER  27           HN       SER  27   4.746   6.302  -0.636
  221    HA   SER  27           HA       SER  27   5.335   8.442   1.362
  222   1HB   SER  27          HB2       SER  27   6.099   5.852   1.321
  223   2HB   SER  27          HB1       SER  27   7.409   6.549   0.372
  224    HG   SER  27           HG       SER  27   8.193   7.175   2.211
  225    H    SER  28           HN       SER  28   7.349   9.741   0.834
  226    HA   SER  28           HA       SER  28   8.367   9.820  -1.880
  227   1HB   SER  28          HB2       SER  28   7.175  11.731  -2.679
  228   2HB   SER  28          HB1       SER  28   5.949  10.674  -1.984
  229    HG   SER  28           HG       SER  28   5.494  12.280  -0.720
  230    H    ARG  29           HN       ARG  29  10.445  10.396  -1.357
  231    HA   ARG  29           HA       ARG  29  10.865  12.876   0.236
  232   1HB   ARG  29          HB2       ARG  29  11.134  10.214   1.190
  233   2HB   ARG  29          HB1       ARG  29  12.768  10.851   0.998
  234   1HG   ARG  29          HG2       ARG  29  12.505  12.389   2.655
  235   2HG   ARG  29          HG1       ARG  29  10.831  12.724   2.212
  236   1HD   ARG  29          HD2       ARG  29  10.017  10.830   3.409
  237   2HD   ARG  29          HD1       ARG  29  11.643  10.130   3.552
  238    HE   ARG  29           HE       ARG  29  11.289  12.812   4.737
  239   1HH1  ARG  29          HH2       ARG  29   9.621  10.801   6.246
  240   2HH1  ARG  29          HH2       ARG  29  10.741  10.245   7.445
  241   1HH2  ARG  29          HH1       ARG  29  13.528  11.495   5.805
  242   2HH2  ARG  29          HH1       ARG  29  12.953  10.636   7.196
  243    H    SER  30           HN       SER  30  13.455  13.191   0.273
  244    HA   SER  30           HA       SER  30  14.387  12.751  -2.545
  245   1HB   SER  30          HB2       SER  30  13.857  15.088  -1.546
  246   2HB   SER  30          HB1       SER  30  15.341  14.871  -0.619
  247    HG   SER  30           HG       SER  30  15.808  15.906  -2.562
  248    H    THR  31           HN       THR  31  14.754  11.029  -0.034
  249    HA   THR  31           HA       THR  31  17.749  10.947  -0.128
  250    HB   THR  31           HB       THR  31  17.012  11.948   1.963
  251    HG1  THR  31           HG1      THR  31  18.624  10.178   1.924
  252   1HG2  THR  31          HG2       THR  31  14.844  11.433   2.455
  253   2HG2  THR  31          HG2       THR  31  15.583  10.135   3.393
  254   3HG2  THR  31          HG2       THR  31  14.968   9.813   1.772
  255    H    CYS  32           HN       CYS  32  14.984   9.299  -0.932
  256    HA   CYS  32           HA       CYS  32  16.069   6.620  -0.180
  257   1HB   CYS  32          HB2       CYS  32  13.437   7.865  -0.575
  258   2HB   CYS  32          HB1       CYS  32  13.582   6.292  -1.358
  259    H    LEU  33           HN       LEU  33  15.776   4.921  -1.968
  260    HA   LEU  33           HA       LEU  33  17.121   5.805  -4.379
  261   1HB   LEU  33          HB2       LEU  33  16.271   3.345  -3.041
  262   2HB   LEU  33          HB1       LEU  33  16.143   3.239  -4.797
  263    HG   LEU  33           HG       LEU  33  18.623   4.488  -3.748
  264   1HD1  LEU  33          HD1       LEU  33  17.919   2.335  -2.349
  265   2HD1  LEU  33          HD1       LEU  33  19.588   2.577  -2.865
  266   3HD1  LEU  33          HD1       LEU  33  18.531   1.496  -3.776
  267   1HD2  LEU  33          HD2       LEU  33  18.278   2.277  -5.778
  268   2HD2  LEU  33          HD2       LEU  33  19.574   3.468  -5.670
  269   3HD2  LEU  33          HD2       LEU  33  17.961   3.962  -6.187
  270    H    LYS  34           HN       LYS  34  14.273   3.719  -4.535
  271    HA   LYS  34           HA       LYS  34  13.159   5.528  -6.641
  272   1HB   LYS  34          HB2       LYS  34  13.862   2.973  -6.856
  273   2HB   LYS  34          HB1       LYS  34  12.264   2.708  -6.159
  274   1HG   LYS  34          HG2       LYS  34  11.161   3.637  -7.985
  275   2HG   LYS  34          HG1       LYS  34  12.552   4.616  -8.456
  276   1HD   LYS  34          HD2       LYS  34  13.747   2.437  -9.010
  277   2HD   LYS  34          HD1       LYS  34  12.191   1.631  -8.807
  278   1HE   LYS  34          HE2       LYS  34  11.209   3.115 -10.549
  279   2HE   LYS  34          HE1       LYS  34  12.805   3.853 -10.788
  280   1HZ   LYS  34          HZ1       LYS  34  12.407   1.989 -12.322
  281   2HZ   LYS  34          HZ2       LYS  34  12.231   0.944 -10.994
  282   3HZ   LYS  34          HZ3       LYS  34  13.724   1.700 -11.292
  283    H    ALA  35           HN       ALA  35  10.787   5.784  -6.663
  284    HA   ALA  35           HA       ALA  35   9.691   6.034  -3.929
  285   1HB   ALA  35          HB1       ALA  35   7.951   7.316  -5.117
  286   2HB   ALA  35          HB2       ALA  35   8.608   6.786  -6.665
  287   3HB   ALA  35          HB3       ALA  35   9.555   7.846  -5.621
  288    H    GLY  36           HN       GLY  36   8.290   4.550  -3.078
  289   1HA   GLY  36          HA2       GLY  36   6.641   2.903  -4.923
  290   2HA   GLY  36          HA1       GLY  36   7.656   2.067  -3.746
  291    H    VAL  37           HN       VAL  37   4.942   1.648  -3.542
  292    HA   VAL  37           HA       VAL  37   3.938   3.556  -1.480
  293    HB   VAL  37           HB       VAL  37   2.566   1.134  -2.673
  294   1HG1  VAL  37          HG1       VAL  37   0.750   3.193  -2.301
  295   2HG1  VAL  37          HG1       VAL  37   1.840   3.375  -0.930
  296   3HG1  VAL  37          HG1       VAL  37   1.004   1.844  -1.194
  297   1HG2  VAL  37          HG2       VAL  37   2.747   2.170  -4.689
  298   2HG2  VAL  37          HG2       VAL  37   3.314   3.672  -3.958
  299   3HG2  VAL  37          HG2       VAL  37   1.586   3.328  -4.043
  300    H    ILE  38           HN       ILE  38   2.733   2.311   0.404
  301    HA   ILE  38           HA       ILE  38   4.359  -0.073   1.219
  302    HB   ILE  38           HB       ILE  38   3.589   2.411   2.781
  303   1HG1  ILE  38          HG1       ILE  38   6.186   2.157   3.210
  304   2HG1  ILE  38          HG1       ILE  38   6.125   1.190   1.735
  305   1HG2  ILE  38          HG2       ILE  38   4.829   1.211   4.671
  306   2HG2  ILE  38          HG2       ILE  38   4.651  -0.264   3.721
  307   3HG2  ILE  38          HG2       ILE  38   3.221   0.592   4.295
  308   1HD1  ILE  38          HD1       ILE  38   6.194   4.011   1.934
  309   2HD1  ILE  38          HD1       ILE  38   4.576   3.592   1.374
  310   3HD1  ILE  38          HD1       ILE  38   5.989   3.046   0.473
  311    H    PHE  39           HN       PHE  39   2.951  -1.764   1.428
  312    HA   PHE  39           HA       PHE  39   0.132  -1.164   2.216
  313   1HB   PHE  39          HB2       PHE  39   1.526  -3.332   0.658
  314   2HB   PHE  39          HB1       PHE  39  -0.100  -3.586   1.295
  315    HD1  PHE  39           HD1      PHE  39  -1.974  -2.741   0.159
  316    HD2  PHE  39           HD2      PHE  39   1.934  -1.215  -0.755
  317    HE1  PHE  39           HE1      PHE  39  -2.919  -1.457  -1.737
  318    HE2  PHE  39           HE2      PHE  39   0.987   0.069  -2.649
  319    HZ   PHE  39           HZ       PHE  39  -1.440  -0.047  -3.138
  320    H    THR  40           HN       THR  40  -0.756  -2.204   4.016
  321    HA   THR  40           HA       THR  40   1.149  -3.790   5.679
  322    HB   THR  40           HB       THR  40  -1.136  -1.918   6.351
  323    HG1  THR  40           HG1      THR  40   0.514  -0.632   6.348
  324   1HG2  THR  40          HG2       THR  40  -0.105  -4.170   7.851
  325   2HG2  THR  40          HG2       THR  40  -1.438  -3.089   8.250
  326   3HG2  THR  40          HG2       THR  40   0.210  -2.662   8.709
  327    H    THR  41           HN       THR  41   0.367  -5.716   6.606
  328    HA   THR  41           HA       THR  41  -2.031  -6.860   5.320
  329    HB   THR  41           HB       THR  41  -0.348  -8.308   7.321
  330    HG1  THR  41           HG1      THR  41   1.326  -8.489   5.888
  331   1HG2  THR  41          HG2       THR  41  -1.572  -8.945   4.633
  332   2HG2  THR  41          HG2       THR  41  -2.068  -9.558   6.211
  333   3HG2  THR  41          HG2       THR  41  -0.530 -10.064   5.513
  334    H    LYS  42           HN       LYS  42  -3.711  -7.906   6.674
  335    HA   LYS  42           HA       LYS  42  -4.585  -6.283   8.874
  336   1HB   LYS  42          HB2       LYS  42  -6.335  -7.991   9.043
  337   2HB   LYS  42          HB1       LYS  42  -6.010  -7.645   7.346
  338   1HG   LYS  42          HG2       LYS  42  -4.780  -9.659   7.062
  339   2HG   LYS  42          HG1       LYS  42  -4.638  -9.912   8.801
  340   1HD   LYS  42          HD2       LYS  42  -6.847 -10.612   9.020
  341   2HD   LYS  42          HD1       LYS  42  -7.365  -9.772   7.560
  342   1HE   LYS  42          HE2       LYS  42  -6.610 -11.465   6.153
  343   2HE   LYS  42          HE1       LYS  42  -5.367 -12.002   7.301
  344   1HZ   LYS  42          HZ1       LYS  42  -6.964 -12.963   8.693
  345   2HZ   LYS  42          HZ2       LYS  42  -7.455 -13.420   7.132
  346   3HZ   LYS  42          HZ3       LYS  42  -8.252 -12.157   7.940
  347    H    LYS  43           HN       LYS  43  -2.553  -9.131   8.687
  348    HA   LYS  43           HA       LYS  43  -2.776 -10.035  11.396
  349   1HB   LYS  43          HB2       LYS  43  -1.192 -10.485   9.011
  350   2HB   LYS  43          HB1       LYS  43  -0.162 -10.504  10.443
  351   1HG   LYS  43          HG2       LYS  43  -1.874 -12.067  11.502
  352   2HG   LYS  43          HG1       LYS  43  -2.603 -12.206   9.901
  353   1HD   LYS  43          HD2       LYS  43  -0.567 -13.111   8.971
  354   2HD   LYS  43          HD1       LYS  43   0.320 -12.774  10.460
  355   1HE   LYS  43          HE2       LYS  43  -1.786 -14.304  11.383
  356   2HE   LYS  43          HE1       LYS  43  -1.426 -15.052   9.815
  357   1HZ   LYS  43          HZ1       LYS  43   0.654 -14.314  11.802
  358   2HZ   LYS  43          HZ2       LYS  43   0.862 -15.224  10.383
  359   3HZ   LYS  43          HZ3       LYS  43  -0.013 -15.870  11.688
  360    H    GLY  44           HN       GLY  44  -0.016  -8.296   9.961
  361   1HA   GLY  44          HA2       GLY  44   0.146  -6.082  11.620
  362   2HA   GLY  44          HA1       GLY  44   0.893  -7.372  12.561
  363    H    GLN  45           HN       GLN  45   1.014  -6.953   9.034
  364    HA   GLN  45           HA       GLN  45   3.991  -6.675   9.285
  365   1HB   GLN  45          HB2       GLN  45   2.271  -8.512   7.906
  366   2HB   GLN  45          HB1       GLN  45   3.169  -7.583   6.704
  367   1HG   GLN  45          HG2       GLN  45   5.273  -8.212   7.652
  368   2HG   GLN  45          HG1       GLN  45   4.501  -8.875   9.094
  369   1HE2  GLN  45          HE2       GLN  45   6.159 -10.622   7.762
  370   2HE2  GLN  45          HE2       GLN  45   5.260 -11.773   6.898
  371    H    GLN  46           HN       GLN  46   4.940  -5.515   7.299
  372    HA   GLN  46           HA       GLN  46   3.142  -3.648   5.900
  373   1HB   GLN  46          HB2       GLN  46   3.577  -2.764   8.250
  374   2HB   GLN  46          HB1       GLN  46   5.273  -2.605   7.788
  375   1HG   GLN  46          HG2       GLN  46   4.071  -1.374   5.679
  376   2HG   GLN  46          HG1       GLN  46   2.937  -0.981   6.971
  377   1HE2  GLN  46          HE2       GLN  46   6.014  -0.184   5.620
  378   2HE2  GLN  46          HE2       GLN  46   6.518   0.879   6.842
  379    H    SER  47           HN       SER  47   4.053  -4.284   3.915
  380    HA   SER  47           HA       SER  47   7.022  -3.979   3.624
  381   1HB   SER  47          HB2       SER  47   5.591  -6.174   3.197
  382   2HB   SER  47          HB1       SER  47   5.254  -5.392   1.655
  383    HG   SER  47           HG       SER  47   7.235  -6.807   1.941
  384    H    CYS  48           HN       CYS  48   7.687  -3.158   1.418
  385    HA   CYS  48           HA       CYS  48   6.059  -0.808   0.691
  386   1HB   CYS  48          HB2       CYS  48   8.496  -0.672   1.016
  387   2HB   CYS  48          HB1       CYS  48   8.740  -1.873  -0.251
  388    H    GLY  49           HN       GLY  49   4.535  -0.970  -0.916
  389   1HA   GLY  49          HA2       GLY  49   4.651  -3.247  -2.788
  390   2HA   GLY  49          HA1       GLY  49   3.316  -2.110  -2.632
  391    H    ASP  50           HN       ASP  50   4.999  -3.024  -4.974
  392    HA   ASP  50           HA       ASP  50   6.313  -0.525  -5.840
  393   1HB   ASP  50          HB2       ASP  50   7.406  -2.600  -6.361
  394   2HB   ASP  50          HB1       ASP  50   5.916  -3.301  -6.992
  395    HA   PRO  51           HA       PRO  51   2.454   0.880  -7.567
  396   1HB   PRO  51          HB2       PRO  51   3.474   2.945  -9.066
  397   2HB   PRO  51          HB1       PRO  51   3.224   3.043  -7.311
  398   1HG   PRO  51          HG2       PRO  51   5.728   2.469  -8.834
  399   2HG   PRO  51          HG1       PRO  51   5.483   3.513  -7.422
  400   1HD   PRO  51          HD2       PRO  51   6.530   1.046  -7.193
  401   2HD   PRO  51          HD1       PRO  51   5.469   1.735  -5.942
  402    H    LYS  52           HN       LYS  52   5.234  -0.190  -9.362
  403    HA   LYS  52           HA       LYS  52   4.054  -0.069 -12.009
  404   1HB   LYS  52          HB2       LYS  52   6.477  -0.975 -10.666
  405   2HB   LYS  52          HB1       LYS  52   5.970  -2.119 -11.913
  406   1HG   LYS  52          HG2       LYS  52   5.598   0.371 -13.107
  407   2HG   LYS  52          HG1       LYS  52   7.105   0.557 -12.209
  408   1HD   LYS  52          HD2       LYS  52   7.703  -1.773 -13.243
  409   2HD   LYS  52          HD1       LYS  52   6.450  -1.375 -14.418
  410   1HE   LYS  52          HE2       LYS  52   7.605   0.680 -15.041
  411   2HE   LYS  52          HE1       LYS  52   8.814   0.421 -13.765
  412   1HZ   LYS  52          HZ1       LYS  52   9.270  -1.774 -14.806
  413   2HZ   LYS  52          HZ2       LYS  52   9.703  -0.454 -15.783
  414   3HZ   LYS  52          HZ3       LYS  52   8.281  -1.324 -16.109
  415    H    GLN  53           HN       GLN  53   3.780  -2.233  -9.289
  416    HA   GLN  53           HA       GLN  53   2.840  -4.549 -10.783
  417   1HB   GLN  53          HB2       GLN  53   2.709  -3.692  -7.876
  418   2HB   GLN  53          HB1       GLN  53   2.226  -5.286  -8.455
  419   1HG   GLN  53          HG2       GLN  53   4.909  -4.327  -9.303
  420   2HG   GLN  53          HG1       GLN  53   4.726  -4.761  -7.603
  421   1HE2  GLN  53          HE2       GLN  53   6.072  -6.183 -10.025
  422   2HE2  GLN  53          HE2       GLN  53   5.447  -7.759  -9.953
  423    H    GLU  54           HN       GLU  54   0.578  -5.373 -10.554
  424    HA   GLU  54           HA       GLU  54  -1.355  -3.167 -10.934
  425   1HB   GLU  54          HB2       GLU  54  -1.081  -6.055 -11.581
  426   2HB   GLU  54          HB1       GLU  54  -2.727  -5.456 -11.370
  427   1HG   GLU  54          HG2       GLU  54  -2.491  -4.900 -13.580
  428   2HG   GLU  54          HG1       GLU  54  -1.723  -3.466 -12.897
  429    H    TRP  55           HN       TRP  55  -0.439  -5.218  -8.289
  430    HA   TRP  55           HA       TRP  55  -3.150  -5.308  -7.161
  431   1HB   TRP  55          HB2       TRP  55  -2.005  -6.385  -5.268
  432   2HB   TRP  55          HB1       TRP  55  -1.578  -7.135  -6.795
  433    HD1  TRP  55           HD1      TRP  55   0.900  -6.847  -7.661
  434    HE1  TRP  55           HE1      TRP  55   3.073  -6.163  -6.441
  435    HE3  TRP  55           HE3      TRP  55  -1.059  -4.806  -3.420
  436    HZ2  TRP  55           HZ2      TRP  55   3.858  -4.956  -4.014
  437    HZ3  TRP  55           HZ3      TRP  55   0.430  -3.900  -1.666
  438    HH2  TRP  55           HH2      TRP  55   2.889  -3.963  -1.953
  439    H    VAL  56           HN       VAL  56  -0.311  -3.215  -6.925
  440    HA   VAL  56           HA       VAL  56  -1.284  -1.766  -4.585
  441    HB   VAL  56           HB       VAL  56   0.565  -0.971  -6.879
  442   1HG1  VAL  56          HG1       VAL  56  -0.663   0.587  -4.781
  443   2HG1  VAL  56          HG1       VAL  56   0.438   1.123  -6.048
  444   3HG1  VAL  56          HG1       VAL  56   1.079   0.522  -4.521
  445   1HG2  VAL  56          HG2       VAL  56   1.217  -2.875  -5.248
  446   2HG2  VAL  56          HG2       VAL  56   1.335  -1.604  -4.030
  447   3HG2  VAL  56          HG2       VAL  56   2.367  -1.556  -5.459
  448    H    GLN  57           HN       GLN  57  -1.247  -1.140  -8.099
  449    HA   GLN  57           HA       GLN  57  -2.971   1.096  -8.196
  450   1HB   GLN  57          HB2       GLN  57  -1.657  -0.651  -9.937
  451   2HB   GLN  57          HB1       GLN  57  -3.359  -0.882 -10.331
  452   1HG   GLN  57          HG2       GLN  57  -3.059   1.893 -10.020
  453   2HG   GLN  57          HG1       GLN  57  -1.638   1.378 -10.928
  454   1HE2  GLN  57          HE2       GLN  57  -1.969   0.455 -13.061
  455   2HE2  GLN  57          HE2       GLN  57  -3.472   0.532 -13.845
  456    H    ARG  58           HN       ARG  58  -3.735  -2.393  -8.229
  457    HA   ARG  58           HA       ARG  58  -6.568  -2.189  -8.513
  458   1HB   ARG  58          HB2       ARG  58  -5.314  -4.266  -8.782
  459   2HB   ARG  58          HB1       ARG  58  -4.757  -4.187  -7.110
  460   1HG   ARG  58          HG2       ARG  58  -7.119  -4.353  -6.345
  461   2HG   ARG  58          HG1       ARG  58  -7.629  -4.525  -8.026
  462   1HD   ARG  58          HD2       ARG  58  -5.592  -6.424  -7.744
  463   2HD   ARG  58          HD1       ARG  58  -6.524  -6.546  -6.237
  464    HE   ARG  58           HE       ARG  58  -8.388  -6.297  -8.354
  465   1HH1  ARG  58          HH2       ARG  58  -7.296  -8.554  -6.250
  466   2HH1  ARG  58          HH2       ARG  58  -7.473  -9.928  -7.292
  467   1HH2  ARG  58          HH1       ARG  58  -8.051  -8.030 -10.135
  468   2HH2  ARG  58          HH1       ARG  58  -7.903  -9.630  -9.491
  469    H    TYR  59           HN       TYR  59  -4.720  -2.822  -5.499
  470    HA   TYR  59           HA       TYR  59  -6.840  -2.376  -3.670
  471   1HB   TYR  59          HB2       TYR  59  -3.874  -1.762  -3.405
  472   2HB   TYR  59          HB1       TYR  59  -4.985  -2.015  -2.068
  473    HD1  TYR  59           HD1      TYR  59  -2.734  -3.637  -1.896
  474    HD2  TYR  59           HD2      TYR  59  -6.164  -4.283  -4.411
  475    HE1  TYR  59           HE1      TYR  59  -2.246  -6.065  -1.929
  476    HE2  TYR  59           HE2      TYR  59  -5.663  -6.712  -4.439
  477    HH   TYR  59           HH       TYR  59  -3.287  -8.102  -4.065
  478    H    MET  60           HN       MET  60  -4.534  -0.148  -5.136
  479    HA   MET  60           HA       MET  60  -5.210   2.233  -3.712
  480   1HB   MET  60          HB2       MET  60  -3.972   1.506  -6.352
  481   2HB   MET  60          HB1       MET  60  -4.253   3.198  -5.951
  482   1HG   MET  60          HG2       MET  60  -3.072   2.746  -3.746
  483   2HG   MET  60          HG1       MET  60  -2.569   1.202  -4.417
  484   1HE   MET  60          HE1       MET  60  -3.233   4.616  -5.078
  485   2HE   MET  60          HE2       MET  60  -2.221   5.123  -6.429
  486   3HE   MET  60          HE3       MET  60  -1.630   5.300  -4.779
  487    H    LYS  61           HN       LYS  61  -6.624   0.674  -6.569
  488    HA   LYS  61           HA       LYS  61  -8.283   2.822  -7.452
  489   1HB   LYS  61          HB2       LYS  61  -7.861   0.012  -7.919
  490   2HB   LYS  61          HB1       LYS  61  -9.594   0.324  -7.829
  491   1HG   LYS  61          HG2       LYS  61  -9.598   1.610  -9.723
  492   2HG   LYS  61          HG1       LYS  61  -8.003   2.284  -9.390
  493   1HD   LYS  61          HD2       LYS  61  -7.365   0.921 -11.106
  494   2HD   LYS  61          HD1       LYS  61  -7.339  -0.309  -9.840
  495   1HE   LYS  61          HE2       LYS  61  -8.862  -1.450 -11.083
  496   2HE   LYS  61          HE1       LYS  61 -10.029  -0.178 -10.663
  497   1HZ   LYS  61          HZ1       LYS  61  -9.032   1.158 -12.503
  498   2HZ   LYS  61          HZ2       LYS  61  -9.872  -0.224 -13.021
  499   3HZ   LYS  61          HZ3       LYS  61  -8.175  -0.226 -12.981
  500    H    ASN  62           HN       ASN  62  -8.670   0.421  -4.880
  501    HA   ASN  62           HA       ASN  62 -11.424   1.319  -4.298
  502   1HB   ASN  62          HB2       ASN  62  -9.845  -1.014  -3.968
  503   2HB   ASN  62          HB1       ASN  62 -10.230  -0.441  -2.344
  504   1HD2  ASN  62          HD2       ASN  62 -11.356  -2.819  -3.827
  505   2HD2  ASN  62          HD2       ASN  62 -13.036  -2.578  -3.843
  506    H    LEU  63           HN       LEU  63  -8.147   1.598  -3.007
  507    HA   LEU  63           HA       LEU  63  -8.845   2.785  -0.475
  508   1HB   LEU  63          HB2       LEU  63  -6.457   2.412  -2.220
  509   2HB   LEU  63          HB1       LEU  63  -6.342   3.659  -0.974
  510    HG   LEU  63           HG       LEU  63  -7.412   0.946  -0.257
  511   1HD1  LEU  63          HD1       LEU  63  -5.032   0.339   0.364
  512   2HD1  LEU  63          HD1       LEU  63  -4.502   1.723  -0.593
  513   3HD1  LEU  63          HD1       LEU  63  -5.347   0.385  -1.371
  514   1HD2  LEU  63          HD2       LEU  63  -7.554   2.208   1.645
  515   2HD2  LEU  63          HD2       LEU  63  -6.357   3.372   1.076
  516   3HD2  LEU  63          HD2       LEU  63  -5.834   1.844   1.785
  517    H    ASP  64           HN       ASP  64  -8.471   4.052  -3.729
  518    HA   ASP  64           HA       ASP  64  -8.234   6.847  -2.951
  519   1HB   ASP  64          HB2       ASP  64  -7.585   5.533  -5.129
  520   2HB   ASP  64          HB1       ASP  64  -9.257   5.842  -5.597
  521    H    ALA  65           HN       ALA  65 -10.882   4.624  -3.254
  522    HA   ALA  65           HA       ALA  65 -12.918   6.687  -3.736
  523   1HB   ALA  65          HB1       ALA  65 -14.420   4.685  -3.378
  524   2HB   ALA  65          HB2       ALA  65 -12.971   3.738  -3.032
  525   3HB   ALA  65          HB3       ALA  65 -13.196   4.453  -4.629
  526    H    LYS  66           HN       LYS  66 -11.080   6.175  -1.084
  527    HA   LYS  66           HA       LYS  66 -13.349   6.486   0.847
  528   1HB   LYS  66          HB2       LYS  66 -11.898   4.543   1.188
  529   2HB   LYS  66          HB1       LYS  66 -10.473   5.578   1.179
  530   1HG   LYS  66          HG2       LYS  66 -10.864   6.373   3.294
  531   2HG   LYS  66          HG1       LYS  66 -12.617   6.297   3.110
  532   1HD   LYS  66          HD2       LYS  66 -11.939   4.608   4.721
  533   2HD   LYS  66          HD1       LYS  66 -12.467   3.798   3.245
  534   1HE   LYS  66          HE2       LYS  66 -10.440   2.811   3.047
  535   2HE   LYS  66          HE1       LYS  66  -9.652   4.402   3.034
  536   1HZ   LYS  66          HZ1       LYS  66 -10.685   3.208   5.535
  537   2HZ   LYS  66          HZ2       LYS  66  -9.548   4.459   5.349
  538   3HZ   LYS  66          HZ3       LYS  66  -9.123   2.856   4.978
  539    H    GLN  67           HN       GLN  67 -11.010   8.296  -0.780
  540    HA   GLN  67           HA       GLN  67 -10.891  10.301   1.449
  541   1HB   GLN  67          HB2       GLN  67  -8.934   9.289  -0.584
  542   2HB   GLN  67          HB1       GLN  67  -8.780  10.958  -0.032
  543   1HG   GLN  67          HG2       GLN  67  -9.110   9.743   2.353
  544   2HG   GLN  67          HG1       GLN  67  -8.354   8.421   1.462
  545   1HE2  GLN  67          HE2       GLN  67  -6.103   8.528   1.182
  546   2HE2  GLN  67          HE2       GLN  67  -5.158   9.894   1.534
  547    H    LYS  68           HN       LYS  68 -11.293   9.781  -2.038
  548    HA   LYS  68           HA       LYS  68 -11.590  12.583  -2.723
  549   1HB   LYS  68          HB2       LYS  68 -12.148   9.909  -3.996
  550   2HB   LYS  68          HB1       LYS  68 -12.676  11.393  -4.792
  551   1HG   LYS  68          HG2       LYS  68 -10.264  12.229  -4.450
  552   2HG   LYS  68          HG1       LYS  68  -9.862  10.548  -4.097
  553   1HD   LYS  68          HD2       LYS  68  -9.794  10.091  -6.295
  554   2HD   LYS  68          HD1       LYS  68 -11.476  10.599  -6.458
  555   1HE   LYS  68          HE2       LYS  68 -10.781  12.931  -6.771
  556   2HE   LYS  68          HE1       LYS  68  -9.083  12.475  -6.525
  557   1HZ   LYS  68          HZ1       LYS  68 -10.883  11.408  -8.637
  558   2HZ   LYS  68          HZ2       LYS  68  -9.277  10.917  -8.376
  559   3HZ   LYS  68          HZ3       LYS  68  -9.612  12.505  -8.881
  560    H    LYS  69           HN       LYS  69 -13.225  13.588  -1.494
  561    HA   LYS  69           HA       LYS  69 -15.999  12.852  -2.195
  562   1HB   LYS  69          HB2       LYS  69 -16.638  12.587   0.170
  563   2HB   LYS  69          HB1       LYS  69 -15.372  11.432  -0.253
  564   1HG   LYS  69          HG2       LYS  69 -13.849  13.531   0.543
  565   2HG   LYS  69          HG1       LYS  69 -15.264  13.771   1.567
  566   1HD   LYS  69          HD2       LYS  69 -14.135  11.009   1.331
  567   2HD   LYS  69          HD1       LYS  69 -13.288  12.179   2.344
  568   1HE   LYS  69          HE2       LYS  69 -16.190  12.216   2.780
  569   2HE   LYS  69          HE1       LYS  69 -15.450  10.650   3.167
  570   1HZ   LYS  69          HZ1       LYS  69 -15.124  11.922   5.085
  571   2HZ   LYS  69          HZ2       LYS  69 -14.738  13.326   4.210
  572   3HZ   LYS  69          HZ3       LYS  69 -13.638  12.032   4.273
  573    H    ALA  70           HN       ALA  70 -17.497  14.490  -0.847
  574    HA   ALA  70           HA       ALA  70 -16.136  17.111  -0.462
  575   1HB   ALA  70          HB1       ALA  70 -18.607  17.096  -2.119
  576   2HB   ALA  70          HB2       ALA  70 -17.157  16.441  -2.879
  577   3HB   ALA  70          HB3       ALA  70 -17.163  18.095  -2.270
  578    H    SER  71           HN       SER  71 -16.788  17.343   1.687
  579    HA   SER  71           HA       SER  71 -19.741  17.202   2.217
  580   1HB   SER  71          HB2       SER  71 -17.411  16.630   4.076
  581   2HB   SER  71          HB1       SER  71 -19.119  16.436   4.463
  582    HG   SER  71           HG       SER  71 -17.647  15.063   2.455
  583    HA   PRO  72           HA       PRO  72 -18.129  21.476   3.064
  584   1HB   PRO  72          HB2       PRO  72 -20.133  22.807   1.776
  585   2HB   PRO  72          HB1       PRO  72 -18.659  22.251   0.959
  586   1HG   PRO  72          HG2       PRO  72 -21.371  21.041   1.000
  587   2HG   PRO  72          HG1       PRO  72 -20.207  21.165  -0.329
  588   1HD   PRO  72          HD2       PRO  72 -20.613  18.884   1.111
  589   2HD   PRO  72          HD1       PRO  72 -19.075  19.286   0.314
  590    H    ARG  73           HN       ARG  73 -19.859  23.409   3.801
  591    HA   ARG  73           HA       ARG  73 -21.373  22.153   6.034
  592   1HB   ARG  73          HB2       ARG  73 -20.266  24.881   5.372
  593   2HB   ARG  73          HB1       ARG  73 -21.440  24.684   6.673
  594   1HG   ARG  73          HG2       ARG  73 -20.001  23.313   7.934
  595   2HG   ARG  73          HG1       ARG  73 -18.997  22.926   6.536
  596   1HD   ARG  73          HD2       ARG  73 -17.695  24.502   7.750
  597   2HD   ARG  73          HD1       ARG  73 -18.474  25.490   6.497
  598    HE   ARG  73           HE       ARG  73 -19.823  26.476   8.177
  599   1HH1  ARG  73          HH2       ARG  73 -17.396  25.356   9.885
  600   2HH1  ARG  73          HH2       ARG  73 -18.279  24.780  11.259
  601   1HH2  ARG  73          HH1       ARG  73 -21.366  24.978   9.695
  602   2HH2  ARG  73          HH1       ARG  73 -20.526  24.565  11.152
  Start of MODEL   10
    1   1H    VAL   1          HT1       VAL   1  -5.368   9.012  10.649
    2   2H    VAL   1          HT2       VAL   1  -4.796   7.833  11.728
    3   3H    VAL   1          HT3       VAL   1  -4.794   7.532  10.056
    4    HA   VAL   1           HA       VAL   1  -3.253   9.801  11.156
    5    HB   VAL   1           HB       VAL   1  -2.735   7.752  12.454
    6   1HG1  VAL   1          HG1       VAL   1  -3.462   6.207  10.564
    7   2HG1  VAL   1          HG1       VAL   1  -1.972   5.745  11.386
    8   3HG1  VAL   1          HG1       VAL   1  -1.903   6.534   9.810
    9   1HG2  VAL   1          HG2       VAL   1  -0.338   7.740  10.809
   10   2HG2  VAL   1          HG2       VAL   1  -0.565   8.378  12.436
   11   3HG2  VAL   1          HG2       VAL   1  -0.939   9.382  11.037
   12    H    VAL   2           HN       VAL   2  -1.974  10.678   9.521
   13    HA   VAL   2           HA       VAL   2  -2.245   9.444   6.805
   14    HB   VAL   2           HB       VAL   2  -1.551  12.258   7.576
   15   1HG1  VAL   2          HG1       VAL   2  -1.646  12.765   5.344
   16   2HG1  VAL   2          HG1       VAL   2  -2.888  11.554   5.024
   17   3HG1  VAL   2          HG1       VAL   2  -1.201  11.066   5.192
   18   1HG2  VAL   2          HG2       VAL   2  -4.195  10.888   7.238
   19   2HG2  VAL   2          HG2       VAL   2  -4.037  12.576   6.753
   20   3HG2  VAL   2          HG2       VAL   2  -3.720  12.107   8.423
   21    H    ILE   3           HN       ILE   3  -0.476   8.363   6.226
   22    HA   ILE   3           HA       ILE   3   2.112   8.663   7.439
   23    HB   ILE   3           HB       ILE   3   1.328   6.591   6.460
   24   1HG1  ILE   3          HG1       ILE   3   3.197   6.645   4.410
   25   2HG1  ILE   3          HG1       ILE   3   3.754   7.923   5.491
   26   1HG2  ILE   3          HG2       ILE   3   0.405   8.339   4.386
   27   2HG2  ILE   3          HG2       ILE   3   0.048   6.627   4.614
   28   3HG2  ILE   3          HG2       ILE   3   1.451   7.117   3.661
   29   1HD1  ILE   3          HD1       ILE   3   4.220   5.213   5.833
   30   2HD1  ILE   3          HD1       ILE   3   2.880   5.532   6.933
   31   3HD1  ILE   3          HD1       ILE   3   4.380   6.446   7.082
   32    HA   PRO   4           HA       PRO   4   3.428  12.148   5.012
   33   1HB   PRO   4          HB2       PRO   4   6.075  12.113   5.710
   34   2HB   PRO   4          HB1       PRO   4   4.795  12.715   6.782
   35   1HG   PRO   4          HG2       PRO   4   6.236  10.121   6.828
   36   2HG   PRO   4          HG1       PRO   4   5.631  11.104   8.168
   37   1HD   PRO   4          HD2       PRO   4   4.392   8.842   7.201
   38   2HD   PRO   4          HD1       PRO   4   3.575  10.130   8.111
   39    H    SER   5           HN       SER   5   6.441  10.314   4.927
   40    HA   SER   5           HA       SER   5   5.936   9.064   2.355
   41   1HB   SER   5          HB2       SER   5   6.032  11.483   1.781
   42   2HB   SER   5          HB1       SER   5   7.644  11.569   2.486
   43    HG   SER   5           HG       SER   5   7.771  11.240   0.250
   44    HA   PRO   6           HA       PRO   6   9.749   7.899   4.881
   45   1HB   PRO   6          HB2       PRO   6   8.864   5.507   5.853
   46   2HB   PRO   6          HB1       PRO   6   8.656   7.041   6.720
   47   1HG   PRO   6          HG2       PRO   6   6.707   5.520   5.073
   48   2HG   PRO   6          HG1       PRO   6   6.459   6.411   6.582
   49   1HD   PRO   6          HD2       PRO   6   5.765   7.384   4.134
   50   2HD   PRO   6          HD1       PRO   6   6.207   8.416   5.510
   51    H    CYS   7           HN       CYS   7  10.639   5.339   4.699
   52    HA   CYS   7           HA       CYS   7  10.031   4.395   1.926
   53   1HB   CYS   7          HB2       CYS   7  12.774   4.953   3.105
   54   2HB   CYS   7          HB1       CYS   7  12.457   4.327   1.486
   55    H    CYS   8           HN       CYS   8  11.390   2.241   1.596
   56    HA   CYS   8           HA       CYS   8  11.167   0.629   4.122
   57   1HB   CYS   8          HB2       CYS   8  10.766  -0.263   1.249
   58   2HB   CYS   8          HB1       CYS   8  10.409  -1.195   2.699
   59    H    MET   9           HN       MET   9  12.404  -1.646   3.464
   60    HA   MET   9           HA       MET   9  15.207  -0.801   2.888
   61   1HB   MET   9          HB2       MET   9  14.730  -1.929   5.013
   62   2HB   MET   9          HB1       MET   9  13.976  -3.273   4.152
   63   1HG   MET   9          HG2       MET   9  16.139  -3.732   3.019
   64   2HG   MET   9          HG1       MET   9  16.883  -2.434   3.950
   65   1HE   MET   9          HE1       MET   9  18.643  -5.076   5.564
   66   2HE   MET   9          HE2       MET   9  18.400  -3.501   6.315
   67   3HE   MET   9          HE3       MET   9  18.538  -3.622   4.562
   68    H    PHE  10           HN       PHE  10  12.562  -2.605   1.547
   69    HA   PHE  10           HA       PHE  10  14.150  -3.232  -0.853
   70   1HB   PHE  10          HB2       PHE  10  13.827  -5.650  -0.635
   71   2HB   PHE  10          HB1       PHE  10  14.634  -5.045   0.811
   72    HD1  PHE  10           HD1      PHE  10  11.904  -6.966  -0.400
   73    HD2  PHE  10           HD2      PHE  10  13.040  -4.315   2.785
   74    HE1  PHE  10           HE1      PHE  10  10.064  -7.859   1.001
   75    HE2  PHE  10           HE2      PHE  10  11.200  -5.210   4.185
   76    HZ   PHE  10           HZ       PHE  10   9.711  -6.982   3.294
   77    H    PHE  11           HN       PHE  11  12.427  -5.016  -2.068
   78    HA   PHE  11           HA       PHE  11   9.812  -3.546  -2.065
   79   1HB   PHE  11          HB2       PHE  11  11.763  -4.121  -4.106
   80   2HB   PHE  11          HB1       PHE  11  10.252  -4.933  -4.513
   81    HD1  PHE  11           HD1      PHE  11  11.841  -2.242  -5.525
   82    HD2  PHE  11           HD2      PHE  11   8.247  -3.106  -3.336
   83    HE1  PHE  11           HE1      PHE  11  10.873  -0.080  -6.257
   84    HE2  PHE  11           HE2      PHE  11   7.281  -0.944  -4.067
   85    HZ   PHE  11           HZ       PHE  11   8.593   0.570  -5.529
   86    H    VAL  12           HN       VAL  12   7.923  -4.837  -2.177
   87    HA   VAL  12           HA       VAL  12   7.877  -7.347  -0.918
   88    HB   VAL  12           HB       VAL  12   5.605  -7.499  -2.034
   89   1HG1  VAL  12          HG1       VAL  12   6.649  -5.251  -0.427
   90   2HG1  VAL  12          HG1       VAL  12   5.296  -6.337  -0.104
   91   3HG1  VAL  12          HG1       VAL  12   5.087  -4.964  -1.192
   92   1HG2  VAL  12          HG2       VAL  12   5.620  -4.829  -3.120
   93   2HG2  VAL  12          HG2       VAL  12   5.208  -6.340  -3.928
   94   3HG2  VAL  12          HG2       VAL  12   6.879  -5.783  -3.903
   95    H    SER  13           HN       SER  13   8.235  -9.437  -1.629
   96    HA   SER  13           HA       SER  13   9.580  -9.987  -4.080
   97   1HB   SER  13          HB2       SER  13   8.667 -12.382  -3.418
   98   2HB   SER  13          HB1       SER  13   9.841 -11.574  -2.382
   99    HG   SER  13           HG       SER  13   8.259 -12.086  -1.005
  100    H    LYS  14           HN       LYS  14   6.194  -9.657  -3.309
  101    HA   LYS  14           HA       LYS  14   5.482  -9.854  -6.144
  102   1HB   LYS  14          HB2       LYS  14   3.950 -11.760  -5.794
  103   2HB   LYS  14          HB1       LYS  14   5.604 -12.213  -5.377
  104   1HG   LYS  14          HG2       LYS  14   5.157 -11.927  -3.016
  105   2HG   LYS  14          HG1       LYS  14   3.566 -11.246  -3.354
  106   1HD   LYS  14          HD2       LYS  14   3.676 -13.739  -4.697
  107   2HD   LYS  14          HD1       LYS  14   4.306 -14.013  -3.072
  108   1HE   LYS  14          HE2       LYS  14   1.834 -12.341  -3.328
  109   2HE   LYS  14          HE1       LYS  14   1.679 -14.098  -3.538
  110   1HZ   LYS  14          HZ1       LYS  14   3.068 -14.314  -1.479
  111   2HZ   LYS  14          HZ2       LYS  14   1.510 -13.682  -1.225
  112   3HZ   LYS  14          HZ3       LYS  14   2.858 -12.649  -1.232
  113    H    ARG  15           HN       ARG  15   2.700 -10.257  -5.729
  114    HA   ARG  15           HA       ARG  15   1.957  -7.614  -4.711
  115   1HB   ARG  15          HB2       ARG  15  -0.239  -8.260  -5.608
  116   2HB   ARG  15          HB1       ARG  15   1.029  -8.662  -6.763
  117   1HG   ARG  15          HG2       ARG  15   0.646 -10.858  -4.927
  118   2HG   ARG  15          HG1       ARG  15  -0.891 -10.417  -5.672
  119   1HD   ARG  15          HD2       ARG  15   0.056 -10.633  -7.900
  120   2HD   ARG  15          HD1       ARG  15   1.675 -10.904  -7.225
  121    HE   ARG  15           HE       ARG  15  -0.479 -12.744  -6.344
  122   1HH1  ARG  15          HH1       ARG  15   1.155 -12.491  -9.194
  123   2HH1  ARG  15          HH1       ARG  15   2.035 -13.977  -9.060
  124   1HH2  ARG  15          HH2       ARG  15   1.158 -14.504  -5.747
  125   2HH2  ARG  15          HH2       ARG  15   2.038 -15.116  -7.108
  126    H    ILE  16           HN       ILE  16  -0.688  -8.508  -3.769
  127    HA   ILE  16           HA       ILE  16  -0.069 -10.032  -1.278
  128    HB   ILE  16           HB       ILE  16  -1.558  -7.434  -1.060
  129   1HG1  ILE  16          HG1       ILE  16   1.473  -7.635  -1.198
  130   2HG1  ILE  16          HG1       ILE  16   0.439  -6.766  -2.329
  131   1HG2  ILE  16          HG2       ILE  16  -1.516  -8.439   0.990
  132   2HG2  ILE  16          HG2       ILE  16   0.006  -7.564   1.104
  133   3HG2  ILE  16          HG2       ILE  16   0.001  -9.271   0.672
  134   1HD1  ILE  16          HD1       ILE  16   0.558  -6.136   0.633
  135   2HD1  ILE  16          HD1       ILE  16  -0.216  -5.184  -0.632
  136   3HD1  ILE  16          HD1       ILE  16   1.542  -5.308  -0.573
  137    HA   PRO  17           HA       PRO  17  -4.268 -11.212  -2.076
  138   1HB   PRO  17          HB2       PRO  17  -4.910 -12.376   0.308
  139   2HB   PRO  17          HB1       PRO  17  -3.839 -13.137  -0.885
  140   1HG   PRO  17          HG2       PRO  17  -3.192 -11.872   1.676
  141   2HG   PRO  17          HG1       PRO  17  -2.304 -13.094   0.758
  142   1HD   PRO  17          HD2       PRO  17  -1.748 -10.327   0.922
  143   2HD   PRO  17          HD1       PRO  17  -0.953 -11.515  -0.127
  144    H    GLU  18           HN       GLU  18  -5.713  -9.516  -2.212
  145    HA   GLU  18           HA       GLU  18  -6.072  -7.305  -0.606
  146   1HB   GLU  18          HB2       GLU  18  -7.254  -8.347  -2.789
  147   2HB   GLU  18          HB1       GLU  18  -8.538  -8.636  -1.615
  148   1HG   GLU  18          HG2       GLU  18  -9.142  -6.491  -2.056
  149   2HG   GLU  18          HG1       GLU  18  -7.796  -6.067  -0.999
  150    H    ASN  19           HN       ASN  19  -7.275 -10.559   0.087
  151    HA   ASN  19           HA       ASN  19  -9.120  -9.828   2.172
  152   1HB   ASN  19          HB2       ASN  19  -7.953 -12.176   0.934
  153   2HB   ASN  19          HB1       ASN  19  -8.055 -12.387   2.682
  154   1HD2  ASN  19          HD2       ASN  19  -9.732 -13.846   0.817
  155   2HD2  ASN  19          HD2       ASN  19 -11.337 -13.361   1.081
  156    H    ARG  20           HN       ARG  20  -5.707  -9.665   2.081
  157    HA   ARG  20           HA       ARG  20  -5.528  -9.858   5.055
  158   1HB   ARG  20          HB2       ARG  20  -3.520 -10.194   2.810
  159   2HB   ARG  20          HB1       ARG  20  -3.115 -10.284   4.519
  160   1HG   ARG  20          HG2       ARG  20  -5.103 -12.031   4.570
  161   2HG   ARG  20          HG1       ARG  20  -4.715 -12.183   2.857
  162   1HD   ARG  20          HD2       ARG  20  -2.440 -12.825   3.344
  163   2HD   ARG  20          HD1       ARG  20  -2.648 -12.440   5.065
  164    HE   ARG  20           HE       ARG  20  -4.422 -14.485   3.817
  165   1HH1  ARG  20          HH2       ARG  20  -1.367 -14.453   5.094
  166   2HH1  ARG  20          HH2       ARG  20  -1.701 -15.505   6.431
  167   1HH2  ARG  20          HH1       ARG  20  -5.136 -15.451   5.957
  168   2HH2  ARG  20          HH1       ARG  20  -3.836 -16.069   6.920
  169    H    VAL  21           HN       VAL  21  -4.791  -7.841   2.237
  170    HA   VAL  21           HA       VAL  21  -3.206  -5.878   3.644
  171    HB   VAL  21           HB       VAL  21  -4.919  -5.582   1.156
  172   1HG1  VAL  21          HG1       VAL  21  -3.740  -3.579   2.425
  173   2HG1  VAL  21          HG1       VAL  21  -3.653  -3.689   0.667
  174   3HG1  VAL  21          HG1       VAL  21  -2.291  -4.222   1.655
  175   1HG2  VAL  21          HG2       VAL  21  -2.714  -6.145   0.006
  176   2HG2  VAL  21          HG2       VAL  21  -3.512  -7.493   0.812
  177   3HG2  VAL  21          HG2       VAL  21  -2.138  -6.697   1.577
  178    H    VAL  22           HN       VAL  22  -3.882  -3.783   4.411
  179    HA   VAL  22           HA       VAL  22  -6.818  -3.535   4.887
  180    HB   VAL  22           HB       VAL  22  -6.079  -2.424   7.024
  181   1HG1  VAL  22          HG1       VAL  22  -6.548  -4.996   6.550
  182   2HG1  VAL  22          HG1       VAL  22  -6.025  -4.430   8.137
  183   3HG1  VAL  22          HG1       VAL  22  -4.854  -5.133   7.021
  184   1HG2  VAL  22          HG2       VAL  22  -3.380  -3.532   6.227
  185   2HG2  VAL  22          HG2       VAL  22  -3.771  -2.813   7.782
  186   3HG2  VAL  22          HG2       VAL  22  -3.792  -1.823   6.327
  187    H    SER  23           HN       SER  23  -3.754  -1.799   4.424
  188    HA   SER  23           HA       SER  23  -5.027   0.309   2.889
  189   1HB   SER  23          HB2       SER  23  -5.903   0.954   5.015
  190   2HB   SER  23          HB1       SER  23  -4.365   0.654   5.817
  191    HG   SER  23           HG       SER  23  -3.999   2.689   5.444
  192    H    TYR  24           HN       TYR  24  -3.417   1.603   1.881
  193    HA   TYR  24           HA       TYR  24  -0.638   0.710   2.381
  194   1HB   TYR  24          HB2       TYR  24  -0.298   1.401   0.096
  195   2HB   TYR  24          HB1       TYR  24  -1.810   0.503   0.155
  196    HD1  TYR  24           HD1      TYR  24  -0.317   3.904  -0.032
  197    HD2  TYR  24           HD2      TYR  24  -3.922   1.578  -0.258
  198    HE1  TYR  24           HE1      TYR  24  -1.533   5.868  -0.933
  199    HE2  TYR  24           HE2      TYR  24  -5.135   3.539  -1.162
  200    HH   TYR  24           HH       TYR  24  -4.955   5.643  -1.902
  201    H    GLN  25           HN       GLN  25   1.022   2.200   2.744
  202    HA   GLN  25           HA       GLN  25   0.211   4.995   3.427
  203   1HB   GLN  25          HB2       GLN  25   2.417   3.100   4.273
  204   2HB   GLN  25          HB1       GLN  25   2.525   4.829   4.601
  205   1HG   GLN  25          HG2       GLN  25   0.697   4.803   6.057
  206   2HG   GLN  25          HG1       GLN  25   0.029   3.333   5.350
  207   1HE2  GLN  25          HE2       GLN  25   1.172   1.261   5.868
  208   2HE2  GLN  25          HE2       GLN  25   2.094   1.148   7.289
  209    H    LEU  26           HN       LEU  26   0.410   5.980   1.372
  210    HA   LEU  26           HA       LEU  26   2.394   5.309  -0.560
  211   1HB   LEU  26          HB2       LEU  26   0.232   7.187  -0.154
  212   2HB   LEU  26          HB1       LEU  26   1.588   7.968  -0.971
  213    HG   LEU  26           HG       LEU  26   0.255   5.379  -1.823
  214   1HD1  LEU  26          HD1       LEU  26  -0.886   6.586  -3.416
  215   2HD1  LEU  26          HD1       LEU  26   0.374   7.815  -3.538
  216   3HD1  LEU  26          HD1       LEU  26  -0.755   7.842  -2.185
  217   1HD2  LEU  26          HD2       LEU  26   2.634   6.927  -2.876
  218   2HD2  LEU  26          HD2       LEU  26   1.739   5.787  -3.879
  219   3HD2  LEU  26          HD2       LEU  26   2.562   5.225  -2.429
  220    H    SER  27           HN       SER  27   4.245   6.461  -1.238
  221    HA   SER  27           HA       SER  27   5.388   8.465   0.630
  222   1HB   SER  27          HB2       SER  27   6.518   5.791  -0.210
  223   2HB   SER  27          HB1       SER  27   7.565   7.082   0.365
  224    HG   SER  27           HG       SER  27   6.415   7.095   2.296
  225    H    SER  28           HN       SER  28   7.884   8.696  -0.658
  226    HA   SER  28           HA       SER  28   7.358   8.993  -3.557
  227   1HB   SER  28          HB2       SER  28   6.920  11.059  -1.651
  228   2HB   SER  28          HB1       SER  28   8.360  11.496  -2.567
  229    HG   SER  28           HG       SER  28   6.486  12.211  -3.626
  230    H    ARG  29           HN       ARG  29   9.425  10.263  -4.489
  231    HA   ARG  29           HA       ARG  29  11.820   8.927  -3.288
  232   1HB   ARG  29          HB2       ARG  29  10.864   8.520  -5.684
  233   2HB   ARG  29          HB1       ARG  29  11.594  10.081  -6.063
  234   1HG   ARG  29          HG2       ARG  29  13.783   9.291  -5.393
  235   2HG   ARG  29          HG1       ARG  29  13.102   7.776  -4.798
  236   1HD   ARG  29          HD2       ARG  29  14.022   7.314  -6.986
  237   2HD   ARG  29          HD1       ARG  29  12.259   7.373  -7.185
  238    HE   ARG  29           HE       ARG  29  12.645   9.852  -7.795
  239   1HH1  ARG  29          HH2       ARG  29  13.650   7.447  -9.651
  240   2HH1  ARG  29          HH2       ARG  29  15.055   8.210 -10.317
  241   1HH2  ARG  29          HH1       ARG  29  15.046  10.821  -8.036
  242   2HH2  ARG  29          HH1       ARG  29  15.845  10.119  -9.403
  243    H    SER  30           HN       SER  30  11.052  11.327  -2.056
  244    HA   SER  30           HA       SER  30  12.500  13.573  -3.286
  245   1HB   SER  30          HB2       SER  30  11.811  14.512  -0.919
  246   2HB   SER  30          HB1       SER  30  10.570  14.210  -2.131
  247    HG   SER  30           HG       SER  30  10.122  13.302  -0.032
  248    H    THR  31           HN       THR  31  12.879  11.474  -0.413
  249    HA   THR  31           HA       THR  31  15.787  12.177  -0.400
  250    HB   THR  31           HB       THR  31  14.646  13.576   1.246
  251    HG1  THR  31           HG1      THR  31  16.650  12.404   1.781
  252   1HG2  THR  31          HG2       THR  31  12.604  12.520   1.691
  253   2HG2  THR  31          HG2       THR  31  13.504  12.249   3.184
  254   3HG2  THR  31          HG2       THR  31  13.368  10.958   1.989
  255    H    CYS  32           HN       CYS  32  15.260   9.863  -1.544
  256    HA   CYS  32           HA       CYS  32  16.114   7.841   0.421
  257   1HB   CYS  32          HB2       CYS  32  13.367   8.100  -0.688
  258   2HB   CYS  32          HB1       CYS  32  14.034   6.469  -0.649
  259    H    LEU  33           HN       LEU  33  16.753   5.815  -0.683
  260    HA   LEU  33           HA       LEU  33  17.993   6.284  -3.262
  261   1HB   LEU  33          HB2       LEU  33  18.936   4.841  -1.508
  262   2HB   LEU  33          HB1       LEU  33  17.527   3.784  -1.599
  263    HG   LEU  33           HG       LEU  33  18.383   3.947  -4.239
  264   1HD1  LEU  33          HD1       LEU  33  20.868   3.187  -2.813
  265   2HD1  LEU  33          HD1       LEU  33  20.511   4.915  -2.845
  266   3HD1  LEU  33          HD1       LEU  33  20.663   4.016  -4.356
  267   1HD2  LEU  33          HD2       LEU  33  17.852   1.798  -3.732
  268   2HD2  LEU  33          HD2       LEU  33  18.325   1.991  -2.044
  269   3HD2  LEU  33          HD2       LEU  33  19.546   1.635  -3.265
  270    H    LYS  34           HN       LYS  34  14.925   5.002  -2.211
  271    HA   LYS  34           HA       LYS  34  14.105   4.641  -5.039
  272   1HB   LYS  34          HB2       LYS  34  14.673   2.521  -3.069
  273   2HB   LYS  34          HB1       LYS  34  13.100   2.364  -3.854
  274   1HG   LYS  34          HG2       LYS  34  14.269   2.659  -6.071
  275   2HG   LYS  34          HG1       LYS  34  15.803   2.566  -5.205
  276   1HD   LYS  34          HD2       LYS  34  15.289   0.332  -4.415
  277   2HD   LYS  34          HD1       LYS  34  13.662   0.425  -5.088
  278   1HE   LYS  34          HE2       LYS  34  14.803  -0.772  -6.761
  279   2HE   LYS  34          HE1       LYS  34  14.960   0.895  -7.352
  280   1HZ   LYS  34          HZ1       LYS  34  17.090  -0.471  -7.132
  281   2HZ   LYS  34          HZ2       LYS  34  16.913  -0.257  -5.457
  282   3HZ   LYS  34          HZ3       LYS  34  17.093   1.091  -6.474
  283    H    ALA  35           HN       ALA  35  11.643   4.118  -5.055
  284    HA   ALA  35           HA       ALA  35  10.285   5.282  -2.651
  285   1HB   ALA  35          HB1       ALA  35   8.970   6.692  -4.169
  286   2HB   ALA  35          HB2       ALA  35   9.787   5.984  -5.563
  287   3HB   ALA  35          HB3       ALA  35  10.690   6.986  -4.426
  288    H    GLY  36           HN       GLY  36   7.699   5.240  -3.774
  289   1HA   GLY  36          HA2       GLY  36   6.381   3.464  -5.079
  290   2HA   GLY  36          HA1       GLY  36   7.264   2.298  -4.092
  291    H    VAL  37           HN       VAL  37   4.865   1.747  -3.506
  292    HA   VAL  37           HA       VAL  37   3.862   3.652  -1.418
  293    HB   VAL  37           HB       VAL  37   2.483   1.303  -2.749
  294   1HG1  VAL  37          HG1       VAL  37   1.555   3.641  -1.068
  295   2HG1  VAL  37          HG1       VAL  37   1.376   1.924  -0.718
  296   3HG1  VAL  37          HG1       VAL  37   0.448   2.659  -2.026
  297   1HG2  VAL  37          HG2       VAL  37   3.165   3.928  -3.782
  298   2HG2  VAL  37          HG2       VAL  37   1.414   3.729  -3.692
  299   3HG2  VAL  37          HG2       VAL  37   2.387   2.578  -4.610
  300    H    ILE  38           HN       ILE  38   2.798   2.447   0.492
  301    HA   ILE  38           HA       ILE  38   4.430   0.034   1.221
  302    HB   ILE  38           HB       ILE  38   3.564   2.459   2.822
  303   1HG1  ILE  38          HG1       ILE  38   6.220   2.227   3.198
  304   2HG1  ILE  38          HG1       ILE  38   6.099   1.465   1.613
  305   1HG2  ILE  38          HG2       ILE  38   3.336   0.731   4.391
  306   2HG2  ILE  38          HG2       ILE  38   5.013   1.226   4.617
  307   3HG2  ILE  38          HG2       ILE  38   4.639  -0.220   3.679
  308   1HD1  ILE  38          HD1       ILE  38   6.487   3.863   1.335
  309   2HD1  ILE  38          HD1       ILE  38   5.093   4.229   2.347
  310   3HD1  ILE  38          HD1       ILE  38   4.864   3.464   0.777
  311    H    PHE  39           HN       PHE  39   2.995  -1.712   1.342
  312    HA   PHE  39           HA       PHE  39   0.208  -1.095   2.226
  313   1HB   PHE  39          HB2       PHE  39   1.492  -3.224   0.531
  314   2HB   PHE  39          HB1       PHE  39  -0.097  -3.497   1.242
  315    HD1  PHE  39           HD1      PHE  39  -1.974  -2.806   0.053
  316    HD2  PHE  39           HD2      PHE  39   1.785  -0.845  -0.618
  317    HE1  PHE  39           HE1      PHE  39  -3.011  -1.421  -1.723
  318    HE2  PHE  39           HE2      PHE  39   0.748   0.532  -2.392
  319    HZ   PHE  39           HZ       PHE  39  -1.651   0.252  -2.946
  320    H    THR  40           HN       THR  40  -0.401  -1.749   4.210
  321    HA   THR  40           HA       THR  40   1.367  -3.586   5.726
  322    HB   THR  40           HB       THR  40  -0.864  -1.661   6.438
  323    HG1  THR  40           HG1      THR  40   0.737  -0.394   7.034
  324   1HG2  THR  40          HG2       THR  40   0.518  -2.468   8.766
  325   2HG2  THR  40          HG2       THR  40   0.110  -3.952   7.901
  326   3HG2  THR  40          HG2       THR  40  -1.162  -2.814   8.346
  327    H    THR  41           HN       THR  41   0.528  -5.508   6.616
  328    HA   THR  41           HA       THR  41  -1.957  -6.513   5.367
  329    HB   THR  41           HB       THR  41  -0.100  -8.064   7.146
  330    HG1  THR  41           HG1      THR  41   1.241  -8.357   5.333
  331   1HG2  THR  41          HG2       THR  41  -1.338  -8.869   4.521
  332   2HG2  THR  41          HG2       THR  41  -2.242  -8.959   6.033
  333   3HG2  THR  41          HG2       THR  41  -0.767  -9.904   5.829
  334    H    LYS  42           HN       LYS  42  -3.677  -7.373   6.677
  335    HA   LYS  42           HA       LYS  42  -4.294  -6.001   9.092
  336   1HB   LYS  42          HB2       LYS  42  -6.106  -7.682   9.216
  337   2HB   LYS  42          HB1       LYS  42  -5.908  -7.100   7.562
  338   1HG   LYS  42          HG2       LYS  42  -4.725  -9.073   6.908
  339   2HG   LYS  42          HG1       LYS  42  -4.535  -9.596   8.583
  340   1HD   LYS  42          HD2       LYS  42  -7.249  -9.366   8.425
  341   2HD   LYS  42          HD1       LYS  42  -6.862  -9.862   6.778
  342   1HE   LYS  42          HE2       LYS  42  -5.285 -11.598   8.127
  343   2HE   LYS  42          HE1       LYS  42  -6.583 -11.386   9.318
  344   1HZ   LYS  42          HZ1       LYS  42  -6.977 -13.117   7.526
  345   2HZ   LYS  42          HZ2       LYS  42  -7.144 -11.817   6.443
  346   3HZ   LYS  42          HZ3       LYS  42  -8.209 -11.975   7.759
  347    H    LYS  43           HN       LYS  43  -2.414  -8.877   8.467
  348    HA   LYS  43           HA       LYS  43  -2.523 -10.151  11.012
  349   1HB   LYS  43          HB2       LYS  43  -1.261 -10.456   8.552
  350   2HB   LYS  43          HB1       LYS  43   0.081 -10.183   9.663
  351   1HG   LYS  43          HG2       LYS  43  -1.852 -11.974  10.854
  352   2HG   LYS  43          HG1       LYS  43  -1.341 -12.587   9.281
  353   1HD   LYS  43          HD2       LYS  43   0.837 -11.514  10.972
  354   2HD   LYS  43          HD1       LYS  43   0.065 -12.977  11.584
  355   1HE   LYS  43          HE2       LYS  43   0.661 -14.241   9.686
  356   2HE   LYS  43          HE1       LYS  43   0.926 -12.792   8.694
  357   1HZ   LYS  43          HZ1       LYS  43   2.573 -13.793  10.943
  358   2HZ   LYS  43          HZ2       LYS  43   2.681 -12.188  10.397
  359   3HZ   LYS  43          HZ3       LYS  43   3.060 -13.473   9.352
  360    H    GLY  44           HN       GLY  44  -0.844  -7.276   9.917
  361   1HA   GLY  44          HA2       GLY  44  -0.234  -5.644  11.694
  362   2HA   GLY  44          HA1       GLY  44   0.349  -7.015  12.636
  363    H    GLN  45           HN       GLN  45   0.932  -6.831   9.184
  364    HA   GLN  45           HA       GLN  45   3.850  -6.535   9.787
  365   1HB   GLN  45          HB2       GLN  45   2.474  -8.458   8.435
  366   2HB   GLN  45          HB1       GLN  45   2.902  -7.376   7.108
  367   1HG   GLN  45          HG2       GLN  45   4.939  -8.347   7.109
  368   2HG   GLN  45          HG1       GLN  45   5.230  -7.541   8.651
  369   1HE2  GLN  45          HE2       GLN  45   5.410 -10.540   7.285
  370   2HE2  GLN  45          HE2       GLN  45   5.099 -11.503   8.648
  371    H    GLN  46           HN       GLN  46   4.833  -5.707   7.392
  372    HA   GLN  46           HA       GLN  46   3.328  -3.422   6.328
  373   1HB   GLN  46          HB2       GLN  46   5.095  -3.213   8.598
  374   2HB   GLN  46          HB1       GLN  46   5.776  -2.308   7.246
  375   1HG   GLN  46          HG2       GLN  46   3.829  -0.960   7.030
  376   2HG   GLN  46          HG1       GLN  46   2.874  -2.040   8.046
  377   1HE2  GLN  46          HE2       GLN  46   3.207  -1.936  10.380
  378   2HE2  GLN  46          HE2       GLN  46   4.048  -0.649  11.098
  379    H    SER  47           HN       SER  47   3.760  -4.022   4.199
  380    HA   SER  47           HA       SER  47   6.635  -4.473   3.459
  381   1HB   SER  47          HB2       SER  47   4.259  -5.975   3.066
  382   2HB   SER  47          HB1       SER  47   4.722  -5.347   1.487
  383    HG   SER  47           HG       SER  47   6.153  -7.002   3.261
  384    H    CYS  48           HN       CYS  48   7.261  -3.615   1.320
  385    HA   CYS  48           HA       CYS  48   5.925  -1.026   0.752
  386   1HB   CYS  48          HB2       CYS  48   8.561  -1.969   0.897
  387   2HB   CYS  48          HB1       CYS  48   8.278  -1.707  -0.823
  388    H    GLY  49           HN       GLY  49   4.457  -0.935  -0.912
  389   1HA   GLY  49          HA2       GLY  49   4.374  -3.140  -2.871
  390   2HA   GLY  49          HA1       GLY  49   3.169  -1.869  -2.703
  391    H    ASP  50           HN       ASP  50   4.825  -2.871  -5.035
  392    HA   ASP  50           HA       ASP  50   6.416  -0.489  -5.751
  393   1HB   ASP  50          HB2       ASP  50   7.260  -2.705  -6.286
  394   2HB   ASP  50          HB1       ASP  50   5.763  -3.114  -7.125
  395    HA   PRO  51           HA       PRO  51   2.757   1.289  -7.601
  396   1HB   PRO  51          HB2       PRO  51   3.997   3.425  -8.799
  397   2HB   PRO  51          HB1       PRO  51   3.606   3.375  -7.068
  398   1HG   PRO  51          HG2       PRO  51   6.199   2.839  -8.434
  399   2HG   PRO  51          HG1       PRO  51   5.877   3.719  -6.930
  400   1HD   PRO  51          HD2       PRO  51   6.798   1.175  -6.958
  401   2HD   PRO  51          HD1       PRO  51   5.731   1.789  -5.678
  402    H    LYS  52           HN       LYS  52   5.751   0.533  -9.281
  403    HA   LYS  52           HA       LYS  52   4.849   0.803 -11.981
  404   1HB   LYS  52          HB2       LYS  52   7.020  -0.452 -10.431
  405   2HB   LYS  52          HB1       LYS  52   6.654  -1.293 -11.937
  406   1HG   LYS  52          HG2       LYS  52   8.354   0.436 -12.322
  407   2HG   LYS  52          HG1       LYS  52   6.863   0.842 -13.171
  408   1HD   LYS  52          HD2       LYS  52   6.596   1.959 -10.598
  409   2HD   LYS  52          HD1       LYS  52   8.240   2.332 -11.110
  410   1HE   LYS  52          HE2       LYS  52   7.538   3.700 -12.821
  411   2HE   LYS  52          HE1       LYS  52   6.103   2.711 -13.154
  412   1HZ   LYS  52          HZ1       LYS  52   5.631   4.889 -12.040
  413   2HZ   LYS  52          HZ2       LYS  52   6.449   4.300 -10.672
  414   3HZ   LYS  52          HZ3       LYS  52   5.037   3.529 -11.219
  415    H    GLN  53           HN       GLN  53   4.326  -1.619  -9.504
  416    HA   GLN  53           HA       GLN  53   3.308  -3.681 -11.303
  417   1HB   GLN  53          HB2       GLN  53   3.891  -3.243  -8.471
  418   2HB   GLN  53          HB1       GLN  53   2.404  -4.165  -8.708
  419   1HG   GLN  53          HG2       GLN  53   3.529  -5.986  -9.436
  420   2HG   GLN  53          HG1       GLN  53   4.555  -5.021 -10.498
  421   1HE2  GLN  53          HE2       GLN  53   6.719  -5.031  -9.899
  422   2HE2  GLN  53          HE2       GLN  53   7.295  -5.257  -8.317
  423    H    GLU  54           HN       GLU  54   1.014  -4.411 -11.176
  424    HA   GLU  54           HA       GLU  54  -0.821  -2.089 -11.262
  425   1HB   GLU  54          HB2       GLU  54  -2.304  -3.777 -12.308
  426   2HB   GLU  54          HB1       GLU  54  -0.711  -3.761 -13.066
  427   1HG   GLU  54          HG2       GLU  54  -0.414  -5.927 -12.551
  428   2HG   GLU  54          HG1       GLU  54  -0.653  -5.568 -10.839
  429    H    TRP  55           HN       TRP  55  -0.086  -4.695  -9.051
  430    HA   TRP  55           HA       TRP  55  -2.747  -4.783  -7.871
  431   1HB   TRP  55          HB2       TRP  55  -1.746  -6.308  -6.330
  432   2HB   TRP  55          HB1       TRP  55  -1.031  -6.623  -7.902
  433    HD1  TRP  55           HD1      TRP  55   1.519  -6.424  -8.121
  434    HE1  TRP  55           HE1      TRP  55   3.422  -5.858  -6.469
  435    HE3  TRP  55           HE3      TRP  55  -1.199  -4.657  -4.175
  436    HZ2  TRP  55           HZ2      TRP  55   3.742  -4.835  -3.864
  437    HZ3  TRP  55           HZ3      TRP  55  -0.060  -3.890  -2.112
  438    HH2  TRP  55           HH2      TRP  55   2.417  -3.970  -1.953
  439    H    VAL  56           HN       VAL  56   0.168  -2.850  -7.265
  440    HA   VAL  56           HA       VAL  56  -0.811  -1.811  -4.712
  441    HB   VAL  56           HB       VAL  56   1.141  -0.643  -6.738
  442   1HG1  VAL  56          HG1       VAL  56   0.062   0.276  -4.198
  443   2HG1  VAL  56          HG1       VAL  56   1.081   1.142  -5.346
  444   3HG1  VAL  56          HG1       VAL  56   1.813   0.108  -4.118
  445   1HG2  VAL  56          HG2       VAL  56   1.753  -2.926  -5.867
  446   2HG2  VAL  56          HG2       VAL  56   1.712  -2.260  -4.234
  447   3HG2  VAL  56          HG2       VAL  56   2.889  -1.662  -5.400
  448    H    GLN  57           HN       GLN  57  -0.931  -0.885  -8.114
  449    HA   GLN  57           HA       GLN  57  -2.400   1.600  -7.732
  450   1HB   GLN  57          HB2       GLN  57  -0.993   0.208  -9.740
  451   2HB   GLN  57          HB1       GLN  57  -2.656   0.270 -10.321
  452   1HG   GLN  57          HG2       GLN  57  -2.382   2.815  -9.415
  453   2HG   GLN  57          HG1       GLN  57  -0.720   2.477  -9.899
  454   1HE2  GLN  57          HE2       GLN  57  -2.129   4.375 -11.393
  455   2HE2  GLN  57          HE2       GLN  57  -2.517   3.738 -12.916
  456    H    ARG  58           HN       ARG  58  -3.203  -1.753  -8.574
  457    HA   ARG  58           HA       ARG  58  -5.996  -1.400  -9.098
  458   1HB   ARG  58          HB2       ARG  58  -4.713  -3.384  -9.727
  459   2HB   ARG  58          HB1       ARG  58  -4.337  -3.713  -8.037
  460   1HG   ARG  58          HG2       ARG  58  -6.934  -3.772  -7.731
  461   2HG   ARG  58          HG1       ARG  58  -6.956  -4.016  -9.478
  462   1HD   ARG  58          HD2       ARG  58  -4.965  -5.764  -8.543
  463   2HD   ARG  58          HD1       ARG  58  -6.303  -5.926  -7.391
  464    HE   ARG  58           HE       ARG  58  -7.802  -6.271  -9.391
  465   1HH1  ARG  58          HH2       ARG  58  -5.591  -8.441  -9.025
  466   2HH1  ARG  58          HH2       ARG  58  -5.148  -8.696 -10.679
  467   1HH2  ARG  58          HH1       ARG  58  -6.716  -5.821 -11.819
  468   2HH2  ARG  58          HH1       ARG  58  -5.785  -7.212 -12.261
  469    H    TYR  59           HN       TYR  59  -4.114  -1.644  -6.149
  470    HA   TYR  59           HA       TYR  59  -6.459  -2.085  -4.427
  471   1HB   TYR  59          HB2       TYR  59  -3.521  -1.481  -3.957
  472   2HB   TYR  59          HB1       TYR  59  -4.666  -1.764  -2.655
  473    HD1  TYR  59           HD1      TYR  59  -5.536  -3.757  -5.519
  474    HD2  TYR  59           HD2      TYR  59  -2.847  -3.575  -2.165
  475    HE1  TYR  59           HE1      TYR  59  -5.130  -6.191  -5.694
  476    HE2  TYR  59           HE2      TYR  59  -2.454  -6.017  -2.346
  477    HH   TYR  59           HH       TYR  59  -4.385  -8.052  -3.966
  478    H    MET  60           HN       MET  60  -4.114   0.524  -5.045
  479    HA   MET  60           HA       MET  60  -5.068   2.513  -3.331
  480   1HB   MET  60          HB2       MET  60  -3.339   2.235  -5.535
  481   2HB   MET  60          HB1       MET  60  -4.405   3.582  -5.911
  482   1HG   MET  60          HG2       MET  60  -3.711   4.831  -4.072
  483   2HG   MET  60          HG1       MET  60  -3.202   3.401  -3.174
  484   1HE   MET  60          HE1       MET  60  -0.796   1.941  -5.493
  485   2HE   MET  60          HE2       MET  60  -1.871   1.809  -4.105
  486   3HE   MET  60          HE3       MET  60  -0.199   2.316  -3.870
  487    H    LYS  61           HN       LYS  61  -6.342   1.529  -6.498
  488    HA   LYS  61           HA       LYS  61  -8.209   3.652  -6.881
  489   1HB   LYS  61          HB2       LYS  61  -8.338   0.725  -7.682
  490   2HB   LYS  61          HB1       LYS  61  -9.239   2.039  -8.440
  491   1HG   LYS  61          HG2       LYS  61  -6.412   2.675  -8.302
  492   2HG   LYS  61          HG1       LYS  61  -6.672   1.147  -9.144
  493   1HD   LYS  61          HD2       LYS  61  -6.937   2.644 -10.898
  494   2HD   LYS  61          HD1       LYS  61  -8.605   2.506 -10.339
  495   1HE   LYS  61          HE2       LYS  61  -7.943   4.509  -8.753
  496   2HE   LYS  61          HE1       LYS  61  -6.667   4.774  -9.959
  497   1HZ   LYS  61          HZ1       LYS  61  -8.484   4.500 -11.670
  498   2HZ   LYS  61          HZ2       LYS  61  -8.532   5.935 -10.763
  499   3HZ   LYS  61          HZ3       LYS  61  -9.595   4.662 -10.399
  500    H    ASN  62           HN       ASN  62  -8.757   0.372  -5.511
  501    HA   ASN  62           HA       ASN  62 -11.468   0.978  -4.671
  502   1HB   ASN  62          HB2       ASN  62 -10.501  -1.276  -5.215
  503   2HB   ASN  62          HB1       ASN  62  -9.538  -1.173  -3.741
  504   1HD2  ASN  62          HD2       ASN  62 -12.223  -2.675  -4.795
  505   2HD2  ASN  62          HD2       ASN  62 -13.174  -2.649  -3.388
  506    H    LEU  63           HN       LEU  63  -8.300   0.939  -3.070
  507    HA   LEU  63           HA       LEU  63  -9.205   1.375  -0.393
  508   1HB   LEU  63          HB2       LEU  63  -6.711   1.616  -2.000
  509   2HB   LEU  63          HB1       LEU  63  -6.734   2.456  -0.446
  510    HG   LEU  63           HG       LEU  63  -7.768  -0.337  -0.493
  511   1HD1  LEU  63          HD1       LEU  63  -4.853  -0.150  -0.103
  512   2HD1  LEU  63          HD1       LEU  63  -5.379   0.124  -1.764
  513   3HD1  LEU  63          HD1       LEU  63  -5.799  -1.378  -0.943
  514   1HD2  LEU  63          HD2       LEU  63  -6.742  -0.366   1.721
  515   2HD2  LEU  63          HD2       LEU  63  -7.688   1.112   1.549
  516   3HD2  LEU  63          HD2       LEU  63  -5.932   1.166   1.400
  517    H    ASP  64           HN       ASP  64  -8.646   3.563  -3.098
  518    HA   ASP  64           HA       ASP  64  -8.834   5.979  -1.426
  519   1HB   ASP  64          HB2       ASP  64  -7.457   5.596  -3.565
  520   2HB   ASP  64          HB1       ASP  64  -8.982   5.743  -4.439
  521    H    ALA  65           HN       ALA  65 -10.982   3.924  -3.255
  522    HA   ALA  65           HA       ALA  65 -13.096   5.751  -3.823
  523   1HB   ALA  65          HB1       ALA  65 -13.243   3.664  -4.856
  524   2HB   ALA  65          HB2       ALA  65 -14.408   3.463  -3.547
  525   3HB   ALA  65          HB3       ALA  65 -12.780   2.798  -3.392
  526    H    LYS  66           HN       LYS  66 -12.260   3.963  -0.878
  527    HA   LYS  66           HA       LYS  66 -14.725   4.788   0.506
  528   1HB   LYS  66          HB2       LYS  66 -13.177   2.627   0.677
  529   2HB   LYS  66          HB1       LYS  66 -12.329   3.617   1.863
  530   1HG   LYS  66          HG2       LYS  66 -14.301   3.873   3.198
  531   2HG   LYS  66          HG1       LYS  66 -15.323   3.193   1.931
  532   1HD   LYS  66          HD2       LYS  66 -14.554   1.013   2.297
  533   2HD   LYS  66          HD1       LYS  66 -13.067   1.564   3.070
  534   1HE   LYS  66          HE2       LYS  66 -14.157   2.056   5.103
  535   2HE   LYS  66          HE1       LYS  66 -15.754   2.132   4.331
  536   1HZ   LYS  66          HZ1       LYS  66 -15.725  -0.181   3.929
  537   2HZ   LYS  66          HZ2       LYS  66 -15.252   0.005   5.549
  538   3HZ   LYS  66          HZ3       LYS  66 -14.090  -0.323   4.356
  539    H    GLN  67           HN       GLN  67 -11.249   5.527   0.659
  540    HA   GLN  67           HA       GLN  67 -11.647   7.569   2.742
  541   1HB   GLN  67          HB2       GLN  67  -9.667   6.002   2.501
  542   2HB   GLN  67          HB1       GLN  67  -9.206   6.917   1.065
  543   1HG   GLN  67          HG2       GLN  67  -8.543   8.748   2.274
  544   2HG   GLN  67          HG1       GLN  67  -9.773   8.502   3.516
  545   1HE2  GLN  67          HE2       GLN  67  -7.588   8.982   4.821
  546   2HE2  GLN  67          HE2       GLN  67  -6.718   7.601   5.289
  547    H    LYS  68           HN       LYS  68 -13.253   8.429   0.771
  548    HA   LYS  68           HA       LYS  68 -11.766  10.200  -1.080
  549   1HB   LYS  68          HB2       LYS  68 -13.718   8.836  -1.791
  550   2HB   LYS  68          HB1       LYS  68 -14.727   9.703  -0.635
  551   1HG   LYS  68          HG2       LYS  68 -14.244  11.824  -1.792
  552   2HG   LYS  68          HG1       LYS  68 -13.223  10.966  -2.947
  553   1HD   LYS  68          HD2       LYS  68 -15.018   9.985  -4.017
  554   2HD   LYS  68          HD1       LYS  68 -16.021   9.987  -2.565
  555   1HE   LYS  68          HE2       LYS  68 -17.025  11.873  -3.311
  556   2HE   LYS  68          HE1       LYS  68 -15.464  12.712  -3.206
  557   1HZ   LYS  68          HZ1       LYS  68 -16.447  12.616  -5.494
  558   2HZ   LYS  68          HZ2       LYS  68 -16.208  10.933  -5.462
  559   3HZ   LYS  68          HZ3       LYS  68 -14.878  11.986  -5.369
  560    H    LYS  69           HN       LYS  69 -13.463  10.351   1.958
  561    HA   LYS  69           HA       LYS  69 -14.263  13.089   1.986
  562   1HB   LYS  69          HB2       LYS  69 -14.274  10.861   3.666
  563   2HB   LYS  69          HB1       LYS  69 -13.278  12.031   4.528
  564   1HG   LYS  69          HG2       LYS  69 -15.074  13.288   5.049
  565   2HG   LYS  69          HG1       LYS  69 -15.612  13.312   3.368
  566   1HD   LYS  69          HD2       LYS  69 -16.477  10.942   3.747
  567   2HD   LYS  69          HD1       LYS  69 -16.191  11.212   5.467
  568   1HE   LYS  69          HE2       LYS  69 -18.384  11.958   5.357
  569   2HE   LYS  69          HE1       LYS  69 -17.573  13.469   4.897
  570   1HZ   LYS  69          HZ1       LYS  69 -17.602  12.519   2.555
  571   2HZ   LYS  69          HZ2       LYS  69 -19.085  13.073   3.174
  572   3HZ   LYS  69          HZ3       LYS  69 -18.749  11.408   3.128
  573    H    ALA  70           HN       ALA  70 -12.545  14.365   1.058
  574    HA   ALA  70           HA       ALA  70 -10.355  14.973   2.964
  575   1HB   ALA  70          HB1       ALA  70  -8.802  13.899   1.729
  576   2HB   ALA  70          HB2       ALA  70  -9.277  14.822   0.302
  577   3HB   ALA  70          HB3       ALA  70 -10.090  13.302   0.681
  578    H    SER  71           HN       SER  71 -11.098  15.695  -0.452
  579    HA   SER  71           HA       SER  71 -11.078  18.609   0.257
  580   1HB   SER  71          HB2       SER  71 -10.464  18.767  -2.242
  581   2HB   SER  71          HB1       SER  71  -9.246  18.081  -1.169
  582    HG   SER  71           HG       SER  71 -10.349  16.971  -3.285
  583    HA   PRO  72           HA       PRO  72 -15.371  17.777  -1.063
  584   1HB   PRO  72          HB2       PRO  72 -16.477  19.817   0.376
  585   2HB   PRO  72          HB1       PRO  72 -16.129  18.219   1.068
  586   1HG   PRO  72          HG2       PRO  72 -14.585  20.748   1.279
  587   2HG   PRO  72          HG1       PRO  72 -14.892  19.506   2.502
  588   1HD   PRO  72          HD2       PRO  72 -12.540  19.727   1.145
  589   2HD   PRO  72          HD1       PRO  72 -13.160  18.189   1.787
  590    H    ARG  73           HN       ARG  73 -17.054  19.867  -1.595
  591    HA   ARG  73           HA       ARG  73 -15.464  21.663  -3.401
  592   1HB   ARG  73          HB2       ARG  73 -16.689  19.790  -4.524
  593   2HB   ARG  73          HB1       ARG  73 -18.196  20.419  -3.857
  594   1HG   ARG  73          HG2       ARG  73 -18.353  21.847  -5.586
  595   2HG   ARG  73          HG1       ARG  73 -16.833  22.597  -5.092
  596   1HD   ARG  73          HD2       ARG  73 -16.427  21.858  -7.322
  597   2HD   ARG  73          HD1       ARG  73 -15.697  20.593  -6.313
  598    HE   ARG  73           HE       ARG  73 -18.268  19.698  -6.557
  599   1HH1  ARG  73          HH2       ARG  73 -18.404  21.368  -9.083
  600   2HH1  ARG  73          HH2       ARG  73 -17.924  20.215 -10.284
  601   1HH2  ARG  73          HH1       ARG  73 -16.589  17.985  -7.989
  602   2HH2  ARG  73          HH1       ARG  73 -16.897  18.300  -9.664
  Start of MODEL   11
    1   1H    VAL   1          HT1       VAL   1  -5.438   6.857   7.502
    2   2H    VAL   1          HT2       VAL   1  -5.798   8.518   7.524
    3   3H    VAL   1          HT3       VAL   1  -6.039   7.574   8.916
    4    HA   VAL   1           HA       VAL   1  -4.048   8.695   9.363
    5    HB   VAL   1           HB       VAL   1  -3.562   5.959   8.139
    6   1HG1  VAL   1          HG1       VAL   1  -1.869   7.645  10.003
    7   2HG1  VAL   1          HG1       VAL   1  -1.418   7.035   8.411
    8   3HG1  VAL   1          HG1       VAL   1  -1.620   5.917   9.759
    9   1HG2  VAL   1          HG2       VAL   1  -3.608   5.437  10.706
   10   2HG2  VAL   1          HG2       VAL   1  -5.136   5.667   9.856
   11   3HG2  VAL   1          HG2       VAL   1  -4.460   6.976  10.828
   12    H    VAL   2           HN       VAL   2  -3.642  10.469   7.915
   13    HA   VAL   2           HA       VAL   2  -2.698  10.118   5.200
   14    HB   VAL   2           HB       VAL   2  -2.197  12.550   5.458
   15   1HG1  VAL   2          HG1       VAL   2  -4.422  12.398   4.915
   16   2HG1  VAL   2          HG1       VAL   2  -4.618  13.033   6.547
   17   3HG1  VAL   2          HG1       VAL   2  -4.779  11.302   6.249
   18   1HG2  VAL   2          HG2       VAL   2  -3.224  13.153   7.974
   19   2HG2  VAL   2          HG2       VAL   2  -1.520  13.190   7.520
   20   3HG2  VAL   2          HG2       VAL   2  -2.202  11.746   8.270
   21    H    ILE   3           HN       ILE   3  -0.887   8.901   5.004
   22    HA   ILE   3           HA       ILE   3   1.359   8.907   6.800
   23    HB   ILE   3           HB       ILE   3   0.799   7.042   5.348
   24   1HG1  ILE   3          HG1       ILE   3   3.043   7.114   3.863
   25   2HG1  ILE   3          HG1       ILE   3   3.402   8.445   4.962
   26   1HG2  ILE   3          HG2       ILE   3  -0.132   7.561   3.362
   27   2HG2  ILE   3          HG2       ILE   3   1.507   7.812   2.765
   28   3HG2  ILE   3          HG2       ILE   3   0.571   9.177   3.372
   29   1HD1  ILE   3          HD1       ILE   3   3.606   5.661   5.483
   30   2HD1  ILE   3          HD1       ILE   3   2.283   6.277   6.472
   31   3HD1  ILE   3          HD1       ILE   3   3.889   6.991   6.604
   32    HA   PRO   4           HA       PRO   4   3.252  12.626   5.290
   33   1HB   PRO   4          HB2       PRO   4   5.696  12.335   6.487
   34   2HB   PRO   4          HB1       PRO   4   4.237  12.829   7.365
   35   1HG   PRO   4          HG2       PRO   4   5.597  10.198   7.293
   36   2HG   PRO   4          HG1       PRO   4   4.708  10.979   8.607
   37   1HD   PRO   4          HD2       PRO   4   3.721   8.955   6.996
   38   2HD   PRO   4          HD1       PRO   4   2.732  10.074   7.959
   39    H    SER   5           HN       SER   5   6.142  10.607   5.501
   40    HA   SER   5           HA       SER   5   6.179   9.863   2.688
   41   1HB   SER   5          HB2       SER   5   6.658  12.500   3.177
   42   2HB   SER   5          HB1       SER   5   8.293  11.856   3.296
   43    HG   SER   5           HG       SER   5   6.484  11.380   1.155
   44    HA   PRO   6           HA       PRO   6   9.216   7.906   5.701
   45   1HB   PRO   6          HB2       PRO   6   8.114   5.405   5.738
   46   2HB   PRO   6          HB1       PRO   6   7.657   6.683   6.881
   47   1HG   PRO   6          HG2       PRO   6   6.266   5.751   4.427
   48   2HG   PRO   6          HG1       PRO   6   5.595   6.249   5.987
   49   1HD   PRO   6          HD2       PRO   6   5.610   7.846   3.778
   50   2HD   PRO   6          HD1       PRO   6   5.634   8.471   5.442
   51    H    CYS   7           HN       CYS   7   9.912   5.246   5.062
   52    HA   CYS   7           HA       CYS   7  10.189   5.121   2.110
   53   1HB   CYS   7          HB2       CYS   7  12.122   6.253   3.865
   54   2HB   CYS   7          HB1       CYS   7  12.769   4.701   3.330
   55    H    CYS   8           HN       CYS   8  12.014   3.100   1.897
   56    HA   CYS   8           HA       CYS   8  11.160   0.939   3.773
   57   1HB   CYS   8          HB2       CYS   8  11.007   0.866   0.742
   58   2HB   CYS   8          HB1       CYS   8  10.600  -0.469   1.820
   59    H    MET   9           HN       MET   9  12.386  -1.193   2.687
   60    HA   MET   9           HA       MET   9  15.220  -0.353   2.182
   61   1HB   MET   9          HB2       MET   9  15.762  -2.423   3.618
   62   2HB   MET   9          HB1       MET   9  15.124  -1.017   4.469
   63   1HG   MET   9          HG2       MET   9  12.854  -2.018   4.380
   64   2HG   MET   9          HG1       MET   9  13.528  -3.439   3.584
   65   1HE   MET   9          HE1       MET   9  14.112  -5.686   5.448
   66   2HE   MET   9          HE2       MET   9  15.742  -5.139   5.831
   67   3HE   MET   9          HE3       MET   9  15.063  -4.817   4.237
   68    H    PHE  10           HN       PHE  10  12.716  -2.852   1.760
   69    HA   PHE  10           HA       PHE  10  14.149  -3.720  -0.706
   70   1HB   PHE  10          HB2       PHE  10  14.124  -6.000  -0.052
   71   2HB   PHE  10          HB1       PHE  10  14.606  -5.148   1.411
   72    HD1  PHE  10           HD1      PHE  10  11.657  -6.631  -0.341
   73    HD2  PHE  10           HD2      PHE  10  13.321  -5.329   3.399
   74    HE1  PHE  10           HE1      PHE  10   9.729  -7.622   0.863
   75    HE2  PHE  10           HE2      PHE  10  11.392  -6.314   4.602
   76    HZ   PHE  10           HZ       PHE  10   9.595  -7.463   3.333
   77    H    PHE  11           HN       PHE  11  12.729  -3.991  -2.416
   78    HA   PHE  11           HA       PHE  11   9.945  -3.266  -2.091
   79   1HB   PHE  11          HB2       PHE  11  11.887  -3.739  -4.175
   80   2HB   PHE  11          HB1       PHE  11  10.378  -4.557  -4.577
   81    HD1  PHE  11           HD1      PHE  11   8.281  -2.933  -3.536
   82    HD2  PHE  11           HD2      PHE  11  12.003  -1.685  -5.278
   83    HE1  PHE  11           HE1      PHE  11   7.264  -0.762  -4.156
   84    HE2  PHE  11           HE2      PHE  11  10.982   0.486  -5.900
   85    HZ   PHE  11           HZ       PHE  11   8.613   0.950  -5.338
   86    H    VAL  12           HN       VAL  12   8.111  -4.620  -2.230
   87    HA   VAL  12           HA       VAL  12   8.140  -7.142  -1.009
   88    HB   VAL  12           HB       VAL  12   5.883  -7.359  -2.152
   89   1HG1  VAL  12          HG1       VAL  12   5.445  -6.241  -0.236
   90   2HG1  VAL  12          HG1       VAL  12   5.344  -4.809  -1.260
   91   3HG1  VAL  12          HG1       VAL  12   6.850  -5.193  -0.426
   92   1HG2  VAL  12          HG2       VAL  12   6.022  -4.604  -3.170
   93   2HG2  VAL  12          HG2       VAL  12   5.308  -6.036  -3.909
   94   3HG2  VAL  12          HG2       VAL  12   7.037  -5.731  -4.069
   95    H    SER  13           HN       SER  13   8.734  -9.163  -1.711
   96    HA   SER  13           HA       SER  13  10.011  -9.632  -4.215
   97   1HB   SER  13          HB2       SER  13  10.499 -11.193  -2.558
   98   2HB   SER  13          HB1       SER  13   8.835 -11.246  -1.980
   99    HG   SER  13           HG       SER  13   9.593 -12.196  -4.536
  100    H    LYS  14           HN       LYS  14   6.657  -9.522  -3.303
  101    HA   LYS  14           HA       LYS  14   5.823  -9.829  -6.085
  102   1HB   LYS  14          HB2       LYS  14   4.377 -11.816  -5.541
  103   2HB   LYS  14          HB1       LYS  14   6.105 -12.161  -5.439
  104   1HG   LYS  14          HG2       LYS  14   5.808 -12.828  -3.311
  105   2HG   LYS  14          HG1       LYS  14   5.323 -11.184  -2.895
  106   1HD   LYS  14          HD2       LYS  14   3.284 -12.028  -2.422
  107   2HD   LYS  14          HD1       LYS  14   3.076 -12.253  -4.159
  108   1HE   LYS  14          HE2       LYS  14   4.690 -14.391  -2.998
  109   2HE   LYS  14          HE1       LYS  14   3.082 -14.291  -2.253
  110   1HZ   LYS  14          HZ1       LYS  14   2.030 -14.450  -4.307
  111   2HZ   LYS  14          HZ2       LYS  14   3.291 -15.580  -4.439
  112   3HZ   LYS  14          HZ3       LYS  14   3.431 -14.055  -5.178
  113    H    ARG  15           HN       ARG  15   3.202 -10.034  -5.949
  114    HA   ARG  15           HA       ARG  15   2.307  -7.603  -4.679
  115   1HB   ARG  15          HB2       ARG  15   0.110  -8.397  -5.572
  116   2HB   ARG  15          HB1       ARG  15   1.399  -8.485  -6.771
  117   1HG   ARG  15          HG2       ARG  15   1.339 -10.922  -5.234
  118   2HG   ARG  15          HG1       ARG  15  -0.263 -10.594  -5.893
  119   1HD   ARG  15          HD2       ARG  15   1.174 -10.027  -8.089
  120   2HD   ARG  15          HD1       ARG  15   2.281 -11.192  -7.334
  121    HE   ARG  15           HE       ARG  15  -0.572 -11.767  -8.018
  122   1HH1  ARG  15          HH1       ARG  15   1.703 -12.980  -5.951
  123   2HH1  ARG  15          HH1       ARG  15   1.817 -14.549  -6.675
  124   1HH2  ARG  15          HH2       ARG  15  -0.039 -13.683  -9.475
  125   2HH2  ARG  15          HH2       ARG  15   0.833 -14.946  -8.674
  126    H    ILE  16           HN       ILE  16  -0.215  -8.325  -3.669
  127    HA   ILE  16           HA       ILE  16   0.356 -10.122  -1.345
  128    HB   ILE  16           HB       ILE  16  -1.192  -7.636  -0.799
  129   1HG1  ILE  16          HG1       ILE  16   1.795  -7.548  -1.356
  130   2HG1  ILE  16          HG1       ILE  16   0.542  -6.644  -2.202
  131   1HG2  ILE  16          HG2       ILE  16  -0.748  -8.443   1.247
  132   2HG2  ILE  16          HG2       ILE  16   0.943  -8.001   1.005
  133   3HG2  ILE  16          HG2       ILE  16   0.387  -9.618   0.586
  134   1HD1  ILE  16          HD1       ILE  16   1.112  -6.356   0.764
  135   2HD1  ILE  16          HD1       ILE  16   0.041  -5.353  -0.216
  136   3HD1  ILE  16          HD1       ILE  16   1.784  -5.292  -0.474
  137    HA   PRO  17           HA       PRO  17  -3.847 -11.224  -2.151
  138   1HB   PRO  17          HB2       PRO  17  -4.534 -12.371   0.226
  139   2HB   PRO  17          HB1       PRO  17  -3.413 -13.121  -0.926
  140   1HG   PRO  17          HG2       PRO  17  -2.868 -11.907   1.660
  141   2HG   PRO  17          HG1       PRO  17  -1.868 -12.991   0.691
  142   1HD   PRO  17          HD2       PRO  17  -1.667 -10.135   0.971
  143   2HD   PRO  17          HD1       PRO  17  -0.596 -11.236   0.076
  144    H    GLU  18           HN       GLU  18  -5.491  -9.746  -2.304
  145    HA   GLU  18           HA       GLU  18  -5.964  -7.483  -0.767
  146   1HB   GLU  18          HB2       GLU  18  -7.060  -8.664  -2.931
  147   2HB   GLU  18          HB1       GLU  18  -8.332  -8.993  -1.753
  148   1HG   GLU  18          HG2       GLU  18  -7.172  -6.232  -1.900
  149   2HG   GLU  18          HG1       GLU  18  -8.346  -6.730  -3.118
  150    H    ASN  19           HN       ASN  19  -6.777 -10.799   0.065
  151    HA   ASN  19           HA       ASN  19  -8.738 -10.157   2.107
  152   1HB   ASN  19          HB2       ASN  19  -8.435 -12.326   0.842
  153   2HB   ASN  19          HB1       ASN  19  -6.983 -12.612   1.803
  154   1HD2  ASN  19          HD2       ASN  19  -7.628 -14.251   3.247
  155   2HD2  ASN  19          HD2       ASN  19  -8.988 -14.149   4.258
  156    H    ARG  20           HN       ARG  20  -5.311  -9.891   2.010
  157    HA   ARG  20           HA       ARG  20  -5.140 -10.004   4.994
  158   1HB   ARG  20          HB2       ARG  20  -3.137 -10.316   2.746
  159   2HB   ARG  20          HB1       ARG  20  -2.690 -10.285   4.447
  160   1HG   ARG  20          HG2       ARG  20  -4.452 -12.156   4.741
  161   2HG   ARG  20          HG1       ARG  20  -4.351 -12.326   2.987
  162   1HD   ARG  20          HD2       ARG  20  -2.208 -13.182   3.058
  163   2HD   ARG  20          HD1       ARG  20  -1.769 -12.239   4.496
  164    HE   ARG  20           HE       ARG  20  -3.625 -14.589   4.625
  165   1HH1  ARG  20          HH1       ARG  20  -2.460 -12.251   6.616
  166   2HH1  ARG  20          HH1       ARG  20  -1.636 -13.303   7.717
  167   1HH2  ARG  20          HH2       ARG  20  -1.974 -16.110   5.712
  168   2HH2  ARG  20          HH2       ARG  20  -1.364 -15.488   7.209
  169    H    VAL  21           HN       VAL  21  -4.524  -8.023   2.147
  170    HA   VAL  21           HA       VAL  21  -3.029  -5.938   3.479
  171    HB   VAL  21           HB       VAL  21  -4.779  -5.829   1.003
  172   1HG1  VAL  21          HG1       VAL  21  -2.811  -4.166   0.435
  173   2HG1  VAL  21          HG1       VAL  21  -2.646  -4.085   2.190
  174   3HG1  VAL  21          HG1       VAL  21  -4.165  -3.623   1.425
  175   1HG2  VAL  21          HG2       VAL  21  -2.360  -7.314   1.574
  176   2HG2  VAL  21          HG2       VAL  21  -2.050  -6.104   0.329
  177   3HG2  VAL  21          HG2       VAL  21  -3.326  -7.299   0.098
  178    H    VAL  22           HN       VAL  22  -3.824  -3.850   4.176
  179    HA   VAL  22           HA       VAL  22  -6.774  -3.751   4.636
  180    HB   VAL  22           HB       VAL  22  -5.945  -2.428   6.749
  181   1HG1  VAL  22          HG1       VAL  22  -5.782  -5.423   6.417
  182   2HG1  VAL  22          HG1       VAL  22  -7.182  -4.475   6.921
  183   3HG1  VAL  22          HG1       VAL  22  -5.779  -4.610   7.981
  184   1HG2  VAL  22          HG2       VAL  22  -3.500  -2.633   5.876
  185   2HG2  VAL  22          HG2       VAL  22  -3.592  -4.289   6.470
  186   3HG2  VAL  22          HG2       VAL  22  -3.803  -2.940   7.584
  187    H    SER  23           HN       SER  23  -3.795  -1.860   4.168
  188    HA   SER  23           HA       SER  23  -5.123   0.161   2.604
  189   1HB   SER  23          HB2       SER  23  -6.188   0.832   4.605
  190   2HB   SER  23          HB1       SER  23  -4.744   0.543   5.570
  191    HG   SER  23           HG       SER  23  -4.433   2.605   5.273
  192    H    TYR  24           HN       TYR  24  -3.562   1.484   1.636
  193    HA   TYR  24           HA       TYR  24  -0.766   0.800   2.254
  194   1HB   TYR  24          HB2       TYR  24  -0.352   1.488   0.041
  195   2HB   TYR  24          HB1       TYR  24  -1.921   0.714  -0.014
  196    HD1  TYR  24           HD1      TYR  24  -3.245   3.299   1.445
  197    HD2  TYR  24           HD2      TYR  24  -0.845   2.671  -2.064
  198    HE1  TYR  24           HE1      TYR  24  -4.189   5.348   0.433
  199    HE2  TYR  24           HE2      TYR  24  -1.786   4.731  -3.067
  200    HH   TYR  24           HH       TYR  24  -2.862   6.962  -2.018
  201    H    GLN  25           HN       GLN  25   0.819   2.640   1.797
  202    HA   GLN  25           HA       GLN  25  -0.004   5.285   2.872
  203   1HB   GLN  25          HB2       GLN  25   1.903   3.277   4.079
  204   2HB   GLN  25          HB1       GLN  25   2.150   5.000   4.355
  205   1HG   GLN  25          HG2       GLN  25   0.549   4.998   5.934
  206   2HG   GLN  25          HG1       GLN  25  -0.624   4.398   4.761
  207   1HE2  GLN  25          HE2       GLN  25  -1.631   2.660   5.815
  208   2HE2  GLN  25          HE2       GLN  25  -0.803   1.375   6.552
  209    H    LEU  26           HN       LEU  26   0.547   6.218   0.851
  210    HA   LEU  26           HA       LEU  26   2.716   5.493  -0.798
  211   1HB   LEU  26          HB2       LEU  26   0.868   7.768  -0.439
  212   2HB   LEU  26          HB1       LEU  26   2.351   8.146  -1.317
  213    HG   LEU  26           HG       LEU  26   0.437   5.888  -1.979
  214   1HD1  LEU  26          HD1       LEU  26  -0.406   7.207  -3.692
  215   2HD1  LEU  26          HD1       LEU  26   1.054   8.194  -3.790
  216   3HD1  LEU  26          HD1       LEU  26  -0.090   8.440  -2.471
  217   1HD2  LEU  26          HD2       LEU  26   2.575   5.149  -2.655
  218   2HD2  LEU  26          HD2       LEU  26   3.097   6.770  -3.098
  219   3HD2  LEU  26          HD2       LEU  26   1.933   5.911  -4.106
  220    H    SER  27           HN       SER  27   4.697   6.654  -1.246
  221    HA   SER  27           HA       SER  27   5.830   8.301   0.949
  222   1HB   SER  27          HB2       SER  27   6.543   6.186   1.674
  223   2HB   SER  27          HB1       SER  27   6.655   5.556   0.033
  224    HG   SER  27           HG       SER  27   8.609   6.349  -0.134
  225    H    SER  28           HN       SER  28   8.301   8.768   0.125
  226    HA   SER  28           HA       SER  28   8.237   9.229  -2.830
  227   1HB   SER  28          HB2       SER  28   8.807  11.539  -2.484
  228   2HB   SER  28          HB1       SER  28   7.440  11.196  -1.429
  229    HG   SER  28           HG       SER  28   9.689  12.209  -0.702
  230    H    ARG  29           HN       ARG  29  10.675  10.702  -2.877
  231    HA   ARG  29           HA       ARG  29  12.623   8.639  -1.892
  232   1HB   ARG  29          HB2       ARG  29  13.881   9.172  -3.956
  233   2HB   ARG  29          HB1       ARG  29  12.239   8.651  -4.337
  234   1HG   ARG  29          HG2       ARG  29  12.386  11.527  -3.877
  235   2HG   ARG  29          HG1       ARG  29  13.450  11.017  -5.187
  236   1HD   ARG  29          HD2       ARG  29  11.536   9.801  -6.235
  237   2HD   ARG  29          HD1       ARG  29  10.476  10.430  -4.956
  238    HE   ARG  29           HE       ARG  29  11.208  12.743  -5.730
  239   1HH1  ARG  29          HH1       ARG  29   9.515  11.027  -7.730
  240   2HH1  ARG  29          HH1       ARG  29  10.293  11.465  -9.216
  241   1HH2  ARG  29          HH2       ARG  29  13.058  12.865  -7.659
  242   2HH2  ARG  29          HH2       ARG  29  12.300  12.508  -9.175
  243    H    SER  30           HN       SER  30  11.666  11.317  -0.715
  244    HA   SER  30           HA       SER  30  13.569  13.371  -0.952
  245   1HB   SER  30          HB2       SER  30  11.428  13.373   0.348
  246   2HB   SER  30          HB1       SER  30  12.201  12.357   1.562
  247    HG   SER  30           HG       SER  30  12.320  14.566   2.117
  248    H    THR  31           HN       THR  31  13.777  10.330   0.844
  249    HA   THR  31           HA       THR  31  16.570  11.054   1.656
  250    HB   THR  31           HB       THR  31  16.179   9.459   3.500
  251    HG1  THR  31           HG1      THR  31  14.092   8.551   3.682
  252   1HG2  THR  31          HG2       THR  31  15.539  11.704   4.008
  253   2HG2  THR  31          HG2       THR  31  14.215  10.684   4.573
  254   3HG2  THR  31          HG2       THR  31  14.061  11.571   3.055
  255    H    CYS  32           HN       CYS  32  14.489   8.559   0.258
  256    HA   CYS  32           HA       CYS  32  16.788   6.755  -0.228
  257   1HB   CYS  32          HB2       CYS  32  13.842   6.571  -0.949
  258   2HB   CYS  32          HB1       CYS  32  15.007   5.249  -1.018
  259    H    LEU  33           HN       LEU  33  16.293   5.685  -2.672
  260    HA   LEU  33           HA       LEU  33  16.694   7.991  -4.516
  261   1HB   LEU  33          HB2       LEU  33  18.020   5.511  -4.007
  262   2HB   LEU  33          HB1       LEU  33  17.391   5.466  -5.655
  263    HG   LEU  33           HG       LEU  33  19.651   6.444  -5.616
  264   1HD1  LEU  33          HD1       LEU  33  19.165   8.387  -6.929
  265   2HD1  LEU  33          HD1       LEU  33  17.623   8.637  -6.106
  266   3HD1  LEU  33          HD1       LEU  33  17.829   7.265  -7.196
  267   1HD2  LEU  33          HD2       LEU  33  20.299   7.948  -4.052
  268   2HD2  LEU  33          HD2       LEU  33  18.785   7.584  -3.223
  269   3HD2  LEU  33          HD2       LEU  33  18.877   8.953  -4.330
  270    H    LYS  34           HN       LYS  34  15.051   4.845  -4.259
  271    HA   LYS  34           HA       LYS  34  13.466   5.426  -6.700
  272   1HB   LYS  34          HB2       LYS  34  13.516   3.046  -4.815
  273   2HB   LYS  34          HB1       LYS  34  12.764   3.091  -6.410
  274   1HG   LYS  34          HG2       LYS  34  15.713   3.590  -5.926
  275   2HG   LYS  34          HG1       LYS  34  15.046   2.025  -6.391
  276   1HD   LYS  34          HD2       LYS  34  13.923   3.386  -8.334
  277   2HD   LYS  34          HD1       LYS  34  15.188   4.565  -7.987
  278   1HE   LYS  34          HE2       LYS  34  16.068   1.727  -8.209
  279   2HE   LYS  34          HE1       LYS  34  15.581   2.532  -9.712
  280   1HZ   LYS  34          HZ1       LYS  34  17.400   3.760  -7.714
  281   2HZ   LYS  34          HZ2       LYS  34  17.055   4.321  -9.280
  282   3HZ   LYS  34          HZ3       LYS  34  17.956   2.897  -9.064
  283    H    ALA  35           HN       ALA  35  11.037   4.924  -6.499
  284    HA   ALA  35           HA       ALA  35   9.974   5.899  -3.867
  285   1HB   ALA  35          HB1       ALA  35   9.778   6.937  -6.602
  286   2HB   ALA  35          HB2       ALA  35   9.428   7.746  -5.075
  287   3HB   ALA  35          HB3       ALA  35   8.201   6.736  -5.838
  288    H    GLY  36           HN       GLY  36   8.497   4.491  -3.015
  289   1HA   GLY  36          HA2       GLY  36   6.830   2.866  -4.859
  290   2HA   GLY  36          HA1       GLY  36   7.780   2.018  -3.636
  291    H    VAL  37           HN       VAL  37   5.072   1.689  -3.479
  292    HA   VAL  37           HA       VAL  37   4.076   3.681  -1.489
  293    HB   VAL  37           HB       VAL  37   2.666   1.314  -2.754
  294   1HG1  VAL  37          HG1       VAL  37   0.889   3.402  -2.366
  295   2HG1  VAL  37          HG1       VAL  37   1.933   3.510  -0.955
  296   3HG1  VAL  37          HG1       VAL  37   1.072   2.010  -1.300
  297   1HG2  VAL  37          HG2       VAL  37   3.630   3.746  -3.982
  298   2HG2  VAL  37          HG2       VAL  37   1.867   3.728  -3.991
  299   3HG2  VAL  37          HG2       VAL  37   2.766   2.402  -4.728
  300    H    ILE  38           HN       ILE  38   2.877   2.613   0.434
  301    HA   ILE  38           HA       ILE  38   4.374   0.174   1.329
  302    HB   ILE  38           HB       ILE  38   3.518   2.685   2.800
  303   1HG1  ILE  38          HG1       ILE  38   6.155   2.392   3.278
  304   2HG1  ILE  38          HG1       ILE  38   6.068   1.578   1.718
  305   1HG2  ILE  38          HG2       ILE  38   4.445   1.666   4.812
  306   2HG2  ILE  38          HG2       ILE  38   4.903   0.223   3.907
  307   3HG2  ILE  38          HG2       ILE  38   3.200   0.601   4.159
  308   1HD1  ILE  38          HD1       ILE  38   5.230   4.421   2.351
  309   2HD1  ILE  38          HD1       ILE  38   4.845   3.618   0.832
  310   3HD1  ILE  38          HD1       ILE  38   6.526   3.902   1.274
  311    H    PHE  39           HN       PHE  39   2.949  -1.521   1.582
  312    HA   PHE  39           HA       PHE  39   0.102  -0.851   2.207
  313   1HB   PHE  39          HB2       PHE  39   1.506  -3.109   0.791
  314   2HB   PHE  39          HB1       PHE  39  -0.153  -3.291   1.360
  315    HD1  PHE  39           HD1      PHE  39  -1.971  -2.307   0.196
  316    HD2  PHE  39           HD2      PHE  39   2.062  -1.200  -0.775
  317    HE1  PHE  39           HE1      PHE  39  -2.787  -1.084  -1.800
  318    HE2  PHE  39           HE2      PHE  39   1.246   0.022  -2.769
  319    HZ   PHE  39           HZ       PHE  39  -1.178   0.081  -3.283
  320    H    THR  40           HN       THR  40  -0.819  -1.664   4.063
  321    HA   THR  40           HA       THR  40   0.952  -3.226   5.878
  322    HB   THR  40           HB       THR  40  -1.467  -1.444   6.277
  323    HG1  THR  40           HG1      THR  40   0.310  -0.225   6.094
  324   1HG2  THR  40          HG2       THR  40  -0.316  -2.016   8.768
  325   2HG2  THR  40          HG2       THR  40  -0.427  -3.576   7.951
  326   3HG2  THR  40          HG2       THR  40  -1.874  -2.592   8.172
  327    H    THR  41           HN       THR  41   0.204  -5.195   6.728
  328    HA   THR  41           HA       THR  41  -2.100  -6.412   5.329
  329    HB   THR  41           HB       THR  41  -0.493  -7.952   7.282
  330    HG1  THR  41           HG1      THR  41   0.694  -7.150   4.850
  331   1HG2  THR  41          HG2       THR  41  -1.815  -8.286   4.671
  332   2HG2  THR  41          HG2       THR  41  -1.613  -9.439   5.990
  333   3HG2  THR  41          HG2       THR  41  -0.300  -9.172   4.845
  334    H    LYS  42           HN       LYS  42  -3.164  -8.164   7.014
  335    HA   LYS  42           HA       LYS  42  -4.440  -6.490   9.078
  336   1HB   LYS  42          HB2       LYS  42  -5.119  -8.646   7.361
  337   2HB   LYS  42          HB1       LYS  42  -5.296  -9.238   9.014
  338   1HG   LYS  42          HG2       LYS  42  -6.343  -6.529   8.690
  339   2HG   LYS  42          HG1       LYS  42  -7.150  -7.690   7.638
  340   1HD   LYS  42          HD2       LYS  42  -6.671  -8.564  10.437
  341   2HD   LYS  42          HD1       LYS  42  -7.881  -7.302  10.208
  342   1HE   LYS  42          HE2       LYS  42  -9.311  -8.693   9.036
  343   2HE   LYS  42          HE1       LYS  42  -7.984  -9.670   8.376
  344   1HZ   LYS  42          HZ1       LYS  42  -9.091  -9.701  11.121
  345   2HZ   LYS  42          HZ2       LYS  42  -7.546 -10.317  10.778
  346   3HZ   LYS  42          HZ3       LYS  42  -8.918 -11.000  10.045
  347    H    LYS  43           HN       LYS  43  -2.055  -9.026   8.853
  348    HA   LYS  43           HA       LYS  43  -2.281  -9.928  11.619
  349   1HB   LYS  43          HB2       LYS  43  -1.329 -11.022   9.402
  350   2HB   LYS  43          HB1       LYS  43   0.166 -10.234   9.908
  351   1HG   LYS  43          HG2       LYS  43   0.089 -11.369  12.063
  352   2HG   LYS  43          HG1       LYS  43  -1.476 -12.081  11.666
  353   1HD   LYS  43          HD2       LYS  43   0.471 -12.614   9.577
  354   2HD   LYS  43          HD1       LYS  43   1.044 -13.195  11.141
  355   1HE   LYS  43          HE2       LYS  43  -1.282 -14.258  11.432
  356   2HE   LYS  43          HE1       LYS  43  -1.505 -13.951   9.696
  357   1HZ   LYS  43          HZ1       LYS  43  -0.496 -16.123  10.061
  358   2HZ   LYS  43          HZ2       LYS  43   0.781 -15.406  10.919
  359   3HZ   LYS  43          HZ3       LYS  43   0.584 -15.088   9.262
  360    H    GLY  44           HN       GLY  44  -0.944  -7.137  10.166
  361   1HA   GLY  44          HA2       GLY  44  -0.081  -5.365  11.623
  362   2HA   GLY  44          HA1       GLY  44   0.634  -6.621  12.634
  363    H    GLN  45           HN       GLN  45   0.782  -6.749   9.138
  364    HA   GLN  45           HA       GLN  45   3.754  -6.505   9.323
  365   1HB   GLN  45          HB2       GLN  45   1.755  -7.949   7.662
  366   2HB   GLN  45          HB1       GLN  45   3.217  -7.422   6.828
  367   1HG   GLN  45          HG2       GLN  45   4.625  -8.608   8.374
  368   2HG   GLN  45          HG1       GLN  45   3.262  -8.954   9.439
  369   1HE2  GLN  45          HE2       GLN  45   4.347  -9.554   6.051
  370   2HE2  GLN  45          HE2       GLN  45   3.608 -11.078   5.929
  371    H    GLN  46           HN       GLN  46   4.771  -5.437   7.345
  372    HA   GLN  46           HA       GLN  46   3.108  -3.363   6.031
  373   1HB   GLN  46          HB2       GLN  46   5.110  -2.964   8.202
  374   2HB   GLN  46          HB1       GLN  46   5.158  -1.810   6.870
  375   1HG   GLN  46          HG2       GLN  46   2.560  -1.705   7.220
  376   2HG   GLN  46          HG1       GLN  46   2.934  -2.355   8.816
  377   1HE2  GLN  46          HE2       GLN  46   2.322   0.529   7.415
  378   2HE2  GLN  46          HE2       GLN  46   3.333   1.540   8.327
  379    H    SER  47           HN       SER  47   3.674  -4.250   4.000
  380    HA   SER  47           HA       SER  47   6.594  -4.449   3.369
  381   1HB   SER  47          HB2       SER  47   5.878  -5.999   1.652
  382   2HB   SER  47          HB1       SER  47   5.034  -6.430   3.138
  383    HG   SER  47           HG       SER  47   3.234  -6.007   2.155
  384    H    CYS  48           HN       CYS  48   7.442  -3.158   1.734
  385    HA   CYS  48           HA       CYS  48   5.903  -0.860   0.833
  386   1HB   CYS  48          HB2       CYS  48   8.532  -1.459   1.248
  387   2HB   CYS  48          HB1       CYS  48   8.441  -1.594  -0.508
  388    H    GLY  49           HN       GLY  49   4.500  -0.937  -0.884
  389   1HA   GLY  49          HA2       GLY  49   4.791  -3.131  -2.857
  390   2HA   GLY  49          HA1       GLY  49   3.365  -2.121  -2.651
  391    H    ASP  50           HN       ASP  50   5.124  -2.729  -5.022
  392    HA   ASP  50           HA       ASP  50   6.223  -0.063  -5.688
  393   1HB   ASP  50          HB2       ASP  50   7.296  -2.330  -6.185
  394   2HB   ASP  50          HB1       ASP  50   6.031  -2.564  -7.392
  395    HA   PRO  51           HA       PRO  51   2.422   1.142  -7.600
  396   1HB   PRO  51          HB2       PRO  51   3.383   3.142  -9.219
  397   2HB   PRO  51          HB1       PRO  51   3.162   3.329  -7.468
  398   1HG   PRO  51          HG2       PRO  51   5.651   2.759  -9.010
  399   2HG   PRO  51          HG1       PRO  51   5.407   3.823  -7.615
  400   1HD   PRO  51          HD2       PRO  51   6.508   1.359  -7.401
  401   2HD   PRO  51          HD1       PRO  51   5.545   2.099  -6.104
  402    H    LYS  52           HN       LYS  52   5.265   0.276  -9.507
  403    HA   LYS  52           HA       LYS  52   4.016   0.153 -12.086
  404   1HB   LYS  52          HB2       LYS  52   6.512  -0.365 -10.884
  405   2HB   LYS  52          HB1       LYS  52   6.028  -1.890 -11.626
  406   1HG   LYS  52          HG2       LYS  52   5.405  -0.384 -13.681
  407   2HG   LYS  52          HG1       LYS  52   6.500   0.776 -12.926
  408   1HD   LYS  52          HD2       LYS  52   8.039  -1.423 -12.751
  409   2HD   LYS  52          HD1       LYS  52   7.103  -1.853 -14.184
  410   1HE   LYS  52          HE2       LYS  52   7.686   0.656 -14.889
  411   2HE   LYS  52          HE1       LYS  52   9.066   0.375 -13.809
  412   1HZ   LYS  52          HZ1       LYS  52   9.768  -0.483 -15.848
  413   2HZ   LYS  52          HZ2       LYS  52   8.254  -1.169 -16.198
  414   3HZ   LYS  52          HZ3       LYS  52   9.245  -1.858 -15.001
  415    H    GLN  53           HN       GLN  53   3.703  -1.833  -9.260
  416    HA   GLN  53           HA       GLN  53   2.864  -4.267 -10.632
  417   1HB   GLN  53          HB2       GLN  53   2.539  -3.283  -7.777
  418   2HB   GLN  53          HB1       GLN  53   2.308  -4.946  -8.318
  419   1HG   GLN  53          HG2       GLN  53   4.898  -3.601  -8.972
  420   2HG   GLN  53          HG1       GLN  53   4.639  -4.148  -7.315
  421   1HE2  GLN  53          HE2       GLN  53   6.210  -5.901  -7.536
  422   2HE2  GLN  53          HE2       GLN  53   5.874  -7.273  -8.478
  423    H    GLU  54           HN       GLU  54   0.626  -5.106 -10.493
  424    HA   GLU  54           HA       GLU  54  -1.353  -2.956 -10.960
  425   1HB   GLU  54          HB2       GLU  54  -1.435  -5.981 -11.219
  426   2HB   GLU  54          HB1       GLU  54  -2.699  -4.884 -11.777
  427   1HG   GLU  54          HG2       GLU  54  -0.471  -3.772 -12.925
  428   2HG   GLU  54          HG1       GLU  54  -0.078  -5.490 -12.980
  429    H    TRP  55           HN       TRP  55  -0.448  -4.971  -8.280
  430    HA   TRP  55           HA       TRP  55  -3.175  -5.078  -7.197
  431   1HB   TRP  55          HB2       TRP  55  -2.059  -6.156  -5.291
  432   2HB   TRP  55          HB1       TRP  55  -1.593  -6.896  -6.811
  433    HD1  TRP  55           HD1      TRP  55   0.906  -6.552  -7.637
  434    HE1  TRP  55           HE1      TRP  55   3.045  -5.880  -6.351
  435    HE3  TRP  55           HE3      TRP  55  -1.168  -4.612  -3.402
  436    HZ2  TRP  55           HZ2      TRP  55   3.765  -4.715  -3.879
  437    HZ3  TRP  55           HZ3      TRP  55   0.272  -3.739  -1.593
  438    HH2  TRP  55           HH2      TRP  55   2.739  -3.775  -1.825
  439    H    VAL  56           HN       VAL  56  -0.370  -2.958  -6.964
  440    HA   VAL  56           HA       VAL  56  -1.364  -1.519  -4.625
  441    HB   VAL  56           HB       VAL  56   0.520  -0.750  -6.904
  442   1HG1  VAL  56          HG1       VAL  56   0.897   0.781  -4.500
  443   2HG1  VAL  56          HG1       VAL  56  -0.791   0.905  -4.988
  444   3HG1  VAL  56          HG1       VAL  56   0.487   1.361  -6.112
  445   1HG2  VAL  56          HG2       VAL  56   0.810  -2.322  -4.492
  446   2HG2  VAL  56          HG2       VAL  56   1.826  -0.883  -4.398
  447   3HG2  VAL  56          HG2       VAL  56   2.003  -2.000  -5.751
  448    H    GLN  57           HN       GLN  57  -1.321  -0.912  -8.144
  449    HA   GLN  57           HA       GLN  57  -3.075   1.310  -8.244
  450   1HB   GLN  57          HB2       GLN  57  -1.692  -0.382  -9.976
  451   2HB   GLN  57          HB1       GLN  57  -3.380  -0.692 -10.385
  452   1HG   GLN  57          HG2       GLN  57  -3.688   1.835 -10.493
  453   2HG   GLN  57          HG1       GLN  57  -1.931   1.965 -10.401
  454   1HE2  GLN  57          HE2       GLN  57  -4.040  -0.365 -12.182
  455   2HE2  GLN  57          HE2       GLN  57  -3.352  -0.047 -13.701
  456    H    ARG  58           HN       ARG  58  -3.803  -2.193  -8.469
  457    HA   ARG  58           HA       ARG  58  -6.624  -2.045  -8.706
  458   1HB   ARG  58          HB2       ARG  58  -5.291  -4.089  -8.971
  459   2HB   ARG  58          HB1       ARG  58  -4.811  -4.022  -7.275
  460   1HG   ARG  58          HG2       ARG  58  -7.199  -4.245  -6.618
  461   2HG   ARG  58          HG1       ARG  58  -7.632  -4.400  -8.321
  462   1HD   ARG  58          HD2       ARG  58  -5.525  -6.249  -7.864
  463   2HD   ARG  58          HD1       ARG  58  -6.685  -6.454  -6.535
  464    HE   ARG  58           HE       ARG  58  -8.472  -6.589  -8.332
  465   1HH1  ARG  58          HH2       ARG  58  -6.513  -8.965  -8.328
  466   2HH1  ARG  58          HH2       ARG  58  -6.237  -9.151 -10.028
  467   1HH2  ARG  58          HH1       ARG  58  -7.539  -6.045 -10.849
  468   2HH2  ARG  58          HH1       ARG  58  -6.820  -7.499 -11.456
  469    H    TYR  59           HN       TYR  59  -4.719  -2.562  -5.710
  470    HA   TYR  59           HA       TYR  59  -6.829  -2.235  -3.839
  471   1HB   TYR  59          HB2       TYR  59  -3.874  -1.530  -3.736
  472   2HB   TYR  59          HB1       TYR  59  -4.908  -1.609  -2.319
  473    HD1  TYR  59           HD1      TYR  59  -6.042  -4.108  -4.576
  474    HD2  TYR  59           HD2      TYR  59  -2.856  -3.242  -1.819
  475    HE1  TYR  59           HE1      TYR  59  -5.566  -6.532  -4.340
  476    HE2  TYR  59           HE2      TYR  59  -2.389  -5.663  -1.591
  477    HH   TYR  59           HH       TYR  59  -3.360  -7.750  -1.940
  478    H    MET  60           HN       MET  60  -4.400   0.136  -4.843
  479    HA   MET  60           HA       MET  60  -5.225   2.490  -3.669
  480   1HB   MET  60          HB2       MET  60  -4.077   1.750  -6.350
  481   2HB   MET  60          HB1       MET  60  -4.352   3.443  -5.944
  482   1HG   MET  60          HG2       MET  60  -3.083   2.987  -3.775
  483   2HG   MET  60          HG1       MET  60  -2.588   1.460  -4.490
  484   1HE   MET  60          HE1       MET  60  -1.519   5.668  -5.168
  485   2HE   MET  60          HE2       MET  60  -3.052   4.957  -4.667
  486   3HE   MET  60          HE3       MET  60  -2.750   5.267  -6.375
  487    H    LYS  61           HN       LYS  61  -6.803   0.808  -6.351
  488    HA   LYS  61           HA       LYS  61  -8.501   3.002  -7.174
  489   1HB   LYS  61          HB2       LYS  61  -7.823   0.657  -8.238
  490   2HB   LYS  61          HB1       LYS  61  -9.292   0.120  -7.425
  491   1HG   LYS  61          HG2       LYS  61 -10.666   1.539  -8.682
  492   2HG   LYS  61          HG1       LYS  61  -9.334   2.619  -9.096
  493   1HD   LYS  61          HD2       LYS  61  -8.338   0.658 -10.403
  494   2HD   LYS  61          HD1       LYS  61  -9.900  -0.137 -10.201
  495   1HE   LYS  61          HE2       LYS  61 -10.424   2.531 -11.069
  496   2HE   LYS  61          HE1       LYS  61  -9.183   1.851 -12.139
  497   1HZ   LYS  61          HZ1       LYS  61 -11.611   1.293 -12.657
  498   2HZ   LYS  61          HZ2       LYS  61 -11.533   0.262 -11.307
  499   3HZ   LYS  61          HZ3       LYS  61 -10.498   0.012 -12.633
  500    H    ASN  62           HN       ASN  62  -9.090   0.120  -5.124
  501    HA   ASN  62           HA       ASN  62 -11.743   0.978  -4.314
  502   1HB   ASN  62          HB2       ASN  62  -9.959  -1.261  -4.051
  503   2HB   ASN  62          HB1       ASN  62 -10.561  -0.828  -2.449
  504   1HD2  ASN  62          HD2       ASN  62 -11.362  -3.247  -3.840
  505   2HD2  ASN  62          HD2       ASN  62 -13.024  -3.121  -4.169
  506    H    LEU  63           HN       LEU  63  -8.496   1.627  -3.227
  507    HA   LEU  63           HA       LEU  63  -9.133   2.435  -0.522
  508   1HB   LEU  63          HB2       LEU  63  -6.857   2.661  -2.465
  509   2HB   LEU  63          HB1       LEU  63  -6.812   3.630  -0.989
  510    HG   LEU  63           HG       LEU  63  -7.361   0.657  -0.950
  511   1HD1  LEU  63          HD1       LEU  63  -5.189   0.838  -1.945
  512   2HD1  LEU  63          HD1       LEU  63  -4.919   0.503  -0.235
  513   3HD1  LEU  63          HD1       LEU  63  -4.726   2.143  -0.853
  514   1HD2  LEU  63          HD2       LEU  63  -6.237   2.513   1.168
  515   2HD2  LEU  63          HD2       LEU  63  -6.804   0.859   1.390
  516   3HD2  LEU  63          HD2       LEU  63  -7.954   2.144   1.019
  517    H    ASP  64           HN       ASP  64  -8.807   4.138  -3.618
  518    HA   ASP  64           HA       ASP  64  -9.122   6.797  -2.509
  519   1HB   ASP  64          HB2       ASP  64  -8.139   5.883  -4.771
  520   2HB   ASP  64          HB1       ASP  64  -9.808   6.005  -5.328
  521    H    ALA  65           HN       ALA  65 -11.346   4.415  -3.940
  522    HA   ALA  65           HA       ALA  65 -13.659   6.137  -4.007
  523   1HB   ALA  65          HB1       ALA  65 -13.677   3.136  -3.682
  524   2HB   ALA  65          HB2       ALA  65 -13.112   3.881  -5.179
  525   3HB   ALA  65          HB3       ALA  65 -14.770   4.143  -4.634
  526    H    LYS  66           HN       LYS  66 -12.054   4.425  -1.447
  527    HA   LYS  66           HA       LYS  66 -14.303   4.070   0.328
  528   1HB   LYS  66          HB2       LYS  66 -11.789   3.168   0.218
  529   2HB   LYS  66          HB1       LYS  66 -11.525   4.517   1.323
  530   1HG   LYS  66          HG2       LYS  66 -13.535   3.619   2.645
  531   2HG   LYS  66          HG1       LYS  66 -13.362   2.149   1.684
  532   1HD   LYS  66          HD2       LYS  66 -11.041   1.905   2.437
  533   2HD   LYS  66          HD1       LYS  66 -11.175   3.396   3.369
  534   1HE   LYS  66          HE2       LYS  66 -13.092   2.319   4.642
  535   2HE   LYS  66          HE1       LYS  66 -12.661   0.792   3.842
  536   1HZ   LYS  66          HZ1       LYS  66 -10.543   0.807   4.771
  537   2HZ   LYS  66          HZ2       LYS  66 -11.525   1.327   6.057
  538   3HZ   LYS  66          HZ3       LYS  66 -10.611   2.454   5.172
  539    H    GLN  67           HN       GLN  67 -11.621   6.424   0.455
  540    HA   GLN  67           HA       GLN  67 -12.594   8.075   2.506
  541   1HB   GLN  67          HB2       GLN  67 -10.374   8.036   1.171
  542   2HB   GLN  67          HB1       GLN  67 -11.198   9.105   0.035
  543   1HG   GLN  67          HG2       GLN  67 -11.201  10.868   1.486
  544   2HG   GLN  67          HG1       GLN  67 -11.446   9.838   2.897
  545   1HE2  GLN  67          HE2       GLN  67  -9.397   8.357   3.366
  546   2HE2  GLN  67          HE2       GLN  67  -7.893   9.134   3.236
  547    H    LYS  68           HN       LYS  68 -13.655   7.850  -0.833
  548    HA   LYS  68           HA       LYS  68 -15.365  10.277  -0.482
  549   1HB   LYS  68          HB2       LYS  68 -13.698   9.427  -2.506
  550   2HB   LYS  68          HB1       LYS  68 -15.277   8.895  -3.085
  551   1HG   LYS  68          HG2       LYS  68 -16.025  11.318  -2.351
  552   2HG   LYS  68          HG1       LYS  68 -14.307  11.677  -2.523
  553   1HD   LYS  68          HD2       LYS  68 -14.311  10.949  -4.826
  554   2HD   LYS  68          HD1       LYS  68 -15.957  10.334  -4.679
  555   1HE   LYS  68          HE2       LYS  68 -16.580  12.375  -5.498
  556   2HE   LYS  68          HE1       LYS  68 -16.225  12.972  -3.865
  557   1HZ   LYS  68          HZ1       LYS  68 -14.871  14.244  -5.281
  558   2HZ   LYS  68          HZ2       LYS  68 -14.425  12.897  -6.216
  559   3HZ   LYS  68          HZ3       LYS  68 -13.829  13.071  -4.634
  560    H    LYS  69           HN       LYS  69 -17.635  10.105  -0.775
  561    HA   LYS  69           HA       LYS  69 -18.839   7.547  -0.100
  562   1HB   LYS  69          HB2       LYS  69 -19.511  10.355  -0.271
  563   2HB   LYS  69          HB1       LYS  69 -20.778   9.387  -1.026
  564   1HG   LYS  69          HG2       LYS  69 -20.519   7.883   1.115
  565   2HG   LYS  69          HG1       LYS  69 -19.803   9.336   1.814
  566   1HD   LYS  69          HD2       LYS  69 -21.964   9.876   2.297
  567   2HD   LYS  69          HD1       LYS  69 -22.015  10.385   0.608
  568   1HE   LYS  69          HE2       LYS  69 -23.555   8.790   0.159
  569   2HE   LYS  69          HE1       LYS  69 -22.449   7.534   0.750
  570   1HZ   LYS  69          HZ1       LYS  69 -24.469   7.660   2.105
  571   2HZ   LYS  69          HZ2       LYS  69 -24.131   9.286   2.467
  572   3HZ   LYS  69          HZ3       LYS  69 -23.091   8.057   3.009
  573    H    ALA  70           HN       ALA  70 -20.994   7.119  -1.585
  574    HA   ALA  70           HA       ALA  70 -20.235   7.213  -4.466
  575   1HB   ALA  70          HB1       ALA  70 -21.267   4.614  -3.728
  576   2HB   ALA  70          HB2       ALA  70 -19.866   5.015  -2.733
  577   3HB   ALA  70          HB3       ALA  70 -19.726   5.014  -4.491
  578    H    SER  71           HN       SER  71 -22.684   5.690  -2.354
  579    HA   SER  71           HA       SER  71 -24.801   7.048  -3.990
  580   1HB   SER  71          HB2       SER  71 -24.115   4.312  -3.868
  581   2HB   SER  71          HB1       SER  71 -25.599   4.472  -2.935
  582    HG   SER  71           HG       SER  71 -25.240   5.643  -5.489
  583    HA   PRO  72           HA       PRO  72 -25.635   8.063   0.364
  584   1HB   PRO  72          HB2       PRO  72 -27.050  10.334  -0.172
  585   2HB   PRO  72          HB1       PRO  72 -25.277  10.292  -0.102
  586   1HG   PRO  72          HG2       PRO  72 -27.077  10.277  -2.463
  587   2HG   PRO  72          HG1       PRO  72 -25.524  11.092  -2.231
  588   1HD   PRO  72          HD2       PRO  72 -25.820   8.783  -3.654
  589   2HD   PRO  72          HD1       PRO  72 -24.317   9.244  -2.823
  590    H    ARG  73           HN       ARG  73 -27.753   7.688  -2.394
  591    HA   ARG  73           HA       ARG  73 -29.966   6.894  -0.529
  592   1HB   ARG  73          HB2       ARG  73 -29.803   8.929  -2.633
  593   2HB   ARG  73          HB1       ARG  73 -31.165   7.830  -2.854
  594   1HG   ARG  73          HG2       ARG  73 -30.695   8.834  -0.091
  595   2HG   ARG  73          HG1       ARG  73 -31.310   9.999  -1.266
  596   1HD   ARG  73          HD2       ARG  73 -32.652   7.358  -1.335
  597   2HD   ARG  73          HD1       ARG  73 -32.925   8.306   0.141
  598    HE   ARG  73           HE       ARG  73 -33.135  10.028  -2.139
  599   1HH1  ARG  73          HH1       ARG  73 -34.730   7.531  -2.912
  600   2HH1  ARG  73          HH1       ARG  73 -36.313   7.973  -2.364
  601   1HH2  ARG  73          HH2       ARG  73 -35.188  10.587  -0.383
  602   2HH2  ARG  73          HH2       ARG  73 -36.572   9.703  -0.932
  Start of MODEL   12
    1   1H    VAL   1          HT1       VAL   1  -5.412  11.938   3.849
    2   2H    VAL   1          HT2       VAL   1  -4.723  13.127   2.851
    3   3H    VAL   1          HT3       VAL   1  -5.695  13.580   4.168
    4    HA   VAL   1           HA       VAL   1  -3.545  13.946   4.961
    5    HB   VAL   1           HB       VAL   1  -4.461  11.143   5.685
    6   1HG1  VAL   1          HG1       VAL   1  -3.146  11.308   7.635
    7   2HG1  VAL   1          HG1       VAL   1  -2.947  13.052   7.461
    8   3HG1  VAL   1          HG1       VAL   1  -2.091  11.954   6.378
    9   1HG2  VAL   1          HG2       VAL   1  -5.244  12.825   7.702
   10   2HG2  VAL   1          HG2       VAL   1  -6.288  12.321   6.371
   11   3HG2  VAL   1          HG2       VAL   1  -5.439  13.865   6.291
   12    H    VAL   2           HN       VAL   2  -2.047  13.952   3.141
   13    HA   VAL   2           HA       VAL   2  -0.980  11.527   1.979
   14    HB   VAL   2           HB       VAL   2   0.701  13.154   1.086
   15   1HG1  VAL   2          HG1       VAL   2  -1.377  14.878   0.466
   16   2HG1  VAL   2          HG1       VAL   2  -2.214  13.387   0.897
   17   3HG1  VAL   2          HG1       VAL   2  -1.004  13.380  -0.387
   18   1HG2  VAL   2          HG2       VAL   2  -0.509  15.562   2.073
   19   2HG2  VAL   2          HG2       VAL   2   1.164  15.030   2.244
   20   3HG2  VAL   2          HG2       VAL   2  -0.036  14.566   3.450
   21    H    ILE   3           HN       ILE   3   0.829  10.368   2.563
   22    HA   ILE   3           HA       ILE   3   2.275  11.203   5.043
   23    HB   ILE   3           HB       ILE   3   0.621   9.477   5.439
   24   1HG1  ILE   3          HG1       ILE   3   3.497   9.076   5.709
   25   2HG1  ILE   3          HG1       ILE   3   2.221   8.756   6.873
   26   1HG2  ILE   3          HG2       ILE   3   0.266   8.653   3.210
   27   2HG2  ILE   3          HG2       ILE   3   0.810   7.286   4.175
   28   3HG2  ILE   3          HG2       ILE   3   1.934   8.094   3.083
   29   1HD1  ILE   3          HD1       ILE   3   1.757   6.599   5.644
   30   2HD1  ILE   3          HD1       ILE   3   3.340   6.668   6.416
   31   3HD1  ILE   3          HD1       ILE   3   3.196   6.913   4.675
   32    HA   PRO   4           HA       PRO   4   5.195  10.035   1.565
   33   1HB   PRO   4          HB2       PRO   4   6.265  12.489   1.035
   34   2HB   PRO   4          HB1       PRO   4   4.806  11.884   0.228
   35   1HG   PRO   4          HG2       PRO   4   5.076  13.887   2.382
   36   2HG   PRO   4          HG1       PRO   4   3.861  13.755   1.105
   37   1HD   PRO   4          HD2       PRO   4   3.529  13.007   3.777
   38   2HD   PRO   4          HD1       PRO   4   2.476  12.555   2.422
   39    H    SER   5           HN       SER   5   5.414  12.038   4.416
   40    HA   SER   5           HA       SER   5   8.096  12.472   4.867
   41   1HB   SER   5          HB2       SER   5   5.692  11.913   6.463
   42   2HB   SER   5          HB1       SER   5   7.204  11.602   7.314
   43    HG   SER   5           HG       SER   5   6.097  13.973   6.421
   44    HA   PRO   6           HA       PRO   6   8.793   8.072   6.558
   45   1HB   PRO   6          HB2       PRO   6   6.856   6.190   6.195
   46   2HB   PRO   6          HB1       PRO   6   6.918   7.262   7.607
   47   1HG   PRO   6          HG2       PRO   6   5.223   7.421   5.181
   48   2HG   PRO   6          HG1       PRO   6   4.837   7.821   6.860
   49   1HD   PRO   6          HD2       PRO   6   5.424   9.673   4.920
   50   2HD   PRO   6          HD1       PRO   6   5.628   9.955   6.662
   51    H    CYS   7           HN       CYS   7   9.726   6.224   5.491
   52    HA   CYS   7           HA       CYS   7   9.065   5.851   2.604
   53   1HB   CYS   7          HB2       CYS   7  10.937   7.540   3.030
   54   2HB   CYS   7          HB1       CYS   7  11.876   6.198   3.684
   55    H    CYS   8           HN       CYS   8   9.308   3.685   1.972
   56    HA   CYS   8           HA       CYS   8   9.763   1.720   4.108
   57   1HB   CYS   8          HB2       CYS   8   9.042   0.152   2.352
   58   2HB   CYS   8          HB1       CYS   8   7.963   1.545   2.407
   59    H    MET   9           HN       MET   9  10.946  -0.362   2.630
   60    HA   MET   9           HA       MET   9  13.655   0.716   1.947
   61   1HB   MET   9          HB2       MET   9  14.522  -1.286   3.230
   62   2HB   MET   9          HB1       MET   9  13.683  -0.103   4.230
   63   1HG   MET   9          HG2       MET   9  11.850  -2.084   3.114
   64   2HG   MET   9          HG1       MET   9  13.112  -2.829   4.095
   65   1HE   MET   9          HE1       MET   9   9.785  -2.708   5.810
   66   2HE   MET   9          HE2       MET   9  10.157  -2.618   4.090
   67   3HE   MET   9          HE3       MET   9   9.391  -1.248   4.891
   68    H    PHE  10           HN       PHE  10  13.845  -2.608   1.949
   69    HA   PHE  10           HA       PHE  10  14.102  -2.946  -0.821
   70   1HB   PHE  10          HB2       PHE  10  13.940  -5.322  -0.290
   71   2HB   PHE  10          HB1       PHE  10  14.767  -4.508   1.036
   72    HD1  PHE  10           HD1      PHE  10  11.502  -5.905  -0.067
   73    HD2  PHE  10           HD2      PHE  10  13.817  -4.431   3.235
   74    HE1  PHE  10           HE1      PHE  10   9.772  -6.724   1.511
   75    HE2  PHE  10           HE2      PHE  10  12.088  -5.249   4.813
   76    HZ   PHE  10           HZ       PHE  10  10.067  -6.396   3.952
   77    H    PHE  11           HN       PHE  11  12.609  -4.018  -2.370
   78    HA   PHE  11           HA       PHE  11   9.826  -3.079  -1.994
   79   1HB   PHE  11          HB2       PHE  11  11.684  -3.533  -4.159
   80   2HB   PHE  11          HB1       PHE  11  10.196  -4.427  -4.467
   81    HD1  PHE  11           HD1      PHE  11   8.186  -2.695  -3.133
   82    HD2  PHE  11           HD2      PHE  11  11.549  -1.672  -5.602
   83    HE1  PHE  11           HE1      PHE  11   7.060  -0.593  -3.799
   84    HE2  PHE  11           HE2      PHE  11  10.419   0.430  -6.267
   85    HZ   PHE  11           HZ       PHE  11   8.174   0.973  -5.365
   86    H    VAL  12           HN       VAL  12   8.038  -4.513  -2.004
   87    HA   VAL  12           HA       VAL  12   8.218  -6.992  -0.725
   88    HB   VAL  12           HB       VAL  12   5.956  -7.364  -1.813
   89   1HG1  VAL  12          HG1       VAL  12   5.809  -6.189   0.193
   90   2HG1  VAL  12          HG1       VAL  12   5.069  -5.056  -0.938
   91   3HG1  VAL  12          HG1       VAL  12   6.741  -4.823  -0.424
   92   1HG2  VAL  12          HG2       VAL  12   7.071  -5.481  -3.675
   93   2HG2  VAL  12          HG2       VAL  12   5.629  -4.773  -2.948
   94   3HG2  VAL  12          HG2       VAL  12   5.529  -6.330  -3.772
   95    H    SER  13           HN       SER  13   8.805  -9.045  -1.394
   96    HA   SER  13           HA       SER  13  10.136  -9.512  -3.866
   97   1HB   SER  13          HB2       SER  13  10.598 -11.052  -2.174
   98   2HB   SER  13          HB1       SER  13   8.915 -11.146  -1.665
   99    HG   SER  13           HG       SER  13   9.427 -13.023  -2.759
  100    H    LYS  14           HN       LYS  14   6.754  -9.604  -2.963
  101    HA   LYS  14           HA       LYS  14   5.997  -9.918  -5.794
  102   1HB   LYS  14          HB2       LYS  14   5.269 -11.881  -3.596
  103   2HB   LYS  14          HB1       LYS  14   4.500 -11.859  -5.183
  104   1HG   LYS  14          HG2       LYS  14   6.887 -12.037  -6.143
  105   2HG   LYS  14          HG1       LYS  14   7.374 -12.487  -4.508
  106   1HD   LYS  14          HD2       LYS  14   5.021 -13.891  -5.708
  107   2HD   LYS  14          HD1       LYS  14   6.632 -14.335  -6.276
  108   1HE   LYS  14          HE2       LYS  14   7.317 -15.082  -4.145
  109   2HE   LYS  14          HE1       LYS  14   6.034 -14.172  -3.317
  110   1HZ   LYS  14          HZ1       LYS  14   5.524 -16.359  -5.261
  111   2HZ   LYS  14          HZ2       LYS  14   4.381 -15.565  -4.285
  112   3HZ   LYS  14          HZ3       LYS  14   5.543 -16.584  -3.580
  113    H    ARG  15           HN       ARG  15   3.457  -9.879  -5.892
  114    HA   ARG  15           HA       ARG  15   2.527  -7.472  -4.660
  115   1HB   ARG  15          HB2       ARG  15   0.409  -8.118  -5.698
  116   2HB   ARG  15          HB1       ARG  15   1.736  -8.518  -6.789
  117   1HG   ARG  15          HG2       ARG  15   0.999 -10.642  -6.827
  118   2HG   ARG  15          HG1       ARG  15   1.401 -10.768  -5.113
  119   1HD   ARG  15          HD2       ARG  15  -0.787 -10.704  -4.505
  120   2HD   ARG  15          HD1       ARG  15  -1.116  -9.328  -5.577
  121    HE   ARG  15           HE       ARG  15  -1.602 -12.090  -6.241
  122   1HH1  ARG  15          HH1       ARG  15  -2.167  -9.118  -7.423
  123   2HH1  ARG  15          HH1       ARG  15  -1.813  -9.461  -9.083
  124   1HH2  ARG  15          HH2       ARG  15  -0.380 -12.545  -8.418
  125   2HH2  ARG  15          HH2       ARG  15  -0.802 -11.401  -9.647
  126    H    ILE  16           HN       ILE  16  -0.130  -8.451  -3.868
  127    HA   ILE  16           HA       ILE  16   0.396 -10.094  -1.444
  128    HB   ILE  16           HB       ILE  16  -1.145  -7.591  -0.962
  129   1HG1  ILE  16          HG1       ILE  16   1.859  -7.540  -1.426
  130   2HG1  ILE  16          HG1       ILE  16   0.644  -6.623  -2.313
  131   1HG2  ILE  16          HG2       ILE  16   0.900  -7.953   0.927
  132   2HG2  ILE  16          HG2       ILE  16   0.396  -9.578   0.475
  133   3HG2  ILE  16          HG2       ILE  16  -0.790  -8.427   1.090
  134   1HD1  ILE  16          HD1       ILE  16   0.110  -5.303  -0.363
  135   2HD1  ILE  16          HD1       ILE  16   1.865  -5.296  -0.537
  136   3HD1  ILE  16          HD1       ILE  16   1.104  -6.329   0.670
  137    HA   PRO  17           HA       PRO  17  -3.809 -11.146  -2.332
  138   1HB   PRO  17          HB2       PRO  17  -4.518 -12.329   0.024
  139   2HB   PRO  17          HB1       PRO  17  -3.399 -13.069  -1.136
  140   1HG   PRO  17          HG2       PRO  17  -2.854 -11.917   1.474
  141   2HG   PRO  17          HG1       PRO  17  -1.853 -12.978   0.482
  142   1HD   PRO  17          HD2       PRO  17  -1.664 -10.124   0.826
  143   2HD   PRO  17          HD1       PRO  17  -0.571 -11.206  -0.067
  144    H    GLU  18           HN       GLU  18  -5.355  -9.555  -2.487
  145    HA   GLU  18           HA       GLU  18  -5.810  -7.334  -0.910
  146   1HB   GLU  18          HB2       GLU  18  -6.936  -8.521  -3.085
  147   2HB   GLU  18          HB1       GLU  18  -8.235  -8.710  -1.909
  148   1HG   GLU  18          HG2       GLU  18  -7.375  -6.105  -1.490
  149   2HG   GLU  18          HG1       GLU  18  -7.277  -6.287  -3.242
  150    H    ASN  19           HN       ASN  19  -7.039 -10.614  -0.279
  151    HA   ASN  19           HA       ASN  19  -8.885  -9.921   1.801
  152   1HB   ASN  19          HB2       ASN  19  -7.353 -12.353   0.923
  153   2HB   ASN  19          HB1       ASN  19  -8.285 -12.412   2.420
  154   1HD2  ASN  19          HD2       ASN  19  -9.599 -14.062   1.070
  155   2HD2  ASN  19          HD2       ASN  19 -10.839 -13.445   0.089
  156    H    ARG  20           HN       ARG  20  -5.433  -9.903   1.773
  157    HA   ARG  20           HA       ARG  20  -5.316 -10.088   4.752
  158   1HB   ARG  20          HB2       ARG  20  -3.313 -10.332   2.499
  159   2HB   ARG  20          HB1       ARG  20  -2.845 -10.326   4.195
  160   1HG   ARG  20          HG2       ARG  20  -4.740 -12.184   4.364
  161   2HG   ARG  20          HG1       ARG  20  -4.350 -12.396   2.657
  162   1HD   ARG  20          HD2       ARG  20  -2.185 -13.130   3.102
  163   2HD   ARG  20          HD1       ARG  20  -2.098 -12.255   4.644
  164    HE   ARG  20           HE       ARG  20  -4.195 -14.149   4.867
  165   1HH1  ARG  20          HH2       ARG  20  -1.071 -14.623   3.667
  166   2HH1  ARG  20          HH2       ARG  20  -0.642 -15.856   4.805
  167   1HH2  ARG  20          HH1       ARG  20  -3.528 -15.491   6.692
  168   2HH2  ARG  20          HH1       ARG  20  -2.032 -16.346   6.517
  169    H    VAL  21           HN       VAL  21  -4.545  -7.992   2.012
  170    HA   VAL  21           HA       VAL  21  -3.118  -5.975   3.509
  171    HB   VAL  21           HB       VAL  21  -4.719  -5.740   0.941
  172   1HG1  VAL  21          HG1       VAL  21  -3.573  -3.783   0.538
  173   2HG1  VAL  21          HG1       VAL  21  -2.162  -4.297   1.460
  174   3HG1  VAL  21          HG1       VAL  21  -3.601  -3.722   2.299
  175   1HG2  VAL  21          HG2       VAL  21  -2.060  -6.074   0.262
  176   2HG2  VAL  21          HG2       VAL  21  -3.290  -7.333   0.180
  177   3HG2  VAL  21          HG2       VAL  21  -2.257  -7.202   1.603
  178    H    VAL  22           HN       VAL  22  -3.935  -3.884   4.194
  179    HA   VAL  22           HA       VAL  22  -6.898  -3.757   4.517
  180    HB   VAL  22           HB       VAL  22  -6.360  -2.749   6.742
  181   1HG1  VAL  22          HG1       VAL  22  -5.304  -4.971   7.649
  182   2HG1  VAL  22          HG1       VAL  22  -5.531  -5.519   5.987
  183   3HG1  VAL  22          HG1       VAL  22  -6.920  -4.994   6.941
  184   1HG2  VAL  22          HG2       VAL  22  -3.542  -3.572   6.009
  185   2HG2  VAL  22          HG2       VAL  22  -4.054  -3.075   7.618
  186   3HG2  VAL  22          HG2       VAL  22  -4.109  -1.926   6.286
  187    H    SER  23           HN       SER  23  -3.861  -1.931   4.367
  188    HA   SER  23           HA       SER  23  -5.050   0.210   2.807
  189   1HB   SER  23          HB2       SER  23  -6.052   0.549   5.050
  190   2HB   SER  23          HB1       SER  23  -4.437   0.634   5.748
  191    HG   SER  23           HG       SER  23  -5.841   2.483   4.224
  192    H    TYR  24           HN       TYR  24  -3.377   1.653   2.053
  193    HA   TYR  24           HA       TYR  24  -0.638   0.722   2.718
  194   1HB   TYR  24          HB2       TYR  24  -0.109   1.518   0.500
  195   2HB   TYR  24          HB1       TYR  24  -1.599   0.594   0.396
  196    HD1  TYR  24           HD1      TYR  24  -3.726   1.677  -0.069
  197    HD2  TYR  24           HD2      TYR  24  -0.129   3.985   0.362
  198    HE1  TYR  24           HE1      TYR  24  -4.890   3.661  -0.994
  199    HE2  TYR  24           HE2      TYR  24  -1.294   5.969  -0.565
  200    HH   TYR  24           HH       TYR  24  -4.175   6.547  -0.619
  201    H    GLN  25           HN       GLN  25   0.915   2.684   1.956
  202    HA   GLN  25           HA       GLN  25   0.126   5.285   3.129
  203   1HB   GLN  25          HB2       GLN  25   2.058   3.280   4.260
  204   2HB   GLN  25          HB1       GLN  25   2.445   4.993   4.424
  205   1HG   GLN  25          HG2       GLN  25   0.177   5.357   5.424
  206   2HG   GLN  25          HG1       GLN  25  -0.079   3.612   5.377
  207   1HE2  GLN  25          HE2       GLN  25   1.354   2.260   6.756
  208   2HE2  GLN  25          HE2       GLN  25   2.138   2.945   8.096
  209    H    LEU  26           HN       LEU  26   0.546   6.292   1.139
  210    HA   LEU  26           HA       LEU  26   2.603   5.582  -0.673
  211   1HB   LEU  26          HB2       LEU  26   0.680   7.772  -0.224
  212   2HB   LEU  26          HB1       LEU  26   2.076   8.205  -1.211
  213    HG   LEU  26           HG       LEU  26   0.276   5.814  -1.700
  214   1HD1  LEU  26          HD1       LEU  26  -0.089   7.323  -3.861
  215   2HD1  LEU  26          HD1       LEU  26   0.324   8.620  -2.739
  216   3HD1  LEU  26          HD1       LEU  26  -1.055   7.571  -2.406
  217   1HD2  LEU  26          HD2       LEU  26   2.641   6.977  -3.199
  218   2HD2  LEU  26          HD2       LEU  26   1.534   5.796  -3.898
  219   3HD2  LEU  26          HD2       LEU  26   2.513   5.366  -2.499
  220    H    SER  27           HN       SER  27   4.582   6.553  -1.177
  221    HA   SER  27           HA       SER  27   5.800   8.314   0.905
  222   1HB   SER  27          HB2       SER  27   7.829   6.902   0.686
  223   2HB   SER  27          HB1       SER  27   6.442   5.950   1.203
  224    HG   SER  27           HG       SER  27   6.948   4.780  -0.475
  225    H    SER  28           HN       SER  28   8.357   8.351  -0.486
  226    HA   SER  28           HA       SER  28   7.876   9.195  -3.255
  227   1HB   SER  28          HB2       SER  28   7.856  11.046  -0.958
  228   2HB   SER  28          HB1       SER  28   8.910  11.543  -2.277
  229    HG   SER  28           HG       SER  28   7.208  11.947  -3.444
  230    H    ARG  29           HN       ARG  29  10.110  10.805  -3.625
  231    HA   ARG  29           HA       ARG  29  12.321   8.884  -3.060
  232   1HB   ARG  29          HB2       ARG  29  11.463  10.017  -5.351
  233   2HB   ARG  29          HB1       ARG  29  12.620  11.250  -4.848
  234   1HG   ARG  29          HG2       ARG  29  13.916   8.796  -4.395
  235   2HG   ARG  29          HG1       ARG  29  13.128   8.625  -5.963
  236   1HD   ARG  29          HD2       ARG  29  14.347  11.251  -5.739
  237   2HD   ARG  29          HD1       ARG  29  15.545   9.971  -5.461
  238    HE   ARG  29           HE       ARG  29  14.115   9.019  -7.614
  239   1HH1  ARG  29          HH1       ARG  29  16.484  11.337  -6.945
  240   2HH1  ARG  29          HH1       ARG  29  16.529  11.994  -8.547
  241   1HH2  ARG  29          HH2       ARG  29  13.819  10.142  -9.666
  242   2HH2  ARG  29          HH2       ARG  29  15.020  11.317 -10.089
  243    H    SER  30           HN       SER  30  14.304  11.047  -3.614
  244    HA   SER  30           HA       SER  30  15.631  12.550  -2.372
  245   1HB   SER  30          HB2       SER  30  12.835  13.317  -2.202
  246   2HB   SER  30          HB1       SER  30  13.704  13.805  -0.750
  247    HG   SER  30           HG       SER  30  13.745  14.933  -3.138
  248    H    THR  31           HN       THR  31  14.794   9.831  -1.215
  249    HA   THR  31           HA       THR  31  15.929  10.283   1.460
  250    HB   THR  31           HB       THR  31  13.762   8.908   2.275
  251    HG1  THR  31           HG1      THR  31  11.960   9.849   1.158
  252   1HG2  THR  31          HG2       THR  31  14.698  11.207   2.977
  253   2HG2  THR  31          HG2       THR  31  12.973  10.926   3.213
  254   3HG2  THR  31          HG2       THR  31  13.532  11.883   1.841
  255    H    CYS  32           HN       CYS  32  14.227   7.953  -0.628
  256    HA   CYS  32           HA       CYS  32  16.097   5.823   0.345
  257   1HB   CYS  32          HB2       CYS  32  13.327   5.750  -0.894
  258   2HB   CYS  32          HB1       CYS  32  14.263   4.313  -0.484
  259    H    LEU  33           HN       LEU  33  16.324   4.058  -1.512
  260    HA   LEU  33           HA       LEU  33  17.624   5.369  -3.765
  261   1HB   LEU  33          HB2       LEU  33  17.182   2.601  -2.711
  262   2HB   LEU  33          HB1       LEU  33  17.703   2.776  -4.388
  263    HG   LEU  33           HG       LEU  33  19.101   4.091  -2.044
  264   1HD1  LEU  33          HD1       LEU  33  19.468   1.425  -3.380
  265   2HD1  LEU  33          HD1       LEU  33  19.561   1.833  -1.667
  266   3HD1  LEU  33          HD1       LEU  33  20.876   2.281  -2.754
  267   1HD2  LEU  33          HD2       LEU  33  19.714   3.769  -4.992
  268   2HD2  LEU  33          HD2       LEU  33  20.942   4.229  -3.811
  269   3HD2  LEU  33          HD2       LEU  33  19.546   5.270  -4.081
  270    H    LYS  34           HN       LYS  34  14.460   4.055  -3.156
  271    HA   LYS  34           HA       LYS  34  13.679   4.686  -5.960
  272   1HB   LYS  34          HB2       LYS  34  12.549   2.448  -6.079
  273   2HB   LYS  34          HB1       LYS  34  14.304   2.322  -5.945
  274   1HG   LYS  34          HG2       LYS  34  14.132   1.898  -3.549
  275   2HG   LYS  34          HG1       LYS  34  12.385   2.137  -3.603
  276   1HD   LYS  34          HD2       LYS  34  12.645  -0.214  -3.676
  277   2HD   LYS  34          HD1       LYS  34  12.372   0.240  -5.358
  278   1HE   LYS  34          HE2       LYS  34  14.969   0.407  -5.510
  279   2HE   LYS  34          HE1       LYS  34  14.955  -0.571  -4.029
  280   1HZ   LYS  34          HZ1       LYS  34  13.316  -1.270  -6.394
  281   2HZ   LYS  34          HZ2       LYS  34  13.721  -2.252  -5.068
  282   3HZ   LYS  34          HZ3       LYS  34  14.905  -1.835  -6.213
  283    H    ALA  35           HN       ALA  35  11.327   4.954  -6.162
  284    HA   ALA  35           HA       ALA  35  10.030   5.577  -3.534
  285   1HB   ALA  35          HB1       ALA  35   9.256   6.559  -6.290
  286   2HB   ALA  35          HB2       ALA  35  10.507   7.350  -5.330
  287   3HB   ALA  35          HB3       ALA  35   8.849   7.275  -4.731
  288    H    GLY  36           HN       GLY  36   7.773   5.007  -3.298
  289   1HA   GLY  36          HA2       GLY  36   6.211   3.621  -5.214
  290   2HA   GLY  36          HA1       GLY  36   7.064   2.412  -4.248
  291    H    VAL  37           HN       VAL  37   4.796   1.830  -3.493
  292    HA   VAL  37           HA       VAL  37   3.807   3.808  -1.461
  293    HB   VAL  37           HB       VAL  37   2.409   1.431  -2.716
  294   1HG1  VAL  37          HG1       VAL  37   0.390   2.812  -1.949
  295   2HG1  VAL  37          HG1       VAL  37   1.534   3.775  -1.016
  296   3HG1  VAL  37          HG1       VAL  37   1.344   2.057  -0.671
  297   1HG2  VAL  37          HG2       VAL  37   3.064   4.018  -3.823
  298   2HG2  VAL  37          HG2       VAL  37   1.316   3.874  -3.634
  299   3HG2  VAL  37          HG2       VAL  37   2.203   2.681  -4.583
  300    H    ILE  38           HN       ILE  38   2.789   2.656   0.493
  301    HA   ILE  38           HA       ILE  38   4.426   0.255   1.246
  302    HB   ILE  38           HB       ILE  38   3.578   2.713   2.810
  303   1HG1  ILE  38          HG1       ILE  38   6.230   2.467   3.190
  304   2HG1  ILE  38          HG1       ILE  38   6.107   1.659   1.627
  305   1HG2  ILE  38          HG2       ILE  38   4.847   1.609   4.702
  306   2HG2  ILE  38          HG2       ILE  38   4.832   0.121   3.756
  307   3HG2  ILE  38          HG2       ILE  38   3.313   0.836   4.300
  308   1HD1  ILE  38          HD1       ILE  38   6.513   4.029   1.255
  309   2HD1  ILE  38          HD1       ILE  38   5.152   4.462   2.287
  310   3HD1  ILE  38          HD1       ILE  38   4.869   3.653   0.748
  311    H    PHE  39           HN       PHE  39   3.074  -1.500   1.567
  312    HA   PHE  39           HA       PHE  39   0.246  -0.909   2.340
  313   1HB   PHE  39          HB2       PHE  39   1.597  -2.991   0.657
  314   2HB   PHE  39          HB1       PHE  39   0.024  -3.338   1.371
  315    HD1  PHE  39           HD1      PHE  39  -1.922  -2.589   0.318
  316    HD2  PHE  39           HD2      PHE  39   1.825  -0.712  -0.599
  317    HE1  PHE  39           HE1      PHE  39  -3.028  -1.237  -1.432
  318    HE2  PHE  39           HE2      PHE  39   0.713   0.640  -2.354
  319    HZ   PHE  39           HZ       PHE  39  -1.713   0.376  -2.775
  320    H    THR  40           HN       THR  40  -0.661  -1.954   4.082
  321    HA   THR  40           HA       THR  40   1.183  -3.569   5.780
  322    HB   THR  40           HB       THR  40  -1.162  -1.740   6.365
  323    HG1  THR  40           HG1      THR  40   0.410  -0.522   7.355
  324   1HG2  THR  40          HG2       THR  40  -0.013  -2.378   8.795
  325   2HG2  THR  40          HG2       THR  40  -0.014  -3.926   7.948
  326   3HG2  THR  40          HG2       THR  40  -1.526  -3.046   8.177
  327    H    THR  41           HN       THR  41   0.366  -5.519   6.652
  328    HA   THR  41           HA       THR  41  -2.046  -6.602   5.303
  329    HB   THR  41           HB       THR  41  -0.068  -8.103   7.007
  330    HG1  THR  41           HG1      THR  41   1.415  -7.543   5.651
  331   1HG2  THR  41          HG2       THR  41  -1.251  -9.848   6.242
  332   2HG2  THR  41          HG2       THR  41  -0.803  -9.414   4.592
  333   3HG2  THR  41          HG2       THR  41  -2.275  -8.758   5.307
  334    H    LYS  42           HN       LYS  42  -3.745  -7.545   6.577
  335    HA   LYS  42           HA       LYS  42  -4.455  -6.296   9.005
  336   1HB   LYS  42          HB2       LYS  42  -6.065  -8.201   9.161
  337   2HB   LYS  42          HB1       LYS  42  -5.994  -7.515   7.537
  338   1HG   LYS  42          HG2       LYS  42  -4.913  -9.357   6.655
  339   2HG   LYS  42          HG1       LYS  42  -4.138  -9.766   8.184
  340   1HD   LYS  42          HD2       LYS  42  -6.788 -10.066   8.818
  341   2HD   LYS  42          HD1       LYS  42  -6.765 -10.589   7.134
  342   1HE   LYS  42          HE2       LYS  42  -6.151 -12.600   8.081
  343   2HE   LYS  42          HE1       LYS  42  -4.538 -11.860   8.068
  344   1HZ   LYS  42          HZ1       LYS  42  -4.793 -11.108  10.260
  345   2HZ   LYS  42          HZ2       LYS  42  -5.369 -12.706  10.295
  346   3HZ   LYS  42          HZ3       LYS  42  -6.462 -11.405  10.272
  347    H    LYS  43           HN       LYS  43  -2.247  -8.930   8.424
  348    HA   LYS  43           HA       LYS  43  -2.288 -10.133  11.042
  349   1HB   LYS  43          HB2       LYS  43  -0.313  -9.974   8.755
  350   2HB   LYS  43          HB1       LYS  43   0.019 -10.916  10.209
  351   1HG   LYS  43          HG2       LYS  43  -2.654 -11.450   9.188
  352   2HG   LYS  43          HG1       LYS  43  -1.421 -11.778   7.969
  353   1HD   LYS  43          HD2       LYS  43  -0.721 -13.621   9.061
  354   2HD   LYS  43          HD1       LYS  43  -0.588 -12.739  10.582
  355   1HE   LYS  43          HE2       LYS  43  -2.662 -13.413  11.302
  356   2HE   LYS  43          HE1       LYS  43  -3.357 -13.350   9.670
  357   1HZ   LYS  43          HZ1       LYS  43  -1.997 -15.299   9.095
  358   2HZ   LYS  43          HZ2       LYS  43  -3.108 -15.639  10.336
  359   3HZ   LYS  43          HZ3       LYS  43  -1.467 -15.397  10.703
  360    H    GLY  44           HN       GLY  44  -0.884  -7.203   9.793
  361   1HA   GLY  44          HA2       GLY  44  -0.223  -5.508  11.486
  362   2HA   GLY  44          HA1       GLY  44   0.521  -6.822  12.390
  363    H    GLN  45           HN       GLN  45   1.114  -7.409   9.156
  364    HA   GLN  45           HA       GLN  45   3.929  -6.663   9.426
  365   1HB   GLN  45          HB2       GLN  45   2.237  -8.394   7.872
  366   2HB   GLN  45          HB1       GLN  45   3.233  -7.436   6.775
  367   1HG   GLN  45          HG2       GLN  45   5.204  -8.351   7.542
  368   2HG   GLN  45          HG1       GLN  45   4.572  -8.612   9.168
  369   1HE2  GLN  45          HE2       GLN  45   3.877  -9.781   5.814
  370   2HE2  GLN  45          HE2       GLN  45   3.628 -11.394   6.278
  371    H    GLN  46           HN       GLN  46   4.916  -5.520   7.372
  372    HA   GLN  46           HA       GLN  46   3.189  -3.500   6.115
  373   1HB   GLN  46          HB2       GLN  46   4.340  -3.014   8.628
  374   2HB   GLN  46          HB1       GLN  46   5.380  -2.159   7.488
  375   1HG   GLN  46          HG2       GLN  46   2.919  -1.510   6.509
  376   2HG   GLN  46          HG1       GLN  46   2.567  -1.628   8.235
  377   1HE2  GLN  46          HE2       GLN  46   2.746   0.405   9.180
  378   2HE2  GLN  46          HE2       GLN  46   3.934   1.558   8.801
  379    H    SER  47           HN       SER  47   3.998  -4.089   4.080
  380    HA   SER  47           HA       SER  47   6.971  -3.935   3.709
  381   1HB   SER  47          HB2       SER  47   4.909  -5.271   1.940
  382   2HB   SER  47          HB1       SER  47   6.652  -5.528   1.940
  383    HG   SER  47           HG       SER  47   4.685  -6.478   3.661
  384    H    CYS  48           HN       CYS  48   7.392  -3.344   1.225
  385    HA   CYS  48           HA       CYS  48   5.935  -0.791   0.750
  386   1HB   CYS  48          HB2       CYS  48   8.506  -1.118   0.990
  387   2HB   CYS  48          HB1       CYS  48   8.420  -1.756  -0.652
  388    H    GLY  49           HN       GLY  49   4.392  -0.783  -0.841
  389   1HA   GLY  49          HA2       GLY  49   4.317  -3.010  -2.772
  390   2HA   GLY  49          HA1       GLY  49   3.068  -1.787  -2.571
  391    H    ASP  50           HN       ASP  50   4.728  -2.754  -4.937
  392    HA   ASP  50           HA       ASP  50   6.187  -0.310  -5.711
  393   1HB   ASP  50          HB2       ASP  50   6.989  -2.642  -6.139
  394   2HB   ASP  50          HB1       ASP  50   5.614  -2.883  -7.216
  395    HA   PRO  51           HA       PRO  51   2.480   1.316  -7.583
  396   1HB   PRO  51          HB2       PRO  51   3.652   3.416  -8.904
  397   2HB   PRO  51          HB1       PRO  51   3.310   3.433  -7.163
  398   1HG   PRO  51          HG2       PRO  51   5.874   2.894  -8.580
  399   2HG   PRO  51          HG1       PRO  51   5.577   3.815  -7.097
  400   1HD   PRO  51          HD2       PRO  51   6.543   1.281  -7.082
  401   2HD   PRO  51          HD1       PRO  51   5.523   1.929  -5.780
  402    H    LYS  52           HN       LYS  52   5.364   0.320  -9.266
  403    HA   LYS  52           HA       LYS  52   4.363   0.567 -11.969
  404   1HB   LYS  52          HB2       LYS  52   6.466  -1.208 -10.679
  405   2HB   LYS  52          HB1       LYS  52   6.290  -0.960 -12.417
  406   1HG   LYS  52          HG2       LYS  52   6.436   1.590 -11.770
  407   2HG   LYS  52          HG1       LYS  52   7.213   0.972 -10.314
  408   1HD   LYS  52          HD2       LYS  52   9.048   1.240 -11.721
  409   2HD   LYS  52          HD1       LYS  52   8.628  -0.445 -12.025
  410   1HE   LYS  52          HE2       LYS  52   8.243   0.020 -14.207
  411   2HE   LYS  52          HE1       LYS  52   7.063   1.268 -13.754
  412   1HZ   LYS  52          HZ1       LYS  52   9.056   2.677 -13.166
  413   2HZ   LYS  52          HZ2       LYS  52   8.801   2.412 -14.825
  414   3HZ   LYS  52          HZ3       LYS  52  10.004   1.542 -13.998
  415    H    GLN  53           HN       GLN  53   3.988  -1.776  -9.395
  416    HA   GLN  53           HA       GLN  53   3.035  -3.959 -11.075
  417   1HB   GLN  53          HB2       GLN  53   2.766  -3.366  -8.107
  418   2HB   GLN  53          HB1       GLN  53   2.465  -4.930  -8.867
  419   1HG   GLN  53          HG2       GLN  53   5.113  -3.484  -9.102
  420   2HG   GLN  53          HG1       GLN  53   4.773  -4.650  -7.821
  421   1HE2  GLN  53          HE2       GLN  53   5.391  -6.749  -8.335
  422   2HE2  GLN  53          HE2       GLN  53   5.492  -7.382  -9.907
  423    H    GLU  54           HN       GLU  54   0.751  -4.760 -10.914
  424    HA   GLU  54           HA       GLU  54  -1.132  -2.493 -11.149
  425   1HB   GLU  54          HB2       GLU  54  -0.701  -4.762 -12.570
  426   2HB   GLU  54          HB1       GLU  54  -1.999  -5.310 -11.507
  427   1HG   GLU  54          HG2       GLU  54  -2.250  -2.659 -12.897
  428   2HG   GLU  54          HG1       GLU  54  -2.598  -4.143 -13.786
  429    H    TRP  55           HN       TRP  55  -0.282  -4.807  -8.700
  430    HA   TRP  55           HA       TRP  55  -2.967  -4.937  -7.536
  431   1HB   TRP  55          HB2       TRP  55  -1.852  -6.215  -5.806
  432   2HB   TRP  55          HB1       TRP  55  -1.243  -6.731  -7.371
  433    HD1  TRP  55           HD1      TRP  55   1.260  -6.178  -7.970
  434    HE1  TRP  55           HE1      TRP  55   3.268  -5.467  -6.510
  435    HE3  TRP  55           HE3      TRP  55  -1.176  -4.755  -3.710
  436    HZ2  TRP  55           HZ2      TRP  55   3.772  -4.461  -3.922
  437    HZ3  TRP  55           HZ3      TRP  55   0.105  -3.918  -1.758
  438    HH2  TRP  55           HH2      TRP  55   2.581  -3.765  -1.859
  439    H    VAL  56           HN       VAL  56   0.002  -3.013  -6.918
  440    HA   VAL  56           HA       VAL  56  -1.042  -1.726  -4.545
  441    HB   VAL  56           HB       VAL  56   0.890  -0.672  -6.657
  442   1HG1  VAL  56          HG1       VAL  56   0.715   1.197  -5.381
  443   2HG1  VAL  56          HG1       VAL  56   1.599   0.293  -4.150
  444   3HG1  VAL  56          HG1       VAL  56  -0.161   0.336  -4.120
  445   1HG2  VAL  56          HG2       VAL  56   2.102  -2.488  -5.935
  446   2HG2  VAL  56          HG2       VAL  56   1.173  -2.643  -4.442
  447   3HG2  VAL  56          HG2       VAL  56   2.444  -1.427  -4.571
  448    H    GLN  57           HN       GLN  57  -1.157  -1.067  -8.018
  449    HA   GLN  57           HA       GLN  57  -2.668   1.398  -7.844
  450   1HB   GLN  57          HB2       GLN  57  -1.292  -0.118  -9.749
  451   2HB   GLN  57          HB1       GLN  57  -2.974  -0.221 -10.270
  452   1HG   GLN  57          HG2       GLN  57  -2.280   2.479  -9.426
  453   2HG   GLN  57          HG1       GLN  57  -1.235   1.916 -10.731
  454   1HE2  GLN  57          HE2       GLN  57  -3.437   3.945 -10.888
  455   2HE2  GLN  57          HE2       GLN  57  -4.524   3.351 -12.051
  456    H    ARG  58           HN       ARG  58  -3.522  -1.983  -8.639
  457    HA   ARG  58           HA       ARG  58  -6.329  -1.665  -8.922
  458   1HB   ARG  58          HB2       ARG  58  -5.149  -3.693  -9.546
  459   2HB   ARG  58          HB1       ARG  58  -4.566  -3.915  -7.898
  460   1HG   ARG  58          HG2       ARG  58  -7.401  -3.714  -7.771
  461   2HG   ARG  58          HG1       ARG  58  -7.009  -4.855  -9.055
  462   1HD   ARG  58          HD2       ARG  58  -5.310  -5.270  -6.720
  463   2HD   ARG  58          HD1       ARG  58  -7.032  -5.432  -6.322
  464    HE   ARG  58           HE       ARG  58  -7.064  -7.383  -7.644
  465   1HH1  ARG  58          HH2       ARG  58  -3.909  -6.819  -7.535
  466   2HH1  ARG  58          HH2       ARG  58  -3.526  -7.221  -9.175
  467   1HH2  ARG  58          HH1       ARG  58  -6.831  -7.244 -10.222
  468   2HH2  ARG  58          HH1       ARG  58  -5.179  -7.460 -10.697
  469    H    TYR  59           HN       TYR  59  -4.253  -1.912  -6.102
  470    HA   TYR  59           HA       TYR  59  -6.399  -2.232  -4.158
  471   1HB   TYR  59          HB2       TYR  59  -3.452  -1.572  -4.129
  472   2HB   TYR  59          HB1       TYR  59  -4.403  -1.546  -2.652
  473    HD1  TYR  59           HD1      TYR  59  -2.783  -3.330  -1.868
  474    HD2  TYR  59           HD2      TYR  59  -5.512  -3.976  -5.127
  475    HE1  TYR  59           HE1      TYR  59  -2.501  -5.778  -1.611
  476    HE2  TYR  59           HE2      TYR  59  -5.226  -6.428  -4.862
  477    HH   TYR  59           HH       TYR  59  -3.216  -7.943  -3.835
  478    H    MET  60           HN       MET  60  -4.109   0.429  -4.820
  479    HA   MET  60           HA       MET  60  -5.216   2.463  -3.279
  480   1HB   MET  60          HB2       MET  60  -3.352   2.144  -5.356
  481   2HB   MET  60          HB1       MET  60  -4.434   3.430  -5.870
  482   1HG   MET  60          HG2       MET  60  -3.887   4.806  -4.078
  483   2HG   MET  60          HG1       MET  60  -3.417   3.447  -3.061
  484   1HE   MET  60          HE1       MET  60  -0.011   2.474  -3.906
  485   2HE   MET  60          HE2       MET  60  -1.507   1.700  -4.419
  486   3HE   MET  60          HE3       MET  60  -1.409   2.443  -2.825
  487    H    LYS  61           HN       LYS  61  -6.293   1.321  -6.463
  488    HA   LYS  61           HA       LYS  61  -8.177   3.360  -7.069
  489   1HB   LYS  61          HB2       LYS  61  -7.342   1.508  -8.547
  490   2HB   LYS  61          HB1       LYS  61  -8.336   0.379  -7.624
  491   1HG   LYS  61          HG2       LYS  61  -9.769   0.899  -9.384
  492   2HG   LYS  61          HG1       LYS  61 -10.267   2.084  -8.176
  493   1HD   LYS  61          HD2       LYS  61  -9.972   3.477 -10.005
  494   2HD   LYS  61          HD1       LYS  61  -8.354   3.538  -9.306
  495   1HE   LYS  61          HE2       LYS  61  -8.601   1.238 -11.057
  496   2HE   LYS  61          HE1       LYS  61  -9.002   2.735 -11.922
  497   1HZ   LYS  61          HZ1       LYS  61  -6.600   2.296 -10.226
  498   2HZ   LYS  61          HZ2       LYS  61  -7.002   3.753 -11.003
  499   3HZ   LYS  61          HZ3       LYS  61  -6.612   2.377 -11.920
  500    H    ASN  62           HN       ASN  62  -8.580   0.315  -5.234
  501    HA   ASN  62           HA       ASN  62 -11.380   0.871  -4.606
  502   1HB   ASN  62          HB2       ASN  62 -10.014  -1.368  -4.844
  503   2HB   ASN  62          HB1       ASN  62  -9.598  -1.072  -3.155
  504   1HD2  ASN  62          HD2       ASN  62 -11.161  -1.621  -1.594
  505   2HD2  ASN  62          HD2       ASN  62 -12.754  -2.081  -1.960
  506    H    LEU  63           HN       LEU  63  -8.249   1.166  -2.966
  507    HA   LEU  63           HA       LEU  63  -9.213   1.820  -0.355
  508   1HB   LEU  63          HB2       LEU  63  -6.721   2.150  -1.977
  509   2HB   LEU  63          HB1       LEU  63  -6.842   3.052  -0.462
  510    HG   LEU  63           HG       LEU  63  -7.700   0.246  -0.263
  511   1HD1  LEU  63          HD1       LEU  63  -4.914   0.025  -0.076
  512   2HD1  LEU  63          HD1       LEU  63  -5.193   0.906  -1.579
  513   3HD1  LEU  63          HD1       LEU  63  -5.941  -0.673  -1.331
  514   1HD2  LEU  63          HD2       LEU  63  -5.509   1.517   1.332
  515   2HD2  LEU  63          HD2       LEU  63  -6.804   0.450   1.867
  516   3HD2  LEU  63          HD2       LEU  63  -7.146   2.143   1.515
  517    H    ASP  64           HN       ASP  64  -8.713   3.754  -3.264
  518    HA   ASP  64           HA       ASP  64  -8.993   6.343  -1.996
  519   1HB   ASP  64          HB2       ASP  64  -8.793   5.143  -4.685
  520   2HB   ASP  64          HB1       ASP  64  -9.699   6.656  -4.632
  521    H    ALA  65           HN       ALA  65 -11.250   3.889  -2.983
  522    HA   ALA  65           HA       ALA  65 -13.541   5.712  -3.231
  523   1HB   ALA  65          HB1       ALA  65 -14.560   3.840  -4.088
  524   2HB   ALA  65          HB2       ALA  65 -13.874   2.782  -2.856
  525   3HB   ALA  65          HB3       ALA  65 -12.894   3.280  -4.234
  526    H    LYS  66           HN       LYS  66 -11.828   4.563  -0.585
  527    HA   LYS  66           HA       LYS  66 -14.278   4.411   1.130
  528   1HB   LYS  66          HB2       LYS  66 -12.709   2.453   0.999
  529   2HB   LYS  66          HB1       LYS  66 -11.438   3.484   1.656
  530   1HG   LYS  66          HG2       LYS  66 -12.451   2.207   3.472
  531   2HG   LYS  66          HG1       LYS  66 -12.871   3.910   3.655
  532   1HD   LYS  66          HD2       LYS  66 -15.079   3.515   3.334
  533   2HD   LYS  66          HD1       LYS  66 -14.771   2.422   1.983
  534   1HE   LYS  66          HE2       LYS  66 -13.854   1.181   4.420
  535   2HE   LYS  66          HE1       LYS  66 -15.541   1.696   4.613
  536   1HZ   LYS  66          HZ1       LYS  66 -16.084   0.668   2.513
  537   2HZ   LYS  66          HZ2       LYS  66 -15.368  -0.487   3.533
  538   3HZ   LYS  66          HZ3       LYS  66 -14.469   0.213   2.271
  539    H    GLN  67           HN       GLN  67 -11.252   6.102   0.578
  540    HA   GLN  67           HA       GLN  67 -11.662   7.723   3.054
  541   1HB   GLN  67          HB2       GLN  67  -9.466   6.480   2.093
  542   2HB   GLN  67          HB1       GLN  67  -9.284   8.038   1.288
  543   1HG   GLN  67          HG2       GLN  67  -9.826   7.797   4.254
  544   2HG   GLN  67          HG1       GLN  67  -8.193   7.847   3.589
  545   1HE2  GLN  67          HE2       GLN  67  -9.940   9.885   5.206
  546   2HE2  GLN  67          HE2       GLN  67  -9.752  11.327   4.332
  547    H    LYS  68           HN       LYS  68 -10.618   8.291  -0.336
  548    HA   LYS  68           HA       LYS  68 -11.661  11.062  -0.181
  549   1HB   LYS  68          HB2       LYS  68  -9.481   9.823  -1.341
  550   2HB   LYS  68          HB1       LYS  68 -10.564  10.047  -2.716
  551   1HG   LYS  68          HG2       LYS  68  -9.382  12.076  -2.663
  552   2HG   LYS  68          HG1       LYS  68 -10.857  12.466  -1.780
  553   1HD   LYS  68          HD2       LYS  68  -9.359  11.552   0.267
  554   2HD   LYS  68          HD1       LYS  68  -8.074  12.164  -0.776
  555   1HE   LYS  68          HE2       LYS  68 -10.447  13.937  -0.423
  556   2HE   LYS  68          HE1       LYS  68  -9.358  13.765   0.968
  557   1HZ   LYS  68          HZ1       LYS  68  -7.495  14.325  -0.375
  558   2HZ   LYS  68          HZ2       LYS  68  -8.674  15.518  -0.648
  559   3HZ   LYS  68          HZ3       LYS  68  -8.419  14.291  -1.798
  560    H    LYS  69           HN       LYS  69 -13.194  11.857  -1.781
  561    HA   LYS  69           HA       LYS  69 -14.944   9.701  -2.919
  562   1HB   LYS  69          HB2       LYS  69 -15.456  11.672  -1.021
  563   2HB   LYS  69          HB1       LYS  69 -16.122  12.350  -2.508
  564   1HG   LYS  69          HG2       LYS  69 -17.937  11.063  -2.094
  565   2HG   LYS  69          HG1       LYS  69 -16.936   9.708  -2.621
  566   1HD   LYS  69          HD2       LYS  69 -16.787   8.875  -0.526
  567   2HD   LYS  69          HD1       LYS  69 -16.425  10.460   0.159
  568   1HE   LYS  69          HE2       LYS  69 -18.778  11.040   0.241
  569   2HE   LYS  69          HE1       LYS  69 -19.216   9.569  -0.653
  570   1HZ   LYS  69          HZ1       LYS  69 -17.952   8.357   1.178
  571   2HZ   LYS  69          HZ2       LYS  69 -19.481   8.979   1.577
  572   3HZ   LYS  69          HZ3       LYS  69 -18.074   9.795   2.067
  573    H    ALA  70           HN       ALA  70 -12.806  10.565  -4.493
  574    HA   ALA  70           HA       ALA  70 -13.790  12.721  -6.273
  575   1HB   ALA  70          HB1       ALA  70 -11.287  11.483  -5.508
  576   2HB   ALA  70          HB2       ALA  70 -11.551  13.009  -6.355
  577   3HB   ALA  70          HB3       ALA  70 -11.440  11.503  -7.265
  578    H    SER  71           HN       SER  71 -15.594  10.677  -6.436
  579    HA   SER  71           HA       SER  71 -15.317   9.796  -9.213
  580   1HB   SER  71          HB2       SER  71 -13.912   8.188  -7.948
  581   2HB   SER  71          HB1       SER  71 -15.296   7.792  -6.932
  582    HG   SER  71           HG       SER  71 -14.639   6.727  -9.238
  583    HA   PRO  72           HA       PRO  72 -19.598  10.224  -7.367
  584   1HB   PRO  72          HB2       PRO  72 -20.477  12.202  -9.028
  585   2HB   PRO  72          HB1       PRO  72 -19.652  12.525  -7.489
  586   1HG   PRO  72          HG2       PRO  72 -18.579  12.581 -10.258
  587   2HG   PRO  72          HG1       PRO  72 -18.237  13.652  -8.892
  588   1HD   PRO  72          HD2       PRO  72 -16.562  11.659  -9.695
  589   2HD   PRO  72          HD1       PRO  72 -16.651  12.251  -8.022
  590    H    ARG  73           HN       ARG  73 -19.992   8.134  -8.349
  591    HA   ARG  73           HA       ARG  73 -21.360   8.314 -10.981
  592   1HB   ARG  73          HB2       ARG  73 -19.997   6.419 -11.823
  593   2HB   ARG  73          HB1       ARG  73 -18.983   7.809 -11.430
  594   1HG   ARG  73          HG2       ARG  73 -17.860   6.636  -9.870
  595   2HG   ARG  73          HG1       ARG  73 -19.363   6.127  -9.098
  596   1HD   ARG  73          HD2       ARG  73 -18.691   4.044  -9.816
  597   2HD   ARG  73          HD1       ARG  73 -19.403   4.577 -11.353
  598    HE   ARG  73           HE       ARG  73 -16.850   5.646 -11.412
  599   1HH1  ARG  73          HH1       ARG  73 -17.614   3.534 -13.341
  600   2HH1  ARG  73          HH1       ARG  73 -16.525   2.245 -12.949
  601   1HH2  ARG  73          HH2       ARG  73 -15.685   3.544  -9.845
  602   2HH2  ARG  73          HH2       ARG  73 -15.432   2.251 -10.970
  Start of MODEL   13
    1   1H    VAL   1          HT1       VAL   1  -5.520  11.213   7.821
    2   2H    VAL   1          HT2       VAL   1  -3.911  10.760   7.516
    3   3H    VAL   1          HT3       VAL   1  -5.146  10.291   6.449
    4    HA   VAL   1           HA       VAL   1  -5.518  12.569   5.778
    5    HB   VAL   1           HB       VAL   1  -4.027  14.299   6.815
    6   1HG1  VAL   1          HG1       VAL   1  -5.165  13.289   9.265
    7   2HG1  VAL   1          HG1       VAL   1  -6.280  13.012   7.927
    8   3HG1  VAL   1          HG1       VAL   1  -5.704  14.643   8.270
    9   1HG2  VAL   1          HG2       VAL   1  -3.360  12.372   9.001
   10   2HG2  VAL   1          HG2       VAL   1  -2.477  13.798   8.456
   11   3HG2  VAL   1          HG2       VAL   1  -2.401  12.303   7.523
   12    H    VAL   2           HN       VAL   2  -3.167  14.066   5.125
   13    HA   VAL   2           HA       VAL   2  -2.062  12.438   3.009
   14    HB   VAL   2           HB       VAL   2  -0.653  14.482   2.691
   15   1HG1  VAL   2          HG1       VAL   2  -2.932  16.030   2.977
   16   2HG1  VAL   2          HG1       VAL   2  -3.579  14.394   2.858
   17   3HG1  VAL   2          HG1       VAL   2  -2.546  15.030   1.577
   18   1HG2  VAL   2          HG2       VAL   2  -1.240  14.790   5.477
   19   2HG2  VAL   2          HG2       VAL   2  -1.898  16.182   4.618
   20   3HG2  VAL   2          HG2       VAL   2  -0.189  15.783   4.470
   21    H    ILE   3           HN       ILE   3  -0.864  10.721   3.645
   22    HA   ILE   3           HA       ILE   3   0.931  10.650   5.901
   23    HB   ILE   3           HB       ILE   3  -0.096   8.657   4.980
   24   1HG1  ILE   3          HG1       ILE   3   2.866   8.700   4.311
   25   2HG1  ILE   3          HG1       ILE   3   2.170   8.343   5.893
   26   1HG2  ILE   3          HG2       ILE   3   1.280   8.325   2.498
   27   2HG2  ILE   3          HG2       ILE   3   0.528   9.921   2.490
   28   3HG2  ILE   3          HG2       ILE   3  -0.456   8.485   2.767
   29   1HD1  ILE   3          HD1       ILE   3   0.791   6.600   4.309
   30   2HD1  ILE   3          HD1       ILE   3   2.259   6.184   5.192
   31   3HD1  ILE   3          HD1       ILE   3   2.351   6.638   3.490
   32    HA   PRO   4           HA       PRO   4   4.375  12.690   3.982
   33   1HB   PRO   4          HB2       PRO   4   6.336  11.900   5.720
   34   2HB   PRO   4          HB1       PRO   4   5.136  13.142   6.120
   35   1HG   PRO   4          HG2       PRO   4   5.253  10.291   6.933
   36   2HG   PRO   4          HG1       PRO   4   4.701  11.705   7.843
   37   1HD   PRO   4          HD2       PRO   4   3.034   9.888   6.636
   38   2HD   PRO   4          HD1       PRO   4   2.585  11.563   7.015
   39    H    SER   5           HN       SER   5   7.006  11.684   3.922
   40    HA   SER   5           HA       SER   5   6.656   9.184   2.304
   41   1HB   SER   5          HB2       SER   5   8.450  11.602   2.068
   42   2HB   SER   5          HB1       SER   5   8.763  10.121   1.168
   43    HG   SER   5           HG       SER   5   7.096  12.065   0.560
   44    HA   PRO   6           HA       PRO   6   9.462   8.256   5.901
   45   1HB   PRO   6          HB2       PRO   6   8.275   5.890   6.578
   46   2HB   PRO   6          HB1       PRO   6   7.754   7.458   7.230
   47   1HG   PRO   6          HG2       PRO   6   6.584   5.842   5.025
   48   2HG   PRO   6          HG1       PRO   6   5.775   6.769   6.299
   49   1HD   PRO   6          HD2       PRO   6   6.034   7.673   3.751
   50   2HD   PRO   6          HD1       PRO   6   5.967   8.753   5.162
   51    H    CYS   7           HN       CYS   7   8.279   6.500   3.120
   52    HA   CYS   7           HA       CYS   7   9.332   4.942   1.691
   53   1HB   CYS   7          HB2       CYS   7  10.957   6.929   1.905
   54   2HB   CYS   7          HB1       CYS   7  11.872   5.909   3.016
   55    H    CYS   8           HN       CYS   8  10.712   2.930   1.717
   56    HA   CYS   8           HA       CYS   8  10.825   1.720   4.461
   57   1HB   CYS   8          HB2       CYS   8  10.144  -0.378   3.319
   58   2HB   CYS   8          HB1       CYS   8   8.967   0.903   3.049
   59    H    MET   9           HN       MET   9  12.010  -0.734   3.153
   60    HA   MET   9           HA       MET   9  14.757   0.377   2.677
   61   1HB   MET   9          HB2       MET   9  14.444  -0.812   4.814
   62   2HB   MET   9          HB1       MET   9  13.836  -2.222   3.947
   63   1HG   MET   9          HG2       MET   9  15.960  -2.952   3.783
   64   2HG   MET   9          HG1       MET   9  16.280  -1.595   2.705
   65   1HE   MET   9          HE1       MET   9  16.803  -3.473   5.453
   66   2HE   MET   9          HE2       MET   9  17.039  -2.510   6.907
   67   3HE   MET   9          HE3       MET   9  18.412  -2.864   5.862
   68    H    PHE  10           HN       PHE  10  12.670  -2.451   1.933
   69    HA   PHE  10           HA       PHE  10  14.091  -2.647  -0.705
   70   1HB   PHE  10          HB2       PHE  10  13.915  -5.078  -0.448
   71   2HB   PHE  10          HB1       PHE  10  14.699  -4.395   0.976
   72    HD1  PHE  10           HD1      PHE  10  13.422  -4.117   3.101
   73    HD2  PHE  10           HD2      PHE  10  11.743  -6.114  -0.312
   74    HE1  PHE  10           HE1      PHE  10  11.654  -5.092   4.540
   75    HE2  PHE  10           HE2      PHE  10   9.975  -7.090   1.127
   76    HZ   PHE  10           HZ       PHE  10   9.930  -6.578   3.554
   77    H    PHE  11           HN       PHE  11  12.616  -4.317  -2.103
   78    HA   PHE  11           HA       PHE  11   9.852  -3.159  -2.072
   79   1HB   PHE  11          HB2       PHE  11  11.895  -3.568  -4.074
   80   2HB   PHE  11          HB1       PHE  11  10.447  -4.473  -4.521
   81    HD1  PHE  11           HD1      PHE  11   8.279  -2.851  -3.432
   82    HD2  PHE  11           HD2      PHE  11  11.900  -1.623  -5.386
   83    HE1  PHE  11           HE1      PHE  11   7.180  -0.751  -4.150
   84    HE2  PHE  11           HE2      PHE  11  10.799   0.479  -6.103
   85    HZ   PHE  11           HZ       PHE  11   8.438   0.917  -5.485
   86    H    VAL  12           HN       VAL  12   8.090  -4.606  -2.169
   87    HA   VAL  12           HA       VAL  12   8.259  -7.140  -0.968
   88    HB   VAL  12           HB       VAL  12   6.006  -7.462  -2.128
   89   1HG1  VAL  12          HG1       VAL  12   5.613  -6.484  -0.107
   90   2HG1  VAL  12          HG1       VAL  12   5.240  -5.073  -1.097
   91   3HG1  VAL  12          HG1       VAL  12   6.835  -5.236  -0.362
   92   1HG2  VAL  12          HG2       VAL  12   5.555  -6.236  -3.966
   93   2HG2  VAL  12          HG2       VAL  12   7.121  -5.441  -3.822
   94   3HG2  VAL  12          HG2       VAL  12   5.708  -4.759  -3.017
   95    H    SER  13           HN       SER  13   8.727  -9.196  -1.735
   96    HA   SER  13           HA       SER  13  10.128  -9.595  -4.185
   97   1HB   SER  13          HB2       SER  13   9.138 -11.099  -1.918
   98   2HB   SER  13          HB1       SER  13   8.872 -12.012  -3.399
   99    HG   SER  13           HG       SER  13  10.926 -12.472  -2.741
  100    H    LYS  14           HN       LYS  14   6.726  -9.473  -3.429
  101    HA   LYS  14           HA       LYS  14   6.026  -9.591  -6.272
  102   1HB   LYS  14          HB2       LYS  14   4.527 -11.565  -5.932
  103   2HB   LYS  14          HB1       LYS  14   6.228 -11.964  -5.694
  104   1HG   LYS  14          HG2       LYS  14   5.319 -11.089  -3.181
  105   2HG   LYS  14          HG1       LYS  14   4.038 -12.128  -3.804
  106   1HD   LYS  14          HD2       LYS  14   6.094 -13.679  -4.466
  107   2HD   LYS  14          HD1       LYS  14   6.877 -12.806  -3.148
  108   1HE   LYS  14          HE2       LYS  14   4.141 -13.729  -2.518
  109   2HE   LYS  14          HE1       LYS  14   5.318 -15.031  -2.778
  110   1HZ   LYS  14          HZ1       LYS  14   5.252 -14.061  -0.462
  111   2HZ   LYS  14          HZ2       LYS  14   5.918 -12.647  -1.125
  112   3HZ   LYS  14          HZ3       LYS  14   6.777 -14.110  -1.201
  113    H    ARG  15           HN       ARG  15   3.278 -10.025  -5.975
  114    HA   ARG  15           HA       ARG  15   2.437  -7.503  -4.764
  115   1HB   ARG  15          HB2       ARG  15   0.251  -8.203  -5.680
  116   2HB   ARG  15          HB1       ARG  15   1.530  -8.437  -6.871
  117   1HG   ARG  15          HG2       ARG  15   1.244 -10.773  -5.169
  118   2HG   ARG  15          HG1       ARG  15  -0.274 -10.379  -5.976
  119   1HD   ARG  15          HD2       ARG  15   1.625 -10.033  -7.985
  120   2HD   ARG  15          HD1       ARG  15   2.182 -11.478  -7.119
  121    HE   ARG  15           HE       ARG  15  -0.711 -11.392  -7.648
  122   1HH1  ARG  15          HH1       ARG  15   1.843 -11.618  -9.742
  123   2HH1  ARG  15          HH1       ARG  15   1.528 -13.239 -10.266
  124   1HH2  ARG  15          HH2       ARG  15  -0.885 -13.834  -7.846
  125   2HH2  ARG  15          HH2       ARG  15  -0.016 -14.495  -9.193
  126    H    ILE  16           HN       ILE  16  -0.124  -8.331  -3.779
  127    HA   ILE  16           HA       ILE  16   0.513 -10.111  -1.461
  128    HB   ILE  16           HB       ILE  16  -1.069  -7.674  -0.835
  129   1HG1  ILE  16          HG1       ILE  16   1.890  -7.480  -1.508
  130   2HG1  ILE  16          HG1       ILE  16   0.573  -6.592  -2.272
  131   1HG2  ILE  16          HG2       ILE  16   0.569  -9.645   0.462
  132   2HG2  ILE  16          HG2       ILE  16  -0.517  -8.461   1.187
  133   3HG2  ILE  16          HG2       ILE  16   1.165  -8.037   0.869
  134   1HD1  ILE  16          HD1       ILE  16   0.167  -5.306  -0.295
  135   2HD1  ILE  16          HD1       ILE  16   1.915  -5.299  -0.524
  136   3HD1  ILE  16          HD1       ILE  16   1.189  -6.354   0.687
  137    HA   PRO  17           HA       PRO  17  -3.688 -11.251  -2.214
  138   1HB   PRO  17          HB2       PRO  17  -4.291 -12.497   0.136
  139   2HB   PRO  17          HB1       PRO  17  -3.200 -13.196  -1.076
  140   1HG   PRO  17          HG2       PRO  17  -2.588 -12.045   1.534
  141   2HG   PRO  17          HG1       PRO  17  -1.627 -13.130   0.524
  142   1HD   PRO  17          HD2       PRO  17  -1.339 -10.301   0.858
  143   2HD   PRO  17          HD1       PRO  17  -0.360 -11.391  -0.145
  144    H    GLU  18           HN       GLU  18  -5.185  -9.583  -2.284
  145    HA   GLU  18           HA       GLU  18  -5.607  -7.474  -0.538
  146   1HB   GLU  18          HB2       GLU  18  -6.655  -7.882  -2.770
  147   2HB   GLU  18          HB1       GLU  18  -7.737  -9.051  -2.015
  148   1HG   GLU  18          HG2       GLU  18  -8.344  -7.120  -0.391
  149   2HG   GLU  18          HG1       GLU  18  -7.614  -6.068  -1.601
  150    H    ASN  19           HN       ASN  19  -6.603 -10.812  -0.059
  151    HA   ASN  19           HA       ASN  19  -8.563 -10.341   2.004
  152   1HB   ASN  19          HB2       ASN  19  -6.750 -12.716   1.464
  153   2HB   ASN  19          HB1       ASN  19  -8.258 -12.753   2.377
  154   1HD2  ASN  19          HD2       ASN  19  -6.956 -13.160  -0.745
  155   2HD2  ASN  19          HD2       ASN  19  -8.405 -13.063  -1.624
  156    H    ARG  20           HN       ARG  20  -5.170  -9.935   1.998
  157    HA   ARG  20           HA       ARG  20  -5.021 -10.240   4.970
  158   1HB   ARG  20          HB2       ARG  20  -3.087 -10.531   2.676
  159   2HB   ARG  20          HB1       ARG  20  -2.505 -10.311   4.322
  160   1HG   ARG  20          HG2       ARG  20  -4.455 -12.250   4.607
  161   2HG   ARG  20          HG1       ARG  20  -3.693 -12.668   3.072
  162   1HD   ARG  20          HD2       ARG  20  -1.452 -12.530   4.210
  163   2HD   ARG  20          HD1       ARG  20  -2.306 -12.308   5.750
  164    HE   ARG  20           HE       ARG  20  -3.253 -14.602   4.200
  165   1HH1  ARG  20          HH2       ARG  20  -2.409 -13.639   7.230
  166   2HH1  ARG  20          HH2       ARG  20  -1.528 -15.066   7.665
  167   1HH2  ARG  20          HH1       ARG  20  -1.515 -16.358   4.446
  168   2HH2  ARG  20          HH1       ARG  20  -1.022 -16.606   6.090
  169    H    VAL  21           HN       VAL  21  -4.229  -8.179   2.211
  170    HA   VAL  21           HA       VAL  21  -2.908  -6.088   3.702
  171    HB   VAL  21           HB       VAL  21  -4.419  -5.949   1.077
  172   1HG1  VAL  21          HG1       VAL  21  -3.316  -3.970   0.682
  173   2HG1  VAL  21          HG1       VAL  21  -1.907  -4.444   1.633
  174   3HG1  VAL  21          HG1       VAL  21  -3.371  -3.888   2.442
  175   1HG2  VAL  21          HG2       VAL  21  -2.881  -7.354   0.216
  176   2HG2  VAL  21          HG2       VAL  21  -2.144  -7.533   1.807
  177   3HG2  VAL  21          HG2       VAL  21  -1.603  -6.252   0.724
  178    H    VAL  22           HN       VAL  22  -3.784  -4.022   4.345
  179    HA   VAL  22           HA       VAL  22  -6.764  -3.921   4.510
  180    HB   VAL  22           HB       VAL  22  -6.288  -2.771   6.728
  181   1HG1  VAL  22          HG1       VAL  22  -6.586  -4.764   7.751
  182   2HG1  VAL  22          HG1       VAL  22  -5.125  -5.450   7.039
  183   3HG1  VAL  22          HG1       VAL  22  -6.623  -5.403   6.108
  184   1HG2  VAL  22          HG2       VAL  22  -3.536  -3.944   6.248
  185   2HG2  VAL  22          HG2       VAL  22  -4.092  -3.222   7.757
  186   3HG2  VAL  22          HG2       VAL  22  -3.923  -2.224   6.315
  187    H    SER  23           HN       SER  23  -3.736  -2.058   4.414
  188    HA   SER  23           HA       SER  23  -4.982   0.053   2.839
  189   1HB   SER  23          HB2       SER  23  -5.965   0.564   4.972
  190   2HB   SER  23          HB1       SER  23  -4.423   0.362   5.796
  191    HG   SER  23           HG       SER  23  -4.811   2.552   5.468
  192    H    TYR  24           HN       TYR  24  -3.387   1.411   1.952
  193    HA   TYR  24           HA       TYR  24  -0.614   0.523   2.371
  194   1HB   TYR  24          HB2       TYR  24  -0.247   1.556   0.248
  195   2HB   TYR  24          HB1       TYR  24  -1.776   0.704   0.160
  196    HD1  TYR  24           HD1      TYR  24  -1.146   2.769  -1.806
  197    HD2  TYR  24           HD2      TYR  24  -2.921   3.237   2.080
  198    HE1  TYR  24           HE1      TYR  24  -2.219   4.867  -2.545
  199    HE2  TYR  24           HE2      TYR  24  -3.997   5.327   1.331
  200    HH   TYR  24           HH       TYR  24  -4.706   6.218  -1.241
  201    H    GLN  25           HN       GLN  25   0.828   2.619   1.619
  202    HA   GLN  25           HA       GLN  25   0.274   5.018   3.235
  203   1HB   GLN  25          HB2       GLN  25   2.257   2.846   3.889
  204   2HB   GLN  25          HB1       GLN  25   2.666   4.516   4.284
  205   1HG   GLN  25          HG2       GLN  25   0.432   4.680   5.468
  206   2HG   GLN  25          HG1       GLN  25   0.262   2.939   5.239
  207   1HE2  GLN  25          HE2       GLN  25   0.882   4.840   7.697
  208   2HE2  GLN  25          HE2       GLN  25   2.152   4.025   8.474
  209    H    LEU  26           HN       LEU  26   0.470   6.117   1.204
  210    HA   LEU  26           HA       LEU  26   2.535   5.586  -0.695
  211   1HB   LEU  26          HB2       LEU  26   0.414   7.581  -0.199
  212   2HB   LEU  26          HB1       LEU  26   1.750   8.154  -1.195
  213    HG   LEU  26           HG       LEU  26   0.088   5.665  -1.695
  214   1HD1  LEU  26          HD1       LEU  26  -0.846   6.838  -3.538
  215   2HD1  LEU  26          HD1       LEU  26   0.364   8.116  -3.439
  216   3HD1  LEU  26          HD1       LEU  26  -0.887   7.989  -2.201
  217   1HD2  LEU  26          HD2       LEU  26   2.587   6.768  -2.968
  218   2HD2  LEU  26          HD2       LEU  26   1.447   5.825  -3.927
  219   3HD2  LEU  26          HD2       LEU  26   2.218   5.107  -2.515
  220    H    SER  27           HN       SER  27   4.540   6.382  -0.955
  221    HA   SER  27           HA       SER  27   5.509   8.463   0.955
  222   1HB   SER  27          HB2       SER  27   6.313   6.242   1.575
  223   2HB   SER  27          HB1       SER  27   6.838   5.938  -0.078
  224    HG   SER  27           HG       SER  27   8.639   6.637   0.908
  225    H    SER  28           HN       SER  28   8.138   8.454  -0.315
  226    HA   SER  28           HA       SER  28   7.811   8.995  -3.163
  227   1HB   SER  28          HB2       SER  28   6.667  10.925  -2.116
  228   2HB   SER  28          HB1       SER  28   8.128  11.290  -1.201
  229    HG   SER  28           HG       SER  28   7.691  11.399  -3.994
  230    H    ARG  29           HN       ARG  29   9.938  10.655  -3.628
  231    HA   ARG  29           HA       ARG  29  12.218   9.005  -2.698
  232   1HB   ARG  29          HB2       ARG  29  11.850   9.540  -5.089
  233   2HB   ARG  29          HB1       ARG  29  12.002  11.258  -4.715
  234   1HG   ARG  29          HG2       ARG  29  14.291  10.914  -3.923
  235   2HG   ARG  29          HG1       ARG  29  14.148   9.178  -4.204
  236   1HD   ARG  29          HD2       ARG  29  14.807   9.488  -6.343
  237   2HD   ARG  29          HD1       ARG  29  13.394  10.527  -6.615
  238    HE   ARG  29           HE       ARG  29  15.799  11.668  -5.270
  239   1HH1  ARG  29          HH2       ARG  29  15.460  11.225  -8.403
  240   2HH1  ARG  29          HH2       ARG  29  15.109  12.858  -8.863
  241   1HH2  ARG  29          HH1       ARG  29  14.512  13.924  -5.618
  242   2HH2  ARG  29          HH1       ARG  29  14.572  14.386  -7.287
  243    H    SER  30           HN       SER  30  12.811   9.712  -0.637
  244    HA   SER  30           HA       SER  30  13.666  12.574  -0.420
  245   1HB   SER  30          HB2       SER  30  11.792  10.943   1.250
  246   2HB   SER  30          HB1       SER  30  12.807  12.127   2.069
  247    HG   SER  30           HG       SER  30  10.716  12.476   0.281
  248    H    THR  31           HN       THR  31  13.890   9.273   0.902
  249    HA   THR  31           HA       THR  31  16.751   9.829   1.586
  250    HB   THR  31           HB       THR  31  16.297   8.520   3.701
  251    HG1  THR  31           HG1      THR  31  14.354   7.558   2.832
  252   1HG2  THR  31          HG2       THR  31  14.777  11.081   3.170
  253   2HG2  THR  31          HG2       THR  31  16.382  10.910   3.878
  254   3HG2  THR  31          HG2       THR  31  14.960  10.387   4.781
  255    H    CYS  32           HN       CYS  32  15.164   8.279  -0.565
  256    HA   CYS  32           HA       CYS  32  16.601   5.674  -0.189
  257   1HB   CYS  32          HB2       CYS  32  13.824   6.152  -1.319
  258   2HB   CYS  32          HB1       CYS  32  14.609   4.584  -1.148
  259    H    LEU  33           HN       LEU  33  16.073   4.540  -2.625
  260    HA   LEU  33           HA       LEU  33  17.262   6.491  -4.548
  261   1HB   LEU  33          HB2       LEU  33  18.229   4.436  -5.580
  262   2HB   LEU  33          HB1       LEU  33  18.704   4.624  -3.892
  263    HG   LEU  33           HG       LEU  33  16.206   3.188  -4.044
  264   1HD1  LEU  33          HD1       LEU  33  17.542   2.698  -6.327
  265   2HD1  LEU  33          HD1       LEU  33  16.630   1.446  -5.485
  266   3HD1  LEU  33          HD1       LEU  33  18.378   1.560  -5.272
  267   1HD2  LEU  33          HD2       LEU  33  17.626   3.035  -2.117
  268   2HD2  LEU  33          HD2       LEU  33  19.018   2.575  -3.098
  269   3HD2  LEU  33          HD2       LEU  33  17.677   1.450  -2.888
  270    H    LYS  34           HN       LYS  34  14.397   4.826  -3.875
  271    HA   LYS  34           HA       LYS  34  13.401   5.337  -6.620
  272   1HB   LYS  34          HB2       LYS  34  14.257   2.785  -5.642
  273   2HB   LYS  34          HB1       LYS  34  12.503   2.738  -5.830
  274   1HG   LYS  34          HG2       LYS  34  12.883   2.382  -8.029
  275   2HG   LYS  34          HG1       LYS  34  13.365   4.075  -8.112
  276   1HD   LYS  34          HD2       LYS  34  15.338   3.217  -8.870
  277   2HD   LYS  34          HD1       LYS  34  15.655   2.953  -7.155
  278   1HE   LYS  34          HE2       LYS  34  14.656   0.662  -7.362
  279   2HE   LYS  34          HE1       LYS  34  14.505   0.931  -9.110
  280   1HZ   LYS  34          HZ1       LYS  34  16.982   0.918  -7.481
  281   2HZ   LYS  34          HZ2       LYS  34  16.925   1.566  -9.052
  282   3HZ   LYS  34          HZ3       LYS  34  16.598  -0.082  -8.798
  283    H    ALA  35           HN       ALA  35  11.183   5.815  -6.601
  284    HA   ALA  35           HA       ALA  35   9.922   6.085  -3.933
  285   1HB   ALA  35          HB1       ALA  35   9.191   7.953  -4.969
  286   2HB   ALA  35          HB2       ALA  35   8.241   6.944  -6.061
  287   3HB   ALA  35          HB3       ALA  35   9.888   7.403  -6.492
  288    H    GLY  36           HN       GLY  36   7.892   5.112  -3.427
  289   1HA   GLY  36          HA2       GLY  36   6.449   3.477  -5.307
  290   2HA   GLY  36          HA1       GLY  36   7.420   2.473  -4.230
  291    H    VAL  37           HN       VAL  37   5.113   1.737  -3.584
  292    HA   VAL  37           HA       VAL  37   3.939   3.676  -1.617
  293    HB   VAL  37           HB       VAL  37   2.724   1.251  -2.977
  294   1HG1  VAL  37          HG1       VAL  37   1.702   3.423  -1.156
  295   2HG1  VAL  37          HG1       VAL  37   1.473   1.678  -1.032
  296   3HG1  VAL  37          HG1       VAL  37   0.622   2.594  -2.274
  297   1HG2  VAL  37          HG2       VAL  37   3.275   3.907  -3.965
  298   2HG2  VAL  37          HG2       VAL  37   1.532   3.668  -3.848
  299   3HG2  VAL  37          HG2       VAL  37   2.512   2.556  -4.802
  300    H    ILE  38           HN       ILE  38   2.912   2.503   0.315
  301    HA   ILE  38           HA       ILE  38   4.545   0.109   1.097
  302    HB   ILE  38           HB       ILE  38   3.755   2.609   2.622
  303   1HG1  ILE  38          HG1       ILE  38   6.381   2.300   3.047
  304   2HG1  ILE  38          HG1       ILE  38   6.267   1.423   1.523
  305   1HG2  ILE  38          HG2       ILE  38   5.185   1.337   4.452
  306   2HG2  ILE  38          HG2       ILE  38   4.616  -0.096   3.594
  307   3HG2  ILE  38          HG2       ILE  38   3.456   1.028   4.303
  308   1HD1  ILE  38          HD1       ILE  38   4.836   3.581   0.834
  309   2HD1  ILE  38          HD1       ILE  38   6.589   3.545   0.682
  310   3HD1  ILE  38          HD1       ILE  38   5.842   4.324   2.075
  311    H    PHE  39           HN       PHE  39   3.205  -1.625   1.515
  312    HA   PHE  39           HA       PHE  39   0.358  -1.025   2.217
  313   1HB   PHE  39          HB2       PHE  39   1.769  -3.145   0.635
  314   2HB   PHE  39          HB1       PHE  39   0.188  -3.495   1.337
  315    HD1  PHE  39           HD1      PHE  39   2.005  -1.012  -0.781
  316    HD2  PHE  39           HD2      PHE  39  -1.785  -2.693   0.332
  317    HE1  PHE  39           HE1      PHE  39   0.902   0.281  -2.588
  318    HE2  PHE  39           HE2      PHE  39  -2.888  -1.403  -1.473
  319    HZ   PHE  39           HZ       PHE  39  -1.549   0.085  -2.929
  320    H    THR  40           HN       THR  40  -0.573  -2.084   3.982
  321    HA   THR  40           HA       THR  40   1.306  -3.606   5.737
  322    HB   THR  40           HB       THR  40  -0.971  -1.685   6.280
  323    HG1  THR  40           HG1      THR  40   0.620  -0.375   6.556
  324   1HG2  THR  40          HG2       THR  40  -0.024  -3.901   7.900
  325   2HG2  THR  40          HG2       THR  40  -1.380  -2.811   8.187
  326   3HG2  THR  40          HG2       THR  40   0.241  -2.361   8.718
  327    H    THR  41           HN       THR  41   0.506  -5.513   6.687
  328    HA   THR  41           HA       THR  41  -1.860  -6.699   5.395
  329    HB   THR  41           HB       THR  41  -0.247  -8.054   7.515
  330    HG1  THR  41           HG1      THR  41   1.373  -8.439   5.906
  331   1HG2  THR  41          HG2       THR  41  -0.977  -9.012   4.750
  332   2HG2  THR  41          HG2       THR  41  -2.122  -9.081   6.090
  333   3HG2  THR  41          HG2       THR  41  -0.607  -9.977   6.180
  334    H    LYS  42           HN       LYS  42  -3.441  -7.894   6.858
  335    HA   LYS  42           HA       LYS  42  -4.464  -6.107   8.903
  336   1HB   LYS  42          HB2       LYS  42  -6.194  -7.848   9.086
  337   2HB   LYS  42          HB1       LYS  42  -5.831  -7.531   7.390
  338   1HG   LYS  42          HG2       LYS  42  -5.191  -9.665   7.076
  339   2HG   LYS  42          HG1       LYS  42  -4.051  -9.562   8.419
  340   1HD   LYS  42          HD2       LYS  42  -6.902  -9.728   9.199
  341   2HD   LYS  42          HD1       LYS  42  -6.245 -11.175   8.430
  342   1HE   LYS  42          HE2       LYS  42  -4.290 -11.018  10.064
  343   2HE   LYS  42          HE1       LYS  42  -5.240  -9.797  10.935
  344   1HZ   LYS  42          HZ1       LYS  42  -5.570 -12.238  11.588
  345   2HZ   LYS  42          HZ2       LYS  42  -6.436 -12.375  10.134
  346   3HZ   LYS  42          HZ3       LYS  42  -6.955 -11.293  11.335
  347    H    LYS  43           HN       LYS  43  -2.231  -8.769   8.921
  348    HA   LYS  43           HA       LYS  43  -2.639  -9.547  11.703
  349   1HB   LYS  43          HB2       LYS  43  -1.373 -10.538   9.439
  350   2HB   LYS  43          HB1       LYS  43  -0.025 -10.078  10.479
  351   1HG   LYS  43          HG2       LYS  43  -0.808 -11.461  12.267
  352   2HG   LYS  43          HG1       LYS  43  -2.365 -11.716  11.476
  353   1HD   LYS  43          HD2       LYS  43  -1.526 -13.283  10.023
  354   2HD   LYS  43          HD1       LYS  43   0.056 -12.508   9.936
  355   1HE   LYS  43          HE2       LYS  43   0.827 -13.554  11.881
  356   2HE   LYS  43          HE1       LYS  43  -0.814 -13.800  12.515
  357   1HZ   LYS  43          HZ1       LYS  43   0.395 -15.148  10.158
  358   2HZ   LYS  43          HZ2       LYS  43  -1.234 -15.294  10.619
  359   3HZ   LYS  43          HZ3       LYS  43  -0.005 -15.872  11.640
  360    H    GLY  44           HN       GLY  44  -0.850  -7.054  10.054
  361   1HA   GLY  44          HA2       GLY  44  -0.199  -5.157  11.596
  362   2HA   GLY  44          HA1       GLY  44   0.530  -6.397  12.612
  363    H    GLN  45           HN       GLN  45   0.976  -7.215   9.369
  364    HA   GLN  45           HA       GLN  45   3.838  -6.678   9.523
  365   1HB   GLN  45          HB2       GLN  45   1.876  -8.053   7.781
  366   2HB   GLN  45          HB1       GLN  45   3.317  -7.457   6.956
  367   1HG   GLN  45          HG2       GLN  45   4.746  -8.632   8.582
  368   2HG   GLN  45          HG1       GLN  45   3.312  -9.219   9.426
  369   1HE2  GLN  45          HE2       GLN  45   5.569 -10.520   7.600
  370   2HE2  GLN  45          HE2       GLN  45   4.664 -11.540   6.589
  371    H    GLN  46           HN       GLN  46   4.866  -5.606   7.468
  372    HA   GLN  46           HA       GLN  46   3.281  -3.404   6.295
  373   1HB   GLN  46          HB2       GLN  46   5.577  -3.057   8.245
  374   2HB   GLN  46          HB1       GLN  46   5.029  -1.762   7.181
  375   1HG   GLN  46          HG2       GLN  46   2.707  -2.090   8.139
  376   2HG   GLN  46          HG1       GLN  46   3.428  -3.171   9.332
  377   1HE2  GLN  46          HE2       GLN  46   4.582  -0.030   7.975
  378   2HE2  GLN  46          HE2       GLN  46   4.754   0.724   9.487
  379    H    SER  47           HN       SER  47   3.837  -4.091   4.203
  380    HA   SER  47           HA       SER  47   6.755  -4.376   3.586
  381   1HB   SER  47          HB2       SER  47   4.250  -5.413   2.228
  382   2HB   SER  47          HB1       SER  47   5.891  -5.707   1.657
  383    HG   SER  47           HG       SER  47   6.267  -6.981   3.359
  384    H    CYS  48           HN       CYS  48   7.281  -3.696   1.259
  385    HA   CYS  48           HA       CYS  48   6.073  -1.017   0.741
  386   1HB   CYS  48          HB2       CYS  48   8.671  -2.058   0.863
  387   2HB   CYS  48          HB1       CYS  48   8.378  -1.818  -0.858
  388    H    GLY  49           HN       GLY  49   4.596  -0.881  -0.924
  389   1HA   GLY  49          HA2       GLY  49   4.536  -3.079  -2.919
  390   2HA   GLY  49          HA1       GLY  49   3.235  -1.931  -2.637
  391    H    ASP  50           HN       ASP  50   4.908  -2.716  -5.059
  392    HA   ASP  50           HA       ASP  50   6.178  -0.143  -5.768
  393   1HB   ASP  50          HB2       ASP  50   6.927  -1.416  -7.728
  394   2HB   ASP  50          HB1       ASP  50   7.197  -2.366  -6.267
  395    HA   PRO  51           HA       PRO  51   2.388   1.275  -7.608
  396   1HB   PRO  51          HB2       PRO  51   3.440   3.350  -9.070
  397   2HB   PRO  51          HB1       PRO  51   3.169   3.430  -7.316
  398   1HG   PRO  51          HG2       PRO  51   5.690   2.880  -8.817
  399   2HG   PRO  51          HG1       PRO  51   5.430   3.882  -7.378
  400   1HD   PRO  51          HD2       PRO  51   6.463   1.392  -7.232
  401   2HD   PRO  51          HD1       PRO  51   5.433   2.069  -5.953
  402    H    LYS  52           HN       LYS  52   5.233   0.344  -9.428
  403    HA   LYS  52           HA       LYS  52   4.092   0.462 -12.069
  404   1HB   LYS  52          HB2       LYS  52   6.376  -0.911 -10.684
  405   2HB   LYS  52          HB1       LYS  52   5.972  -1.388 -12.335
  406   1HG   LYS  52          HG2       LYS  52   6.615   0.630 -13.224
  407   2HG   LYS  52          HG1       LYS  52   6.134   1.535 -11.788
  408   1HD   LYS  52          HD2       LYS  52   8.532  -0.312 -11.871
  409   2HD   LYS  52          HD1       LYS  52   8.631   1.424 -12.162
  410   1HE   LYS  52          HE2       LYS  52   8.268   1.951  -9.948
  411   2HE   LYS  52          HE1       LYS  52   7.203   0.555  -9.687
  412   1HZ   LYS  52          HZ1       LYS  52  10.159   0.564  -9.930
  413   2HZ   LYS  52          HZ2       LYS  52   9.234  -0.855 -10.061
  414   3HZ   LYS  52          HZ3       LYS  52   9.229   0.037  -8.615
  415    H    GLN  53           HN       GLN  53   3.632  -1.699  -9.393
  416    HA   GLN  53           HA       GLN  53   2.694  -3.962 -11.017
  417   1HB   GLN  53          HB2       GLN  53   3.273  -3.286  -8.210
  418   2HB   GLN  53          HB1       GLN  53   1.909  -4.382  -8.416
  419   1HG   GLN  53          HG2       GLN  53   4.447  -4.884  -9.939
  420   2HG   GLN  53          HG1       GLN  53   4.335  -5.373  -8.248
  421   1HE2  GLN  53          HE2       GLN  53   4.313  -7.669  -8.812
  422   2HE2  GLN  53          HE2       GLN  53   2.954  -8.385  -9.532
  423    H    GLU  54           HN       GLU  54   0.438  -4.786 -10.727
  424    HA   GLU  54           HA       GLU  54  -1.500  -2.557 -10.894
  425   1HB   GLU  54          HB2       GLU  54  -1.212  -4.573 -12.483
  426   2HB   GLU  54          HB1       GLU  54  -2.014  -5.516 -11.225
  427   1HG   GLU  54          HG2       GLU  54  -3.923  -4.859 -12.282
  428   2HG   GLU  54          HG1       GLU  54  -3.678  -3.358 -11.387
  429    H    TRP  55           HN       TRP  55  -0.490  -4.828  -8.451
  430    HA   TRP  55           HA       TRP  55  -3.126  -4.962  -7.178
  431   1HB   TRP  55          HB2       TRP  55  -1.939  -6.228  -5.483
  432   2HB   TRP  55          HB1       TRP  55  -1.435  -6.772  -7.072
  433    HD1  TRP  55           HD1      TRP  55   1.053  -6.386  -7.775
  434    HE1  TRP  55           HE1      TRP  55   3.150  -5.670  -6.447
  435    HE3  TRP  55           HE3      TRP  55  -1.137  -4.639  -3.512
  436    HZ2  TRP  55           HZ2      TRP  55   3.799  -4.548  -3.942
  437    HZ3  TRP  55           HZ3      TRP  55   0.250  -3.757  -1.666
  438    HH2  TRP  55           HH2      TRP  55   2.722  -3.700  -1.872
  439    H    VAL  56           HN       VAL  56  -0.290  -2.865  -6.971
  440    HA   VAL  56           HA       VAL  56  -1.164  -1.580  -4.488
  441    HB   VAL  56           HB       VAL  56   0.637  -0.642  -6.765
  442   1HG1  VAL  56          HG1       VAL  56   0.397   1.377  -5.752
  443   2HG1  VAL  56          HG1       VAL  56   1.362   0.691  -4.444
  444   3HG1  VAL  56          HG1       VAL  56  -0.397   0.667  -4.347
  445   1HG2  VAL  56          HG2       VAL  56   1.915  -2.312  -5.836
  446   2HG2  VAL  56          HG2       VAL  56   1.040  -2.271  -4.305
  447   3HG2  VAL  56          HG2       VAL  56   2.270  -1.054  -4.653
  448    H    GLN  57           HN       GLN  57  -1.259  -0.772  -7.963
  449    HA   GLN  57           HA       GLN  57  -2.933   1.526  -7.814
  450   1HB   GLN  57          HB2       GLN  57  -1.642  -0.019  -9.730
  451   2HB   GLN  57          HB1       GLN  57  -3.344  -0.279 -10.108
  452   1HG   GLN  57          HG2       GLN  57  -3.325   2.414  -9.671
  453   2HG   GLN  57          HG1       GLN  57  -1.716   2.175 -10.350
  454   1HE2  GLN  57          HE2       GLN  57  -4.008   3.504 -11.689
  455   2HE2  GLN  57          HE2       GLN  57  -4.327   2.601 -13.089
  456    H    ARG  58           HN       ARG  58  -3.781  -1.913  -8.378
  457    HA   ARG  58           HA       ARG  58  -6.595  -1.659  -8.492
  458   1HB   ARG  58          HB2       ARG  58  -5.408  -3.704  -9.036
  459   2HB   ARG  58          HB1       ARG  58  -4.757  -3.815  -7.400
  460   1HG   ARG  58          HG2       ARG  58  -7.028  -4.118  -6.504
  461   2HG   ARG  58          HG1       ARG  58  -7.694  -3.988  -8.132
  462   1HD   ARG  58          HD2       ARG  58  -5.544  -6.023  -7.640
  463   2HD   ARG  58          HD1       ARG  58  -7.197  -6.380  -7.101
  464    HE   ARG  58           HE       ARG  58  -7.366  -5.314  -9.726
  465   1HH1  ARG  58          HH1       ARG  58  -8.509  -7.962  -8.785
  466   2HH1  ARG  58          HH1       ARG  58  -7.655  -9.080  -9.792
  467   1HH2  ARG  58          HH2       ARG  58  -5.220  -6.795 -10.723
  468   2HH2  ARG  58          HH2       ARG  58  -5.793  -8.420 -10.890
  469    H    TYR  59           HN       TYR  59  -4.591  -2.461  -5.618
  470    HA   TYR  59           HA       TYR  59  -6.664  -2.307  -3.670
  471   1HB   TYR  59          HB2       TYR  59  -3.684  -1.722  -3.634
  472   2HB   TYR  59          HB1       TYR  59  -4.657  -1.745  -2.172
  473    HD1  TYR  59           HD1      TYR  59  -2.952  -3.515  -1.493
  474    HD2  TYR  59           HD2      TYR  59  -5.786  -4.138  -4.667
  475    HE1  TYR  59           HE1      TYR  59  -2.628  -5.963  -1.293
  476    HE2  TYR  59           HE2      TYR  59  -5.454  -6.586  -4.461
  477    HH   TYR  59           HH       TYR  59  -3.778  -8.154  -3.634
  478    H    MET  60           HN       MET  60  -4.412   0.119  -4.892
  479    HA   MET  60           HA       MET  60  -5.268   2.373  -3.355
  480   1HB   MET  60          HB2       MET  60  -3.851   1.873  -5.958
  481   2HB   MET  60          HB1       MET  60  -4.173   3.517  -5.415
  482   1HG   MET  60          HG2       MET  60  -3.090   2.935  -3.222
  483   2HG   MET  60          HG1       MET  60  -2.622   1.387  -3.911
  484   1HE   MET  60          HE1       MET  60  -1.429   5.581  -4.930
  485   2HE   MET  60          HE2       MET  60  -2.953   4.924  -4.342
  486   3HE   MET  60          HE3       MET  60  -2.601   4.900  -6.067
  487    H    LYS  61           HN       LYS  61  -6.618   0.784  -6.160
  488    HA   LYS  61           HA       LYS  61  -8.206   3.009  -7.129
  489   1HB   LYS  61          HB2       LYS  61  -7.517   0.956  -8.405
  490   2HB   LYS  61          HB1       LYS  61  -8.614   0.012  -7.400
  491   1HG   LYS  61          HG2       LYS  61 -10.253   0.513  -8.856
  492   2HG   LYS  61          HG1       LYS  61 -10.147   2.182  -8.294
  493   1HD   LYS  61          HD2       LYS  61  -8.635   2.785 -10.027
  494   2HD   LYS  61          HD1       LYS  61  -8.308   1.099 -10.430
  495   1HE   LYS  61          HE2       LYS  61 -10.946   1.060 -10.862
  496   2HE   LYS  61          HE1       LYS  61 -10.665   2.789 -11.158
  497   1HZ   LYS  61          HZ1       LYS  61  -8.919   0.692 -12.305
  498   2HZ   LYS  61          HZ2       LYS  61  -9.044   2.323 -12.764
  499   3HZ   LYS  61          HZ3       LYS  61 -10.305   1.238 -13.117
  500    H    ASN  62           HN       ASN  62  -8.755   0.322  -4.859
  501    HA   ASN  62           HA       ASN  62 -11.552   1.091  -4.394
  502   1HB   ASN  62          HB2       ASN  62 -10.336  -1.241  -4.315
  503   2HB   ASN  62          HB1       ASN  62  -9.901  -0.751  -2.678
  504   1HD2  ASN  62          HD2       ASN  62 -11.728  -2.947  -3.285
  505   2HD2  ASN  62          HD2       ASN  62 -13.250  -2.519  -2.665
  506    H    LEU  63           HN       LEU  63  -8.400   1.689  -2.998
  507    HA   LEU  63           HA       LEU  63  -9.270   2.607  -0.403
  508   1HB   LEU  63          HB2       LEU  63  -6.836   2.610  -2.119
  509   2HB   LEU  63          HB1       LEU  63  -6.877   3.795  -0.808
  510    HG   LEU  63           HG       LEU  63  -7.601   0.919  -0.292
  511   1HD1  LEU  63          HD1       LEU  63  -5.229   1.401  -1.412
  512   2HD1  LEU  63          HD1       LEU  63  -5.397   0.254  -0.083
  513   3HD1  LEU  63          HD1       LEU  63  -4.823   1.891   0.234
  514   1HD2  LEU  63          HD2       LEU  63  -6.599   1.633   1.966
  515   2HD2  LEU  63          HD2       LEU  63  -8.131   2.382   1.514
  516   3HD2  LEU  63          HD2       LEU  63  -6.621   3.277   1.331
  517    H    ASP  64           HN       ASP  64  -8.741   4.184  -3.528
  518    HA   ASP  64           HA       ASP  64  -9.079   6.894  -2.506
  519   1HB   ASP  64          HB2       ASP  64  -7.883   5.907  -4.633
  520   2HB   ASP  64          HB1       ASP  64  -9.487   6.032  -5.359
  521    H    ALA  65           HN       ALA  65 -11.191   4.413  -3.859
  522    HA   ALA  65           HA       ALA  65 -13.458   6.200  -4.290
  523   1HB   ALA  65          HB1       ALA  65 -14.598   4.066  -4.765
  524   2HB   ALA  65          HB2       ALA  65 -13.242   3.179  -4.067
  525   3HB   ALA  65          HB3       ALA  65 -13.019   4.107  -5.550
  526    H    LYS  66           HN       LYS  66 -12.123   4.594  -1.537
  527    HA   LYS  66           HA       LYS  66 -14.470   4.063  -0.002
  528   1HB   LYS  66          HB2       LYS  66 -11.930   3.506   0.311
  529   2HB   LYS  66          HB1       LYS  66 -11.873   5.054   1.155
  530   1HG   LYS  66          HG2       LYS  66 -12.619   3.983   2.990
  531   2HG   LYS  66          HG1       LYS  66 -14.157   3.770   2.154
  532   1HD   LYS  66          HD2       LYS  66 -13.668   1.554   2.554
  533   2HD   LYS  66          HD1       LYS  66 -12.817   1.747   1.020
  534   1HE   LYS  66          HE2       LYS  66 -10.799   1.422   2.010
  535   2HE   LYS  66          HE1       LYS  66 -11.177   2.580   3.304
  536   1HZ   LYS  66          HZ1       LYS  66 -12.308  -0.162   3.131
  537   2HZ   LYS  66          HZ2       LYS  66 -12.504   0.943   4.406
  538   3HZ   LYS  66          HZ3       LYS  66 -10.981   0.255   4.101
  539    H    GLN  67           HN       GLN  67 -12.665   7.033  -0.587
  540    HA   GLN  67           HA       GLN  67 -13.823   8.621   1.510
  541   1HB   GLN  67          HB2       GLN  67 -11.757   9.012   0.038
  542   2HB   GLN  67          HB1       GLN  67 -12.881   9.571  -1.203
  543   1HG   GLN  67          HG2       GLN  67 -13.803  11.212   0.462
  544   2HG   GLN  67          HG1       GLN  67 -12.522  10.729   1.575
  545   1HE2  GLN  67          HE2       GLN  67 -10.850  12.228   1.514
  546   2HE2  GLN  67          HE2       GLN  67 -10.287  13.009   0.116
  547    H    LYS  68           HN       LYS  68 -15.149   7.415  -1.442
  548    HA   LYS  68           HA       LYS  68 -17.251   9.529  -1.518
  549   1HB   LYS  68          HB2       LYS  68 -16.081   7.494  -3.366
  550   2HB   LYS  68          HB1       LYS  68 -17.757   7.969  -3.638
  551   1HG   LYS  68          HG2       LYS  68 -16.204  10.327  -3.115
  552   2HG   LYS  68          HG1       LYS  68 -15.408   9.389  -4.381
  553   1HD   LYS  68          HD2       LYS  68 -17.770   9.179  -5.426
  554   2HD   LYS  68          HD1       LYS  68 -18.203  10.516  -4.359
  555   1HE   LYS  68          HE2       LYS  68 -17.196  12.003  -5.739
  556   2HE   LYS  68          HE1       LYS  68 -15.688  11.067  -5.708
  557   1HZ   LYS  68          HZ1       LYS  68 -16.923  11.217  -7.924
  558   2HZ   LYS  68          HZ2       LYS  68 -18.044  10.142  -7.235
  559   3HZ   LYS  68          HZ3       LYS  68 -16.418   9.680  -7.415
  560    H    LYS  69           HN       LYS  69 -19.537   8.724  -1.824
  561    HA   LYS  69           HA       LYS  69 -20.029   6.071  -0.525
  562   1HB   LYS  69          HB2       LYS  69 -20.637   8.802   0.385
  563   2HB   LYS  69          HB1       LYS  69 -22.034   7.724   0.418
  564   1HG   LYS  69          HG2       LYS  69 -21.244   6.834   2.326
  565   2HG   LYS  69          HG1       LYS  69 -19.860   6.220   1.420
  566   1HD   LYS  69          HD2       LYS  69 -18.655   7.541   2.832
  567   2HD   LYS  69          HD1       LYS  69 -19.144   8.834   1.736
  568   1HE   LYS  69          HE2       LYS  69 -21.191   8.220   3.757
  569   2HE   LYS  69          HE1       LYS  69 -19.666   8.805   4.451
  570   1HZ   LYS  69          HZ1       LYS  69 -20.888  10.081   2.079
  571   2HZ   LYS  69          HZ2       LYS  69 -19.702  10.708   3.120
  572   3HZ   LYS  69          HZ3       LYS  69 -21.309  10.557   3.651
  573    H    ALA  70           HN       ALA  70 -21.298   4.900  -1.903
  574    HA   ALA  70           HA       ALA  70 -23.788   5.864  -2.973
  575   1HB   ALA  70          HB1       ALA  70 -22.210   5.407  -5.342
  576   2HB   ALA  70          HB2       ALA  70 -21.430   6.641  -4.350
  577   3HB   ALA  70          HB3       ALA  70 -23.099   6.859  -4.881
  578    H    SER  71           HN       SER  71 -21.083   3.723  -3.879
  579    HA   SER  71           HA       SER  71 -22.712   1.325  -3.425
  580   1HB   SER  71          HB2       SER  71 -22.936   0.696  -5.702
  581   2HB   SER  71          HB1       SER  71 -23.312   2.416  -5.702
  582    HG   SER  71           HG       SER  71 -21.430   1.167  -7.058
  583    HA   PRO  72           HA       PRO  72 -18.679  -0.330  -2.863
  584   1HB   PRO  72          HB2       PRO  72 -19.084  -2.969  -3.437
  585   2HB   PRO  72          HB1       PRO  72 -19.657  -2.201  -1.941
  586   1HG   PRO  72          HG2       PRO  72 -21.152  -2.851  -4.428
  587   2HG   PRO  72          HG1       PRO  72 -21.658  -2.982  -2.737
  588   1HD   PRO  72          HD2       PRO  72 -22.427  -0.948  -4.369
  589   2HD   PRO  72          HD1       PRO  72 -22.262  -0.778  -2.607
  590    H    ARG  73           HN       ARG  73 -16.971  -0.083  -4.257
  591    HA   ARG  73           HA       ARG  73 -17.050  -1.435  -6.906
  592   1HB   ARG  73          HB2       ARG  73 -17.351   1.429  -6.344
  593   2HB   ARG  73          HB1       ARG  73 -16.052   1.088  -7.487
  594   1HG   ARG  73          HG2       ARG  73 -18.715  -0.262  -7.820
  595   2HG   ARG  73          HG1       ARG  73 -18.497   1.394  -8.385
  596   1HD   ARG  73          HD2       ARG  73 -16.971   0.778 -10.031
  597   2HD   ARG  73          HD1       ARG  73 -16.441  -0.663  -9.139
  598    HE   ARG  73           HE       ARG  73 -18.466  -1.800  -9.838
  599   1HH1  ARG  73          HH2       ARG  73 -19.816   1.081  -9.962
  600   2HH1  ARG  73          HH2       ARG  73 -20.290   1.078 -11.627
  601   1HH2  ARG  73          HH1       ARG  73 -18.341  -1.671 -12.451
  602   2HH2  ARG  73          HH1       ARG  73 -19.454  -0.480 -13.037
  Start of MODEL   14
    1   1H    VAL   1          HT1       VAL   1  -5.805  13.533   5.969
    2   2H    VAL   1          HT2       VAL   1  -5.125  13.490   7.526
    3   3H    VAL   1          HT3       VAL   1  -6.760  13.091   7.300
    4    HA   VAL   1           HA       VAL   1  -5.164  11.156   7.622
    5    HB   VAL   1           HB       VAL   1  -7.505  11.074   6.824
    6   1HG1  VAL   1          HG1       VAL   1  -6.221  12.115   4.384
    7   2HG1  VAL   1          HG1       VAL   1  -7.890  12.266   4.930
    8   3HG1  VAL   1          HG1       VAL   1  -7.366  10.808   4.089
    9   1HG2  VAL   1          HG2       VAL   1  -5.364   9.270   5.891
   10   2HG2  VAL   1          HG2       VAL   1  -6.876   9.126   4.994
   11   3HG2  VAL   1          HG2       VAL   1  -6.862   8.895   6.741
   12    H    VAL   2           HN       VAL   2  -3.166  12.772   6.731
   13    HA   VAL   2           HA       VAL   2  -2.290  11.598   4.120
   14    HB   VAL   2           HB       VAL   2  -0.862  13.669   4.074
   15   1HG1  VAL   2          HG1       VAL   2  -3.833  14.135   4.430
   16   2HG1  VAL   2          HG1       VAL   2  -3.062  13.574   2.948
   17   3HG1  VAL   2          HG1       VAL   2  -2.723  15.191   3.561
   18   1HG2  VAL   2          HG2       VAL   2  -0.698  15.041   5.861
   19   2HG2  VAL   2          HG2       VAL   2  -1.537  13.799   6.789
   20   3HG2  VAL   2          HG2       VAL   2  -2.451  15.108   6.042
   21    H    ILE   3           HN       ILE   3  -0.846  10.032   4.405
   22    HA   ILE   3           HA       ILE   3   0.617   9.557   6.843
   23    HB   ILE   3           HB       ILE   3  -0.011   7.751   5.377
   24   1HG1  ILE   3          HG1       ILE   3   2.976   8.253   5.157
   25   2HG1  ILE   3          HG1       ILE   3   2.152   7.444   6.491
   26   1HG2  ILE   3          HG2       ILE   3  -0.275   8.567   3.229
   27   2HG2  ILE   3          HG2       ILE   3   1.283   7.769   3.035
   28   3HG2  ILE   3          HG2       ILE   3   1.213   9.510   3.288
   29   1HD1  ILE   3          HD1       ILE   3   3.113   5.790   4.962
   30   2HD1  ILE   3          HD1       ILE   3   2.214   6.496   3.616
   31   3HD1  ILE   3          HD1       ILE   3   1.351   5.709   4.935
   32    HA   PRO   4           HA       PRO   4   4.042  12.257   6.013
   33   1HB   PRO   4          HB2       PRO   4   5.804  11.249   7.846
   34   2HB   PRO   4          HB1       PRO   4   4.421  12.263   8.298
   35   1HG   PRO   4          HG2       PRO   4   4.755   9.322   8.495
   36   2HG   PRO   4          HG1       PRO   4   3.901  10.438   9.569
   37   1HD   PRO   4          HD2       PRO   4   2.684   8.805   7.720
   38   2HD   PRO   4          HD1       PRO   4   1.966  10.286   8.383
   39    H    SER   5           HN       SER   5   4.061  10.887   3.918
   40    HA   SER   5           HA       SER   5   5.104   8.975   2.678
   41   1HB   SER   5          HB2       SER   5   5.275  11.149   1.680
   42   2HB   SER   5          HB1       SER   5   6.592  11.603   2.758
   43    HG   SER   5           HG       SER   5   7.915  10.163   1.728
   44    HA   PRO   6           HA       PRO   6   8.486   7.796   5.655
   45   1HB   PRO   6          HB2       PRO   6   7.713   5.189   5.941
   46   2HB   PRO   6          HB1       PRO   6   7.101   6.499   6.970
   47   1HG   PRO   6          HG2       PRO   6   5.833   5.189   4.623
   48   2HG   PRO   6          HG1       PRO   6   5.109   5.713   6.150
   49   1HD   PRO   6          HD2       PRO   6   4.881   7.125   3.840
   50   2HD   PRO   6          HD1       PRO   6   4.877   7.886   5.449
   51    H    CYS   7           HN       CYS   7   9.499   5.161   5.206
   52    HA   CYS   7           HA       CYS   7   9.609   4.501   2.390
   53   1HB   CYS   7          HB2       CYS   7  10.776   6.805   2.709
   54   2HB   CYS   7          HB1       CYS   7  12.083   5.872   3.437
   55    H    CYS   8           HN       CYS   8  10.488   2.453   2.199
   56    HA   CYS   8           HA       CYS   8  11.961   1.381   4.575
   57   1HB   CYS   8          HB2       CYS   8  11.097  -0.806   3.780
   58   2HB   CYS   8          HB1       CYS   8   9.790   0.341   4.070
   59    H    MET   9           HN       MET   9  13.009  -0.920   3.263
   60    HA   MET   9           HA       MET   9  14.862   0.329   1.261
   61   1HB   MET   9          HB2       MET   9  16.669  -0.884   2.363
   62   2HB   MET   9          HB1       MET   9  15.793   0.063   3.564
   63   1HG   MET   9          HG2       MET   9  14.373  -2.226   3.700
   64   2HG   MET   9          HG1       MET   9  15.932  -2.887   3.211
   65   1HE   MET   9          HE1       MET   9  13.900  -1.901   6.434
   66   2HE   MET   9          HE2       MET   9  14.044  -0.547   5.316
   67   3HE   MET   9          HE3       MET   9  14.825  -0.466   6.893
   68    H    PHE  10           HN       PHE  10  12.712  -2.269   1.907
   69    HA   PHE  10           HA       PHE  10  13.911  -3.810  -0.373
   70   1HB   PHE  10          HB2       PHE  10  13.261  -5.819   0.773
   71   2HB   PHE  10          HB1       PHE  10  14.024  -4.793   1.983
   72    HD1  PHE  10           HD1      PHE  10  12.781  -3.924   3.842
   73    HD2  PHE  10           HD2      PHE  10  10.749  -5.984   0.666
   74    HE1  PHE  10           HE1      PHE  10  10.713  -3.977   5.205
   75    HE2  PHE  10           HE2      PHE  10   8.681  -6.040   2.031
   76    HZ   PHE  10           HZ       PHE  10   8.662  -5.036   4.299
   77    H    PHE  11           HN       PHE  11  12.364  -4.888  -1.772
   78    HA   PHE  11           HA       PHE  11   9.710  -3.517  -1.837
   79   1HB   PHE  11          HB2       PHE  11  11.716  -4.318  -3.770
   80   2HB   PHE  11          HB1       PHE  11  10.164  -5.056  -4.167
   81    HD1  PHE  11           HD1      PHE  11  10.954  -1.787  -2.523
   82    HD2  PHE  11           HD2      PHE  11   9.242  -3.794  -5.911
   83    HE1  PHE  11           HE1      PHE  11  10.125   0.382  -3.390
   84    HE2  PHE  11           HE2      PHE  11   8.418  -1.626  -6.780
   85    HZ   PHE  11           HZ       PHE  11   8.858   0.464  -5.520
   86    H    VAL  12           HN       VAL  12   7.811  -4.834  -2.012
   87    HA   VAL  12           HA       VAL  12   7.608  -7.131  -0.465
   88    HB   VAL  12           HB       VAL  12   5.555  -7.567  -1.973
   89   1HG1  VAL  12          HG1       VAL  12   6.189  -5.370  -0.192
   90   2HG1  VAL  12          HG1       VAL  12   4.701  -6.307  -0.326
   91   3HG1  VAL  12          HG1       VAL  12   4.955  -4.903  -1.363
   92   1HG2  VAL  12          HG2       VAL  12   5.731  -4.915  -3.169
   93   2HG2  VAL  12          HG2       VAL  12   5.344  -6.457  -3.932
   94   3HG2  VAL  12          HG2       VAL  12   7.027  -5.965  -3.743
   95    H    SER  13           HN       SER  13   8.084  -9.301  -0.763
   96    HA   SER  13           HA       SER  13   9.790 -10.194  -2.863
   97   1HB   SER  13          HB2       SER  13   8.198 -11.324  -0.635
   98   2HB   SER  13          HB1       SER  13   8.567 -12.459  -1.930
   99    HG   SER  13           HG       SER  13  10.773 -11.819  -1.703
  100    H    LYS  14           HN       LYS  14   6.346  -9.779  -2.712
  101    HA   LYS  14           HA       LYS  14   6.033 -10.382  -5.533
  102   1HB   LYS  14          HB2       LYS  14   4.608 -12.372  -5.208
  103   2HB   LYS  14          HB1       LYS  14   6.210 -12.649  -4.521
  104   1HG   LYS  14          HG2       LYS  14   5.296 -11.936  -2.287
  105   2HG   LYS  14          HG1       LYS  14   3.691 -11.885  -3.018
  106   1HD   LYS  14          HD2       LYS  14   3.971 -14.284  -3.677
  107   2HD   LYS  14          HD1       LYS  14   5.499 -14.310  -2.795
  108   1HE   LYS  14          HE2       LYS  14   4.433 -14.543  -0.807
  109   2HE   LYS  14          HE1       LYS  14   3.330 -13.203  -1.176
  110   1HZ   LYS  14          HZ1       LYS  14   2.271 -14.814  -2.813
  111   2HZ   LYS  14          HZ2       LYS  14   1.963 -15.082  -1.163
  112   3HZ   LYS  14          HZ3       LYS  14   3.101 -16.040  -1.986
  113    H    ARG  15           HN       ARG  15   3.229 -11.003  -5.373
  114    HA   ARG  15           HA       ARG  15   2.184  -8.328  -4.721
  115   1HB   ARG  15          HB2       ARG  15   1.688  -9.871  -6.744
  116   2HB   ARG  15          HB1       ARG  15   0.660 -10.780  -5.637
  117   1HG   ARG  15          HG2       ARG  15   0.172  -7.925  -5.426
  118   2HG   ARG  15          HG1       ARG  15  -0.067  -8.493  -7.077
  119   1HD   ARG  15          HD2       ARG  15  -1.228 -10.085  -4.803
  120   2HD   ARG  15          HD1       ARG  15  -2.078  -8.640  -5.385
  121    HE   ARG  15           HE       ARG  15  -1.187 -10.692  -7.358
  122   1HH1  ARG  15          HH2       ARG  15  -3.071  -8.114  -7.470
  123   2HH1  ARG  15          HH2       ARG  15  -4.576  -8.908  -7.795
  124   1HH2  ARG  15          HH1       ARG  15  -3.378 -12.071  -7.034
  125   2HH2  ARG  15          HH1       ARG  15  -4.750 -11.147  -7.548
  126    H    ILE  16           HN       ILE  16  -0.193  -8.520  -3.640
  127    HA   ILE  16           HA       ILE  16   0.051 -10.263  -1.207
  128    HB   ILE  16           HB       ILE  16  -1.407  -7.673  -1.010
  129   1HG1  ILE  16          HG1       ILE  16   1.619  -7.772  -1.296
  130   2HG1  ILE  16          HG1       ILE  16   0.494  -6.891  -2.328
  131   1HG2  ILE  16          HG2       ILE  16  -0.074  -9.603   0.672
  132   2HG2  ILE  16          HG2       ILE  16  -1.187  -8.314   1.127
  133   3HG2  ILE  16          HG2       ILE  16   0.540  -7.985   1.006
  134   1HD1  ILE  16          HD1       ILE  16   1.610  -5.419  -0.640
  135   2HD1  ILE  16          HD1       ILE  16   0.862  -6.373   0.639
  136   3HD1  ILE  16          HD1       ILE  16  -0.145  -5.442  -0.471
  137    HA   PRO  17           HA       PRO  17  -4.119 -11.287  -2.250
  138   1HB   PRO  17          HB2       PRO  17  -4.938 -12.377   0.112
  139   2HB   PRO  17          HB1       PRO  17  -3.807 -13.187  -0.989
  140   1HG   PRO  17          HG2       PRO  17  -3.304 -11.912   1.591
  141   2HG   PRO  17          HG1       PRO  17  -2.355 -13.121   0.722
  142   1HD   PRO  17          HD2       PRO  17  -1.875 -10.315   0.909
  143   2HD   PRO  17          HD1       PRO  17  -0.944 -11.521   0.000
  144    H    GLU  18           HN       GLU  18  -5.578  -9.620  -2.507
  145    HA   GLU  18           HA       GLU  18  -5.999  -7.353  -0.984
  146   1HB   GLU  18          HB2       GLU  18  -7.044  -8.402  -3.212
  147   2HB   GLU  18          HB1       GLU  18  -8.389  -8.733  -2.121
  148   1HG   GLU  18          HG2       GLU  18  -7.143  -6.002  -2.123
  149   2HG   GLU  18          HG1       GLU  18  -8.286  -6.433  -3.396
  150    H    ASN  19           HN       ASN  19  -7.158 -10.595  -0.230
  151    HA   ASN  19           HA       ASN  19  -9.157  -9.787   1.703
  152   1HB   ASN  19          HB2       ASN  19  -9.016 -11.971   0.487
  153   2HB   ASN  19          HB1       ASN  19  -7.586 -12.367   1.440
  154   1HD2  ASN  19          HD2       ASN  19  -9.070 -14.235   2.184
  155   2HD2  ASN  19          HD2       ASN  19 -10.109 -13.929   3.493
  156    H    ARG  20           HN       ARG  20  -5.740  -9.721   1.817
  157    HA   ARG  20           HA       ARG  20  -5.744  -9.883   4.805
  158   1HB   ARG  20          HB2       ARG  20  -3.683 -10.335   2.639
  159   2HB   ARG  20          HB1       ARG  20  -3.254 -10.239   4.343
  160   1HG   ARG  20          HG2       ARG  20  -5.331 -11.986   4.462
  161   2HG   ARG  20          HG1       ARG  20  -4.670 -12.380   2.875
  162   1HD   ARG  20          HD2       ARG  20  -2.362 -12.246   4.293
  163   2HD   ARG  20          HD1       ARG  20  -3.472 -12.785   5.568
  164    HE   ARG  20           HE       ARG  20  -3.068 -14.211   2.970
  165   1HH1  ARG  20          HH1       ARG  20  -5.712 -14.492   4.547
  166   2HH1  ARG  20          HH1       ARG  20  -5.408 -15.965   5.405
  167   1HH2  ARG  20          HH2       ARG  20  -1.993 -15.921   4.801
  168   2HH2  ARG  20          HH2       ARG  20  -3.302 -16.776   5.547
  169    H    VAL  21           HN       VAL  21  -4.844  -7.931   2.013
  170    HA   VAL  21           HA       VAL  21  -3.326  -5.938   3.450
  171    HB   VAL  21           HB       VAL  21  -4.916  -5.710   0.875
  172   1HG1  VAL  21          HG1       VAL  21  -2.385  -4.281   1.719
  173   2HG1  VAL  21          HG1       VAL  21  -3.995  -3.610   1.974
  174   3HG1  VAL  21          HG1       VAL  21  -3.416  -3.918   0.337
  175   1HG2  VAL  21          HG2       VAL  21  -2.949  -7.567   1.391
  176   2HG2  VAL  21          HG2       VAL  21  -2.012  -6.217   0.750
  177   3HG2  VAL  21          HG2       VAL  21  -3.316  -6.919  -0.207
  178    H    VAL  22           HN       VAL  22  -4.037  -3.911   4.271
  179    HA   VAL  22           HA       VAL  22  -6.999  -3.589   4.478
  180    HB   VAL  22           HB       VAL  22  -6.408  -2.542   6.706
  181   1HG1  VAL  22          HG1       VAL  22  -7.255  -4.654   7.016
  182   2HG1  VAL  22          HG1       VAL  22  -5.619  -4.906   7.626
  183   3HG1  VAL  22          HG1       VAL  22  -6.033  -5.402   5.986
  184   1HG2  VAL  22          HG2       VAL  22  -3.720  -3.820   6.156
  185   2HG2  VAL  22          HG2       VAL  22  -4.212  -3.054   7.662
  186   3HG2  VAL  22          HG2       VAL  22  -4.025  -2.085   6.205
  187    H    SER  23           HN       SER  23  -3.862  -1.940   4.319
  188    HA   SER  23           HA       SER  23  -4.948   0.255   2.770
  189   1HB   SER  23          HB2       SER  23  -5.887   0.598   5.068
  190   2HB   SER  23          HB1       SER  23  -4.240   0.737   5.674
  191    HG   SER  23           HG       SER  23  -5.171   2.780   5.190
  192    H    TYR  24           HN       TYR  24  -3.244   1.415   1.849
  193    HA   TYR  24           HA       TYR  24  -0.561   0.370   2.342
  194   1HB   TYR  24          HB2       TYR  24  -0.068   1.443   0.267
  195   2HB   TYR  24          HB1       TYR  24  -1.647   0.694   0.121
  196    HD1  TYR  24           HD1      TYR  24  -0.858   2.768  -1.772
  197    HD2  TYR  24           HD2      TYR  24  -2.667   3.233   2.100
  198    HE1  TYR  24           HE1      TYR  24  -1.791   4.953  -2.463
  199    HE2  TYR  24           HE2      TYR  24  -3.600   5.408   1.399
  200    HH   TYR  24           HH       TYR  24  -4.178   6.593  -0.635
  201    H    GLN  25           HN       GLN  25   1.066   2.328   1.693
  202    HA   GLN  25           HA       GLN  25   0.702   4.731   3.359
  203   1HB   GLN  25          HB2       GLN  25   2.430   2.350   3.981
  204   2HB   GLN  25          HB1       GLN  25   3.033   3.951   4.405
  205   1HG   GLN  25          HG2       GLN  25   1.749   3.909   6.253
  206   2HG   GLN  25          HG1       GLN  25   0.319   3.861   5.221
  207   1HE2  GLN  25          HE2       GLN  25  -0.920   1.976   5.318
  208   2HE2  GLN  25          HE2       GLN  25  -0.403   0.515   6.010
  209    H    LEU  26           HN       LEU  26   0.995   5.781   1.291
  210    HA   LEU  26           HA       LEU  26   2.992   5.154  -0.600
  211   1HB   LEU  26          HB2       LEU  26   1.129   7.331   0.030
  212   2HB   LEU  26          HB1       LEU  26   2.562   7.873  -0.844
  213    HG   LEU  26           HG       LEU  26   0.694   5.636  -1.686
  214   1HD1  LEU  26          HD1       LEU  26   0.095   7.118  -3.513
  215   2HD1  LEU  26          HD1       LEU  26   1.288   8.307  -2.990
  216   3HD1  LEU  26          HD1       LEU  26  -0.132   7.986  -1.994
  217   1HD2  LEU  26          HD2       LEU  26   2.182   5.928  -3.835
  218   2HD2  LEU  26          HD2       LEU  26   2.776   4.942  -2.503
  219   3HD2  LEU  26          HD2       LEU  26   3.360   6.590  -2.703
  220    H    SER  27           HN       SER  27   4.970   6.220  -1.110
  221    HA   SER  27           HA       SER  27   6.285   7.784   1.045
  222   1HB   SER  27          HB2       SER  27   7.003   5.646   1.665
  223   2HB   SER  27          HB1       SER  27   6.940   5.044   0.011
  224    HG   SER  27           HG       SER  27   9.087   5.375   0.733
  225    H    SER  28           HN       SER  28   6.603   9.614  -0.277
  226    HA   SER  28           HA       SER  28   8.327   9.188  -2.684
  227   1HB   SER  28          HB2       SER  28   5.875  10.962  -2.497
  228   2HB   SER  28          HB1       SER  28   6.879  10.729  -3.924
  229    HG   SER  28           HG       SER  28   4.811   9.384  -3.440
  230    H    ARG  29           HN       ARG  29  10.036   9.991  -1.214
  231    HA   ARG  29           HA       ARG  29   9.809  12.917  -0.598
  232   1HB   ARG  29          HB2       ARG  29  10.964  10.524   0.711
  233   2HB   ARG  29          HB1       ARG  29  11.950  11.983   0.813
  234   1HG   ARG  29          HG2       ARG  29   9.369  12.892   1.324
  235   2HG   ARG  29          HG1       ARG  29   9.450  11.347   2.175
  236   1HD   ARG  29          HD2       ARG  29  10.624  12.377   3.814
  237   2HD   ARG  29          HD1       ARG  29  11.925  12.671   2.644
  238    HE   ARG  29           HE       ARG  29  10.156  14.634   1.984
  239   1HH1  ARG  29          HH1       ARG  29   9.112  14.250   4.838
  240   2HH1  ARG  29          HH1       ARG  29  10.011  15.466   5.682
  241   1HH2  ARG  29          HH2       ARG  29  12.316  15.904   3.127
  242   2HH2  ARG  29          HH2       ARG  29  11.828  16.403   4.712
  243    H    SER  30           HN       SER  30  12.094  13.987  -0.668
  244    HA   SER  30           HA       SER  30  13.277  13.383  -3.317
  245   1HB   SER  30          HB2       SER  30  14.549  15.569  -2.549
  246   2HB   SER  30          HB1       SER  30  12.860  15.663  -3.035
  247    HG   SER  30           HG       SER  30  13.026  16.679  -1.078
  248    H    THR  31           HN       THR  31  13.756  11.815  -0.649
  249    HA   THR  31           HA       THR  31  16.749  11.993  -0.717
  250    HB   THR  31           HB       THR  31  16.560  11.207   1.667
  251    HG1  THR  31           HG1      THR  31  14.688  10.410   2.139
  252   1HG2  THR  31          HG2       THR  31  14.848  13.655   1.376
  253   2HG2  THR  31          HG2       THR  31  16.512  13.690   0.793
  254   3HG2  THR  31          HG2       THR  31  16.180  13.352   2.491
  255    H    CYS  32           HN       CYS  32  13.923   9.874  -0.575
  256    HA   CYS  32           HA       CYS  32  15.514   7.409  -0.549
  257   1HB   CYS  32          HB2       CYS  32  12.747   8.300  -0.300
  258   2HB   CYS  32          HB1       CYS  32  12.874   6.866  -1.320
  259    H    LEU  33           HN       LEU  33  16.458   6.599  -2.381
  260    HA   LEU  33           HA       LEU  33  16.125   7.686  -4.996
  261   1HB   LEU  33          HB2       LEU  33  17.292   5.213  -3.763
  262   2HB   LEU  33          HB1       LEU  33  17.192   5.323  -5.520
  263    HG   LEU  33           HG       LEU  33  18.164   7.823  -4.657
  264   1HD1  LEU  33          HD1       LEU  33  19.186   5.518  -3.044
  265   2HD1  LEU  33          HD1       LEU  33  18.945   7.197  -2.567
  266   3HD1  LEU  33          HD1       LEU  33  20.335   6.753  -3.555
  267   1HD2  LEU  33          HD2       LEU  33  20.147   7.152  -5.913
  268   2HD2  LEU  33          HD2       LEU  33  18.713   6.550  -6.741
  269   3HD2  LEU  33          HD2       LEU  33  19.698   5.454  -5.773
  270    H    LYS  34           HN       LYS  34  15.280   4.339  -4.117
  271    HA   LYS  34           HA       LYS  34  13.430   4.007  -6.286
  272   1HB   LYS  34          HB2       LYS  34  14.734   2.312  -4.816
  273   2HB   LYS  34          HB1       LYS  34  13.397   2.484  -3.679
  274   1HG   LYS  34          HG2       LYS  34  11.812   1.897  -5.521
  275   2HG   LYS  34          HG1       LYS  34  13.198   1.600  -6.571
  276   1HD   LYS  34          HD2       LYS  34  12.758   0.195  -3.924
  277   2HD   LYS  34          HD1       LYS  34  12.294  -0.480  -5.486
  278   1HE   LYS  34          HE2       LYS  34  14.593  -0.508  -6.241
  279   2HE   LYS  34          HE1       LYS  34  15.124   0.393  -4.809
  280   1HZ   LYS  34          HZ1       LYS  34  15.486  -1.888  -4.340
  281   2HZ   LYS  34          HZ2       LYS  34  13.942  -2.328  -4.898
  282   3HZ   LYS  34          HZ3       LYS  34  14.108  -1.437  -3.461
  283    H    ALA  35           HN       ALA  35  11.305   4.621  -6.426
  284    HA   ALA  35           HA       ALA  35   9.973   5.623  -3.932
  285   1HB   ALA  35          HB1       ALA  35  10.533   6.832  -6.385
  286   2HB   ALA  35          HB2       ALA  35   9.397   7.430  -5.177
  287   3HB   ALA  35          HB3       ALA  35   8.825   6.415  -6.501
  288    H    GLY  36           HN       GLY  36   8.561   4.046  -3.215
  289   1HA   GLY  36          HA2       GLY  36   6.664   2.916  -5.208
  290   2HA   GLY  36          HA1       GLY  36   7.538   1.798  -4.160
  291    H    VAL  37           HN       VAL  37   5.165   1.297  -3.500
  292    HA   VAL  37           HA       VAL  37   4.239   3.320  -1.477
  293    HB   VAL  37           HB       VAL  37   2.711   1.050  -2.777
  294   1HG1  VAL  37          HG1       VAL  37   2.119   3.210  -0.852
  295   2HG1  VAL  37          HG1       VAL  37   1.279   1.683  -1.117
  296   3HG1  VAL  37          HG1       VAL  37   0.955   3.064  -2.164
  297   1HG2  VAL  37          HG2       VAL  37   2.583   2.262  -4.675
  298   2HG2  VAL  37          HG2       VAL  37   3.651   3.479  -3.970
  299   3HG2  VAL  37          HG2       VAL  37   1.904   3.613  -3.765
  300    H    ILE  38           HN       ILE  38   3.047   2.131   0.421
  301    HA   ILE  38           HA       ILE  38   4.530  -0.382   1.125
  302    HB   ILE  38           HB       ILE  38   3.898   2.103   2.741
  303   1HG1  ILE  38          HG1       ILE  38   6.509   1.632   3.128
  304   2HG1  ILE  38          HG1       ILE  38   6.334   0.834   1.566
  305   1HG2  ILE  38          HG2       ILE  38   3.608   0.616   4.452
  306   2HG2  ILE  38          HG2       ILE  38   5.370   0.556   4.419
  307   3HG2  ILE  38          HG2       ILE  38   4.430  -0.686   3.592
  308   1HD1  ILE  38          HD1       ILE  38   5.126   3.021   0.830
  309   2HD1  ILE  38          HD1       ILE  38   6.879   3.050   0.978
  310   3HD1  ILE  38          HD1       ILE  38   5.876   3.733   2.256
  311    H    PHE  39           HN       PHE  39   3.051  -2.042   1.419
  312    HA   PHE  39           HA       PHE  39   0.270  -1.256   2.177
  313   1HB   PHE  39          HB2       PHE  39   1.492  -3.462   0.548
  314   2HB   PHE  39          HB1       PHE  39  -0.132  -3.649   1.215
  315    HD1  PHE  39           HD1      PHE  39   1.994  -1.305  -0.757
  316    HD2  PHE  39           HD2      PHE  39  -1.978  -2.628   0.178
  317    HE1  PHE  39           HE1      PHE  39   1.083   0.179  -2.511
  318    HE2  PHE  39           HE2      PHE  39  -2.881  -1.142  -1.583
  319    HZ   PHE  39           HZ       PHE  39  -1.354   0.259  -2.935
  320    H    THR  40           HN       THR  40  -0.415  -1.795   4.162
  321    HA   THR  40           HA       THR  40   1.175  -3.677   5.805
  322    HB   THR  40           HB       THR  40  -0.968  -1.595   6.290
  323    HG1  THR  40           HG1      THR  40   1.086  -0.792   6.128
  324   1HG2  THR  40          HG2       THR  40  -0.863  -2.123   8.680
  325   2HG2  THR  40          HG2       THR  40   0.262  -3.443   8.357
  326   3HG2  THR  40          HG2       THR  40  -1.401  -3.539   7.777
  327    H    THR  41           HN       THR  41   0.279  -5.606   6.578
  328    HA   THR  41           HA       THR  41  -2.159  -6.557   5.222
  329    HB   THR  41           HB       THR  41  -0.572  -8.107   7.241
  330    HG1  THR  41           HG1      THR  41   0.261  -7.382   4.632
  331   1HG2  THR  41          HG2       THR  41  -2.127  -9.526   6.334
  332   2HG2  THR  41          HG2       THR  41  -0.873  -9.709   5.107
  333   3HG2  THR  41          HG2       THR  41  -2.230  -8.616   4.827
  334    H    LYS  42           HN       LYS  42  -3.699  -7.904   6.708
  335    HA   LYS  42           HA       LYS  42  -4.611  -6.145   8.864
  336   1HB   LYS  42          HB2       LYS  42  -6.516  -7.680   8.884
  337   2HB   LYS  42          HB1       LYS  42  -6.098  -7.289   7.218
  338   1HG   LYS  42          HG2       LYS  42  -5.922  -9.495   6.816
  339   2HG   LYS  42          HG1       LYS  42  -4.516  -9.519   7.880
  340   1HD   LYS  42          HD2       LYS  42  -5.924 -11.111   8.875
  341   2HD   LYS  42          HD1       LYS  42  -6.281  -9.654   9.803
  342   1HE   LYS  42          HE2       LYS  42  -8.164  -9.237   8.070
  343   2HE   LYS  42          HE1       LYS  42  -7.938 -10.942   7.628
  344   1HZ   LYS  42          HZ1       LYS  42  -9.561 -10.693   9.426
  345   2HZ   LYS  42          HZ2       LYS  42  -8.389  -9.926  10.387
  346   3HZ   LYS  42          HZ3       LYS  42  -8.194 -11.554   9.943
  347    H    LYS  43           HN       LYS  43  -2.425  -8.753   8.679
  348    HA   LYS  43           HA       LYS  43  -3.012  -9.877  11.332
  349   1HB   LYS  43          HB2       LYS  43  -2.122 -11.098   9.279
  350   2HB   LYS  43          HB1       LYS  43  -0.592 -10.262   9.549
  351   1HG   LYS  43          HG2       LYS  43  -0.537 -11.201  11.865
  352   2HG   LYS  43          HG1       LYS  43  -1.994 -12.122  11.489
  353   1HD   LYS  43          HD2       LYS  43  -0.103 -12.547   9.382
  354   2HD   LYS  43          HD1       LYS  43   0.716 -12.815  10.921
  355   1HE   LYS  43          HE2       LYS  43  -0.266 -14.862  10.968
  356   2HE   LYS  43          HE1       LYS  43  -1.816 -14.033  11.206
  357   1HZ   LYS  43          HZ1       LYS  43  -1.734 -13.642   8.704
  358   2HZ   LYS  43          HZ2       LYS  43  -2.106 -15.215   9.228
  359   3HZ   LYS  43          HZ3       LYS  43  -0.546 -14.854   8.665
  360    H    GLY  44           HN       GLY  44  -0.906  -7.442   9.947
  361   1HA   GLY  44          HA2       GLY  44  -0.186  -5.729  11.683
  362   2HA   GLY  44          HA1       GLY  44   0.388  -7.111  12.611
  363    H    GLN  45           HN       GLN  45   0.737  -6.941   9.113
  364    HA   GLN  45           HA       GLN  45   3.702  -6.812   9.520
  365   1HB   GLN  45          HB2       GLN  45   1.823  -8.322   7.830
  366   2HB   GLN  45          HB1       GLN  45   3.210  -7.686   6.945
  367   1HG   GLN  45          HG2       GLN  45   4.037  -8.776   9.503
  368   2HG   GLN  45          HG1       GLN  45   3.159  -9.984   8.565
  369   1HE2  GLN  45          HE2       GLN  45   5.560 -10.887   8.616
  370   2HE2  GLN  45          HE2       GLN  45   6.542 -10.423   7.310
  371    H    GLN  46           HN       GLN  46   4.788  -5.841   7.416
  372    HA   GLN  46           HA       GLN  46   3.209  -3.678   6.165
  373   1HB   GLN  46          HB2       GLN  46   4.892  -3.375   8.507
  374   2HB   GLN  46          HB1       GLN  46   5.513  -2.400   7.174
  375   1HG   GLN  46          HG2       GLN  46   3.260  -1.420   6.855
  376   2HG   GLN  46          HG1       GLN  46   2.665  -2.370   8.217
  377   1HE2  GLN  46          HE2       GLN  46   5.712  -0.481   7.778
  378   2HE2  GLN  46          HE2       GLN  46   5.495   0.467   9.170
  379    H    SER  47           HN       SER  47   3.774  -4.449   4.109
  380    HA   SER  47           HA       SER  47   6.683  -4.782   3.496
  381   1HB   SER  47          HB2       SER  47   4.383  -6.292   2.993
  382   2HB   SER  47          HB1       SER  47   4.753  -5.541   1.447
  383    HG   SER  47           HG       SER  47   5.870  -7.643   2.370
  384    H    CYS  48           HN       CYS  48   7.244  -4.071   1.178
  385    HA   CYS  48           HA       CYS  48   6.106  -1.350   0.696
  386   1HB   CYS  48          HB2       CYS  48   8.639  -2.611  -0.407
  387   2HB   CYS  48          HB1       CYS  48   8.240  -0.895  -0.350
  388    H    GLY  49           HN       GLY  49   4.534  -1.351  -0.899
  389   1HA   GLY  49          HA2       GLY  49   4.422  -3.508  -2.868
  390   2HA   GLY  49          HA1       GLY  49   3.293  -2.169  -2.740
  391    H    ASP  50           HN       ASP  50   4.792  -3.318  -5.062
  392    HA   ASP  50           HA       ASP  50   6.567  -1.099  -5.881
  393   1HB   ASP  50          HB2       ASP  50   7.282  -3.314  -6.445
  394   2HB   ASP  50          HB1       ASP  50   5.683  -3.756  -7.043
  395    HA   PRO  51           HA       PRO  51   2.970   0.922  -7.603
  396   1HB   PRO  51          HB2       PRO  51   4.296   2.953  -8.886
  397   2HB   PRO  51          HB1       PRO  51   3.982   2.945  -7.139
  398   1HG   PRO  51          HG2       PRO  51   6.468   2.236  -8.617
  399   2HG   PRO  51          HG1       PRO  51   6.271   3.126  -7.097
  400   1HD   PRO  51          HD2       PRO  51   7.020   0.519  -7.190
  401   2HD   PRO  51          HD1       PRO  51   6.089   1.208  -5.842
  402    H    LYS  52           HN       LYS  52   5.717  -0.277  -9.395
  403    HA   LYS  52           HA       LYS  52   4.663   0.149 -12.058
  404   1HB   LYS  52          HB2       LYS  52   6.849  -1.315 -10.694
  405   2HB   LYS  52          HB1       LYS  52   6.338  -2.001 -12.235
  406   1HG   LYS  52          HG2       LYS  52   7.971  -0.451 -12.889
  407   2HG   LYS  52          HG1       LYS  52   6.472   0.456 -13.099
  408   1HD   LYS  52          HD2       LYS  52   7.620   2.011 -11.857
  409   2HD   LYS  52          HD1       LYS  52   6.964   1.058 -10.525
  410   1HE   LYS  52          HE2       LYS  52   9.059  -0.297 -10.489
  411   2HE   LYS  52          HE1       LYS  52   9.723   0.746 -11.762
  412   1HZ   LYS  52          HZ1       LYS  52   9.035   2.651 -10.229
  413   2HZ   LYS  52          HZ2       LYS  52  10.419   1.761  -9.796
  414   3HZ   LYS  52          HZ3       LYS  52   8.940   1.478  -9.005
  415    H    GLN  53           HN       GLN  53   4.102  -2.202  -9.536
  416    HA   GLN  53           HA       GLN  53   2.954  -4.269 -11.231
  417   1HB   GLN  53          HB2       GLN  53   3.426  -3.666  -8.382
  418   2HB   GLN  53          HB1       GLN  53   1.984  -4.634  -8.680
  419   1HG   GLN  53          HG2       GLN  53   4.714  -5.281  -9.824
  420   2HG   GLN  53          HG1       GLN  53   4.068  -6.005  -8.350
  421   1HE2  GLN  53          HE2       GLN  53   4.688  -7.482 -10.814
  422   2HE2  GLN  53          HE2       GLN  53   3.226  -8.139 -11.375
  423    H    GLU  54           HN       GLU  54   0.607  -4.850 -11.120
  424    HA   GLU  54           HA       GLU  54  -1.069  -2.420 -11.343
  425   1HB   GLU  54          HB2       GLU  54  -1.167  -5.299 -12.154
  426   2HB   GLU  54          HB1       GLU  54  -2.688  -4.412 -12.050
  427   1HG   GLU  54          HG2       GLU  54  -0.573  -2.892 -13.392
  428   2HG   GLU  54          HG1       GLU  54  -0.973  -4.395 -14.224
  429    H    TRP  55           HN       TRP  55  -0.424  -4.772  -8.891
  430    HA   TRP  55           HA       TRP  55  -3.147  -4.662  -7.790
  431   1HB   TRP  55          HB2       TRP  55  -2.242  -6.144  -6.111
  432   2HB   TRP  55          HB1       TRP  55  -1.686  -6.667  -7.690
  433    HD1  TRP  55           HD1      TRP  55   0.867  -6.575  -8.191
  434    HE1  TRP  55           HE1      TRP  55   2.931  -6.199  -6.686
  435    HE3  TRP  55           HE3      TRP  55  -1.394  -4.714  -4.002
  436    HZ2  TRP  55           HZ2      TRP  55   3.537  -5.266  -4.097
  437    HZ3  TRP  55           HZ3      TRP  55  -0.036  -4.084  -2.024
  438    HH2  TRP  55           HH2      TRP  55   2.430  -4.352  -2.066
  439    H    VAL  56           HN       VAL  56   0.018  -3.117  -7.104
  440    HA   VAL  56           HA       VAL  56  -0.870  -1.815  -4.674
  441    HB   VAL  56           HB       VAL  56   1.146  -0.918  -6.783
  442   1HG1  VAL  56          HG1       VAL  56   0.190   0.203  -4.247
  443   2HG1  VAL  56          HG1       VAL  56   1.132   0.970  -5.522
  444   3HG1  VAL  56          HG1       VAL  56   1.940   0.004  -4.289
  445   1HG2  VAL  56          HG2       VAL  56   2.535  -1.809  -4.562
  446   2HG2  VAL  56          HG2       VAL  56   2.301  -2.734  -6.044
  447   3HG2  VAL  56          HG2       VAL  56   1.215  -2.972  -4.677
  448    H    GLN  57           HN       GLN  57  -0.993  -1.094  -8.121
  449    HA   GLN  57           HA       GLN  57  -2.268   1.504  -7.906
  450   1HB   GLN  57          HB2       GLN  57  -1.112  -0.211  -9.851
  451   2HB   GLN  57          HB1       GLN  57  -2.784   0.035 -10.356
  452   1HG   GLN  57          HG2       GLN  57  -2.471   2.490 -10.121
  453   2HG   GLN  57          HG1       GLN  57  -0.780   2.212  -9.701
  454   1HE2  GLN  57          HE2       GLN  57  -2.074   3.528 -12.168
  455   2HE2  GLN  57          HE2       GLN  57  -1.368   2.718 -13.482
  456    H    ARG  58           HN       ARG  58  -3.438  -1.755  -8.837
  457    HA   ARG  58           HA       ARG  58  -6.203  -1.184  -9.031
  458   1HB   ARG  58          HB2       ARG  58  -5.128  -3.288  -9.713
  459   2HB   ARG  58          HB1       ARG  58  -4.710  -3.633  -8.038
  460   1HG   ARG  58          HG2       ARG  58  -7.391  -3.234  -7.814
  461   2HG   ARG  58          HG1       ARG  58  -7.291  -3.934  -9.430
  462   1HD   ARG  58          HD2       ARG  58  -5.569  -5.546  -7.992
  463   2HD   ARG  58          HD1       ARG  58  -6.866  -5.221  -6.825
  464    HE   ARG  58           HE       ARG  58  -8.483  -5.987  -8.567
  465   1HH1  ARG  58          HH2       ARG  58  -6.594  -8.272  -7.860
  466   2HH1  ARG  58          HH2       ARG  58  -6.202  -8.880  -9.434
  467   1HH2  ARG  58          HH1       ARG  58  -7.342  -6.062 -11.099
  468   2HH2  ARG  58          HH1       ARG  58  -6.627  -7.631 -11.266
  469    H    TYR  59           HN       TYR  59  -4.158  -1.915  -6.236
  470    HA   TYR  59           HA       TYR  59  -6.265  -2.043  -4.269
  471   1HB   TYR  59          HB2       TYR  59  -3.284  -1.541  -4.267
  472   2HB   TYR  59          HB1       TYR  59  -4.219  -1.491  -2.779
  473    HD1  TYR  59           HD1      TYR  59  -5.365  -3.823  -5.357
  474    HD2  TYR  59           HD2      TYR  59  -2.784  -3.358  -1.951
  475    HE1  TYR  59           HE1      TYR  59  -5.189  -6.286  -5.142
  476    HE2  TYR  59           HE2      TYR  59  -2.615  -5.822  -1.738
  477    HH   TYR  59           HH       TYR  59  -3.971  -7.961  -4.176
  478    H    MET  60           HN       MET  60  -3.901   0.502  -5.093
  479    HA   MET  60           HA       MET  60  -4.780   2.586  -3.455
  480   1HB   MET  60          HB2       MET  60  -3.128   2.189  -5.713
  481   2HB   MET  60          HB1       MET  60  -4.168   3.562  -6.073
  482   1HG   MET  60          HG2       MET  60  -3.381   4.809  -4.250
  483   2HG   MET  60          HG1       MET  60  -2.825   3.370  -3.394
  484   1HE   MET  60          HE1       MET  60  -1.512   1.840  -4.215
  485   2HE   MET  60          HE2       MET  60   0.182   2.307  -4.334
  486   3HE   MET  60          HE3       MET  60  -0.702   1.849  -5.787
  487    H    LYS  61           HN       LYS  61  -6.186   1.388  -6.458
  488    HA   LYS  61           HA       LYS  61  -7.992   3.502  -7.051
  489   1HB   LYS  61          HB2       LYS  61  -7.314   0.987  -8.011
  490   2HB   LYS  61          HB1       LYS  61  -8.989   0.773  -7.494
  491   1HG   LYS  61          HG2       LYS  61  -8.682   3.302  -8.867
  492   2HG   LYS  61          HG1       LYS  61  -8.096   1.980  -9.878
  493   1HD   LYS  61          HD2       LYS  61 -10.327   1.852 -10.417
  494   2HD   LYS  61          HD1       LYS  61 -10.349   0.831  -8.979
  495   1HE   LYS  61          HE2       LYS  61 -12.027   2.287  -8.351
  496   2HE   LYS  61          HE1       LYS  61 -10.652   3.281  -7.826
  497   1HZ   LYS  61          HZ1       LYS  61 -12.025   3.374 -10.457
  498   2HZ   LYS  61          HZ2       LYS  61 -10.569   4.182 -10.124
  499   3HZ   LYS  61          HZ3       LYS  61 -11.985   4.599  -9.286
  500    H    ASN  62           HN       ASN  62  -8.523   0.532  -5.110
  501    HA   ASN  62           HA       ASN  62 -11.194   1.272  -4.281
  502   1HB   ASN  62          HB2       ASN  62 -10.365  -1.034  -4.336
  503   2HB   ASN  62          HB1       ASN  62  -9.111  -0.635  -3.161
  504   1HD2  ASN  62          HD2       ASN  62 -10.554  -2.602  -2.170
  505   2HD2  ASN  62          HD2       ASN  62 -11.763  -2.088  -1.093
  506    H    LEU  63           HN       LEU  63  -7.976   1.521  -2.767
  507    HA   LEU  63           HA       LEU  63  -8.654   2.474  -0.220
  508   1HB   LEU  63          HB2       LEU  63  -6.405   2.656  -2.135
  509   2HB   LEU  63          HB1       LEU  63  -6.405   3.886  -0.868
  510    HG   LEU  63           HG       LEU  63  -6.960   1.067  -0.061
  511   1HD1  LEU  63          HD1       LEU  63  -4.103   1.819  -0.094
  512   2HD1  LEU  63          HD1       LEU  63  -4.800   1.498  -1.681
  513   3HD1  LEU  63          HD1       LEU  63  -4.860   0.262  -0.425
  514   1HD2  LEU  63          HD2       LEU  63  -5.461   3.429   1.113
  515   2HD2  LEU  63          HD2       LEU  63  -5.586   1.857   1.899
  516   3HD2  LEU  63          HD2       LEU  63  -7.037   2.818   1.617
  517    H    ASP  64           HN       ASP  64  -8.541   4.228  -3.293
  518    HA   ASP  64           HA       ASP  64  -8.862   6.874  -2.202
  519   1HB   ASP  64          HB2       ASP  64  -8.133   5.999  -4.548
  520   2HB   ASP  64          HB1       ASP  64  -9.863   5.943  -4.891
  521    H    ALA  65           HN       ALA  65 -11.164   4.385  -3.283
  522    HA   ALA  65           HA       ALA  65 -13.557   5.907  -3.213
  523   1HB   ALA  65          HB1       ALA  65 -13.419   3.667  -4.136
  524   2HB   ALA  65          HB2       ALA  65 -14.574   3.631  -2.806
  525   3HB   ALA  65          HB3       ALA  65 -12.942   3.007  -2.573
  526    H    LYS  66           HN       LYS  66 -11.583   4.636  -0.610
  527    HA   LYS  66           HA       LYS  66 -13.402   4.501   1.531
  528   1HB   LYS  66          HB2       LYS  66 -10.931   3.935   1.440
  529   2HB   LYS  66          HB1       LYS  66 -10.601   5.660   1.599
  530   1HG   LYS  66          HG2       LYS  66 -10.532   4.961   3.826
  531   2HG   LYS  66          HG1       LYS  66 -12.205   5.497   3.670
  532   1HD   LYS  66          HD2       LYS  66 -13.038   3.315   3.586
  533   2HD   LYS  66          HD1       LYS  66 -11.494   2.643   3.057
  534   1HE   LYS  66          HE2       LYS  66 -10.583   3.375   5.361
  535   2HE   LYS  66          HE1       LYS  66 -12.285   3.547   5.831
  536   1HZ   LYS  66          HZ1       LYS  66 -10.880   1.127   4.874
  537   2HZ   LYS  66          HZ2       LYS  66 -12.571   1.261   4.779
  538   3HZ   LYS  66          HZ3       LYS  66 -11.795   1.324   6.290
  539    H    GLN  67           HN       GLN  67 -12.166   7.308  -0.156
  540    HA   GLN  67           HA       GLN  67 -13.216   9.164   1.917
  541   1HB   GLN  67          HB2       GLN  67 -11.021   9.128   0.226
  542   2HB   GLN  67          HB1       GLN  67 -12.117  10.249  -0.582
  543   1HG   GLN  67          HG2       GLN  67 -11.675  11.844   0.941
  544   2HG   GLN  67          HG1       GLN  67 -12.135  10.761   2.256
  545   1HE2  GLN  67          HE2       GLN  67 -10.395   9.299   3.110
  546   2HE2  GLN  67          HE2       GLN  67  -8.769   9.762   2.957
  547    H    LYS  68           HN       LYS  68 -15.414   7.992   1.053
  548    HA   LYS  68           HA       LYS  68 -16.565   9.873  -0.978
  549   1HB   LYS  68          HB2       LYS  68 -16.305   6.938  -0.947
  550   2HB   LYS  68          HB1       LYS  68 -17.932   7.506  -1.320
  551   1HG   LYS  68          HG2       LYS  68 -16.484   9.202  -2.860
  552   2HG   LYS  68          HG1       LYS  68 -15.429   7.788  -2.885
  553   1HD   LYS  68          HD2       LYS  68 -18.216   7.027  -3.223
  554   2HD   LYS  68          HD1       LYS  68 -17.713   8.185  -4.457
  555   1HE   LYS  68          HE2       LYS  68 -15.974   6.772  -5.240
  556   2HE   LYS  68          HE1       LYS  68 -16.014   5.773  -3.774
  557   1HZ   LYS  68          HZ1       LYS  68 -18.407   5.312  -4.377
  558   2HZ   LYS  68          HZ2       LYS  68 -17.239   4.581  -5.373
  559   3HZ   LYS  68          HZ3       LYS  68 -18.066   5.968  -5.904
  560    H    LYS  69           HN       LYS  69 -18.703  10.521  -0.531
  561    HA   LYS  69           HA       LYS  69 -19.862   9.517   2.049
  562   1HB   LYS  69          HB2       LYS  69 -18.853  11.866   1.922
  563   2HB   LYS  69          HB1       LYS  69 -20.176  12.270   0.827
  564   1HG   LYS  69          HG2       LYS  69 -21.056  12.889   2.904
  565   2HG   LYS  69          HG1       LYS  69 -21.692  11.256   2.703
  566   1HD   LYS  69          HD2       LYS  69 -20.374  10.393   4.362
  567   2HD   LYS  69          HD1       LYS  69 -19.018  11.451   3.973
  568   1HE   LYS  69          HE2       LYS  69 -21.533  12.585   5.207
  569   2HE   LYS  69          HE1       LYS  69 -20.256  11.882   6.219
  570   1HZ   LYS  69          HZ1       LYS  69 -19.929  14.283   5.769
  571   2HZ   LYS  69          HZ2       LYS  69 -19.786  13.926   4.114
  572   3HZ   LYS  69          HZ3       LYS  69 -18.645  13.320   5.217
  573    H    ALA  70           HN       ALA  70 -20.975   7.936   0.509
  574    HA   ALA  70           HA       ALA  70 -22.899   7.267  -0.692
  575   1HB   ALA  70          HB1       ALA  70 -24.307   9.771   0.035
  576   2HB   ALA  70          HB2       ALA  70 -23.582   8.903   1.389
  577   3HB   ALA  70          HB3       ALA  70 -24.760   8.096   0.354
  578    H    SER  71           HN       SER  71 -21.053   8.416  -2.376
  579    HA   SER  71           HA       SER  71 -22.083  10.687  -3.853
  580   1HB   SER  71          HB2       SER  71 -19.774   8.972  -3.759
  581   2HB   SER  71          HB1       SER  71 -20.312   9.134  -5.429
  582    HG   SER  71           HG       SER  71 -20.010  11.328  -3.660
  583    HA   PRO  72           HA       PRO  72 -23.437   7.416  -7.037
  584   1HB   PRO  72          HB2       PRO  72 -23.243   4.773  -6.394
  585   2HB   PRO  72          HB1       PRO  72 -21.925   5.682  -7.158
  586   1HG   PRO  72          HG2       PRO  72 -22.273   4.874  -4.331
  587   2HG   PRO  72          HG1       PRO  72 -20.800   4.996  -5.301
  588   1HD   PRO  72          HD2       PRO  72 -21.609   6.856  -3.440
  589   2HD   PRO  72          HD1       PRO  72 -20.504   7.193  -4.790
  590    H    ARG  73           HN       ARG  73 -23.962   6.386  -3.677
  591    HA   ARG  73           HA       ARG  73 -26.894   6.582  -4.109
  592   1HB   ARG  73          HB2       ARG  73 -25.478   4.168  -4.249
  593   2HB   ARG  73          HB1       ARG  73 -26.174   4.176  -2.627
  594   1HG   ARG  73          HG2       ARG  73 -28.268   5.106  -4.154
  595   2HG   ARG  73          HG1       ARG  73 -27.512   3.935  -5.235
  596   1HD   ARG  73          HD2       ARG  73 -29.228   2.854  -3.794
  597   2HD   ARG  73          HD1       ARG  73 -27.609   2.225  -3.429
  598    HE   ARG  73           HE       ARG  73 -27.926   4.459  -1.769
  599   1HH1  ARG  73          HH1       ARG  73 -27.823   1.328  -1.221
  600   2HH1  ARG  73          HH1       ARG  73 -29.135   1.211  -0.097
  601   1HH2  ARG  73          HH2       ARG  73 -30.359   4.381  -0.791
  602   2HH2  ARG  73          HH2       ARG  73 -30.571   2.939   0.145
  Start of MODEL   15
    1   1H    VAL   1          HT1       VAL   1  -6.358   7.367   7.142
    2   2H    VAL   1          HT2       VAL   1  -6.814   6.143   8.226
    3   3H    VAL   1          HT3       VAL   1  -6.397   5.752   6.626
    4    HA   VAL   1           HA       VAL   1  -4.607   6.633   8.821
    5    HB   VAL   1           HB       VAL   1  -4.797   4.280   6.914
    6   1HG1  VAL   1          HG1       VAL   1  -2.486   4.504   7.272
    7   2HG1  VAL   1          HG1       VAL   1  -2.971   3.409   8.567
    8   3HG1  VAL   1          HG1       VAL   1  -2.705   5.118   8.911
    9   1HG2  VAL   1          HG2       VAL   1  -5.119   3.054   9.119
   10   2HG2  VAL   1          HG2       VAL   1  -6.452   4.114   8.652
   11   3HG2  VAL   1          HG2       VAL   1  -5.298   4.636   9.880
   12    H    VAL   2           HN       VAL   2  -3.402   8.358   8.063
   13    HA   VAL   2           HA       VAL   2  -2.308   8.150   5.274
   14    HB   VAL   2           HB       VAL   2  -3.965   9.982   5.723
   15   1HG1  VAL   2          HG1       VAL   2  -2.916  10.210   8.165
   16   2HG1  VAL   2          HG1       VAL   2  -3.659  11.588   7.357
   17   3HG1  VAL   2          HG1       VAL   2  -1.904  11.408   7.357
   18   1HG2  VAL   2          HG2       VAL   2  -2.735  11.636   4.559
   19   2HG2  VAL   2          HG2       VAL   2  -1.950  10.121   4.110
   20   3HG2  VAL   2          HG2       VAL   2  -1.217  11.167   5.327
   21    H    ILE   3           HN       ILE   3  -0.274   7.470   5.440
   22    HA   ILE   3           HA       ILE   3   1.425   7.790   7.735
   23    HB   ILE   3           HB       ILE   3   1.629   5.946   6.198
   24   1HG1  ILE   3          HG1       ILE   3   4.059   7.473   5.410
   25   2HG1  ILE   3          HG1       ILE   3   3.750   7.290   7.136
   26   1HG2  ILE   3          HG2       ILE   3   1.700   8.132   4.165
   27   2HG2  ILE   3          HG2       ILE   3   0.871   6.580   4.116
   28   3HG2  ILE   3          HG2       ILE   3   2.605   6.661   3.818
   29   1HD1  ILE   3          HD1       ILE   3   3.279   4.770   6.402
   30   2HD1  ILE   3          HD1       ILE   3   4.913   5.331   6.754
   31   3HD1  ILE   3          HD1       ILE   3   4.364   5.208   5.083
   32    HA   PRO   4           HA       PRO   4   2.881  11.865   6.630
   33   1HB   PRO   4          HB2       PRO   4   4.458  12.242   8.821
   34   2HB   PRO   4          HB1       PRO   4   2.688  12.323   8.883
   35   1HG   PRO   4          HG2       PRO   4   4.488  10.278   9.932
   36   2HG   PRO   4          HG1       PRO   4   2.801  10.608  10.337
   37   1HD   PRO   4          HD2       PRO   4   3.857   8.563   8.605
   38   2HD   PRO   4          HD1       PRO   4   2.170   8.853   9.080
   39    H    SER   5           HN       SER   5   5.349   9.666   8.002
   40    HA   SER   5           HA       SER   5   7.303  10.737   6.001
   41   1HB   SER   5          HB2       SER   5   7.358  10.026   8.855
   42   2HB   SER   5          HB1       SER   5   8.722   9.386   7.947
   43    HG   SER   5           HG       SER   5   9.419  11.365   8.319
   44    HA   PRO   6           HA       PRO   6   6.351   6.203   5.105
   45   1HB   PRO   6          HB2       PRO   6   5.717   6.573   2.467
   46   2HB   PRO   6          HB1       PRO   6   4.520   6.609   3.769
   47   1HG   PRO   6          HG2       PRO   6   5.877   8.870   2.385
   48   2HG   PRO   6          HG1       PRO   6   4.180   8.696   2.858
   49   1HD   PRO   6          HD2       PRO   6   5.899  10.183   4.291
   50   2HD   PRO   6          HD1       PRO   6   4.590   9.257   5.059
   51    H    CYS   7           HN       CYS   7   8.092   4.975   4.465
   52    HA   CYS   7           HA       CYS   7   9.787   5.583   2.214
   53   1HB   CYS   7          HB2       CYS   7  10.234   7.032   4.634
   54   2HB   CYS   7          HB1       CYS   7  11.573   5.900   4.445
   55    H    CYS   8           HN       CYS   8  10.097   3.438   1.678
   56    HA   CYS   8           HA       CYS   8  10.731   1.496   3.861
   57   1HB   CYS   8          HB2       CYS   8  10.030  -0.171   2.180
   58   2HB   CYS   8          HB1       CYS   8   8.791   1.068   2.381
   59    H    MET   9           HN       MET   9  12.289  -0.315   3.019
   60    HA   MET   9           HA       MET   9  14.553   0.985   1.540
   61   1HB   MET   9          HB2       MET   9  16.030  -0.247   3.055
   62   2HB   MET   9          HB1       MET   9  14.866   0.681   4.000
   63   1HG   MET   9          HG2       MET   9  13.433  -1.410   4.101
   64   2HG   MET   9          HG1       MET   9  14.790  -2.285   3.392
   65   1HE   MET   9          HE1       MET   9  15.927  -3.499   4.363
   66   2HE   MET   9          HE2       MET   9  15.827  -3.858   6.084
   67   3HE   MET   9          HE3       MET   9  17.210  -2.966   5.457
   68    H    PHE  10           HN       PHE  10  12.412  -1.728   1.713
   69    HA   PHE  10           HA       PHE  10  13.943  -3.032  -0.504
   70   1HB   PHE  10          HB2       PHE  10  13.592  -5.184   0.566
   71   2HB   PHE  10          HB1       PHE  10  14.299  -4.097   1.760
   72    HD1  PHE  10           HD1      PHE  10  11.135  -5.673   0.612
   73    HD2  PHE  10           HD2      PHE  10  13.075  -3.427   3.718
   74    HE1  PHE  10           HE1      PHE  10   9.187  -6.046   2.100
   75    HE2  PHE  10           HE2      PHE  10  11.127  -3.800   5.206
   76    HZ   PHE  10           HZ       PHE  10   9.181  -5.108   4.397
   77    H    PHE  11           HN       PHE  11  12.608  -3.810  -2.173
   78    HA   PHE  11           HA       PHE  11   9.786  -2.990  -2.085
   79   1HB   PHE  11          HB2       PHE  11  11.836  -3.573  -4.037
   80   2HB   PHE  11          HB1       PHE  11  10.392  -4.513  -4.409
   81    HD1  PHE  11           HD1      PHE  11  11.787  -1.889  -5.701
   82    HD2  PHE  11           HD2      PHE  11   8.286  -2.654  -3.331
   83    HE1  PHE  11           HE1      PHE  11  10.707   0.137  -6.635
   84    HE2  PHE  11           HE2      PHE  11   7.213  -0.627  -4.260
   85    HZ   PHE  11           HZ       PHE  11   8.420   0.771  -5.915
   86    H    VAL  12           HN       VAL  12   8.021  -4.421  -2.066
   87    HA   VAL  12           HA       VAL  12   8.143  -6.821  -0.632
   88    HB   VAL  12           HB       VAL  12   5.913  -7.237  -1.764
   89   1HG1  VAL  12          HG1       VAL  12   5.316  -5.913  -0.043
   90   2HG1  VAL  12          HG1       VAL  12   5.345  -4.565  -1.178
   91   3HG1  VAL  12          HG1       VAL  12   6.772  -4.934  -0.209
   92   1HG2  VAL  12          HG2       VAL  12   6.211  -4.588  -3.127
   93   2HG2  VAL  12          HG2       VAL  12   5.192  -5.958  -3.559
   94   3HG2  VAL  12          HG2       VAL  12   6.917  -5.997  -3.911
   95    H    SER  13           HN       SER  13   8.454  -8.997  -1.202
   96    HA   SER  13           HA       SER  13  10.026  -9.647  -3.503
   97   1HB   SER  13          HB2       SER  13   9.900 -10.917  -1.357
   98   2HB   SER  13          HB1       SER  13   8.253 -11.399  -1.762
   99    HG   SER  13           HG       SER  13  10.485 -11.882  -3.443
  100    H    LYS  14           HN       LYS  14   6.577  -9.469  -2.952
  101    HA   LYS  14           HA       LYS  14   6.034  -9.722  -5.818
  102   1HB   LYS  14          HB2       LYS  14   4.608 -11.737  -5.525
  103   2HB   LYS  14          HB1       LYS  14   6.288 -12.069  -5.108
  104   1HG   LYS  14          HG2       LYS  14   5.810 -12.399  -2.907
  105   2HG   LYS  14          HG1       LYS  14   4.632 -11.086  -2.867
  106   1HD   LYS  14          HD2       LYS  14   3.157 -12.834  -2.688
  107   2HD   LYS  14          HD1       LYS  14   3.297 -12.817  -4.447
  108   1HE   LYS  14          HE2       LYS  14   5.465 -14.363  -3.725
  109   2HE   LYS  14          HE1       LYS  14   4.242 -14.837  -2.528
  110   1HZ   LYS  14          HZ1       LYS  14   4.130 -16.030  -4.735
  111   2HZ   LYS  14          HZ2       LYS  14   3.624 -14.557  -5.411
  112   3HZ   LYS  14          HZ3       LYS  14   2.688 -15.311  -4.209
  113    H    ARG  15           HN       ARG  15   3.363 -10.018  -5.869
  114    HA   ARG  15           HA       ARG  15   2.346  -7.579  -4.714
  115   1HB   ARG  15          HB2       ARG  15   0.228  -8.409  -5.704
  116   2HB   ARG  15          HB1       ARG  15   1.575  -8.610  -6.824
  117   1HG   ARG  15          HG2       ARG  15   1.300 -10.908  -5.058
  118   2HG   ARG  15          HG1       ARG  15  -0.173 -10.614  -5.982
  119   1HD   ARG  15          HD2       ARG  15   1.918 -10.237  -7.829
  120   2HD   ARG  15          HD1       ARG  15   2.353 -11.694  -6.911
  121    HE   ARG  15           HE       ARG  15  -0.364 -11.994  -7.395
  122   1HH1  ARG  15          HH2       ARG  15   2.449 -12.961  -8.779
  123   2HH1  ARG  15          HH2       ARG  15   1.850 -13.109 -10.397
  124   1HH2  ARG  15          HH1       ARG  15  -1.153 -11.518  -9.716
  125   2HH2  ARG  15          HH1       ARG  15  -0.188 -12.290 -10.928
  126    H    ILE  16           HN       ILE  16  -0.231  -8.456  -3.825
  127    HA   ILE  16           HA       ILE  16   0.297 -10.186  -1.457
  128    HB   ILE  16           HB       ILE  16  -1.206  -7.685  -0.887
  129   1HG1  ILE  16          HG1       ILE  16   1.777  -7.614  -1.472
  130   2HG1  ILE  16          HG1       ILE  16   0.522  -6.675  -2.277
  131   1HG2  ILE  16          HG2       ILE  16   0.947  -8.109   0.896
  132   2HG2  ILE  16          HG2       ILE  16   0.338  -9.704   0.471
  133   3HG2  ILE  16          HG2       ILE  16  -0.753  -8.498   1.154
  134   1HD1  ILE  16          HD1       ILE  16   1.806  -5.378  -0.536
  135   2HD1  ILE  16          HD1       ILE  16   1.145  -6.463   0.687
  136   3HD1  ILE  16          HD1       ILE  16   0.067  -5.427  -0.248
  137    HA   PRO  17           HA       PRO  17  -3.941 -11.144  -2.295
  138   1HB   PRO  17          HB2       PRO  17  -4.661 -12.300   0.068
  139   2HB   PRO  17          HB1       PRO  17  -3.558 -13.068  -1.089
  140   1HG   PRO  17          HG2       PRO  17  -2.987 -11.902   1.514
  141   2HG   PRO  17          HG1       PRO  17  -2.011 -12.995   0.531
  142   1HD   PRO  17          HD2       PRO  17  -1.751 -10.143   0.844
  143   2HD   PRO  17          HD1       PRO  17  -0.695 -11.261  -0.047
  144    H    GLU  18           HN       GLU  18  -5.475  -9.522  -2.438
  145    HA   GLU  18           HA       GLU  18  -5.861  -7.309  -0.807
  146   1HB   GLU  18          HB2       GLU  18  -6.910  -7.985  -3.048
  147   2HB   GLU  18          HB1       GLU  18  -8.112  -8.863  -2.099
  148   1HG   GLU  18          HG2       GLU  18  -8.073  -6.426  -0.831
  149   2HG   GLU  18          HG1       GLU  18  -7.804  -5.962  -2.511
  150    H    ASN  19           HN       ASN  19  -6.885 -10.608  -0.164
  151    HA   ASN  19           HA       ASN  19  -8.855 -10.004   1.863
  152   1HB   ASN  19          HB2       ASN  19  -7.151 -12.391   1.124
  153   2HB   ASN  19          HB1       ASN  19  -8.317 -12.455   2.446
  154   1HD2  ASN  19          HD2       ASN  19  -8.790 -14.136   0.280
  155   2HD2  ASN  19          HD2       ASN  19 -10.099 -13.559  -0.634
  156    H    ARG  20           HN       ARG  20  -5.422  -9.778   1.870
  157    HA   ARG  20           HA       ARG  20  -5.329  -9.963   4.852
  158   1HB   ARG  20          HB2       ARG  20  -3.304 -10.260   2.627
  159   2HB   ARG  20          HB1       ARG  20  -2.846 -10.193   4.324
  160   1HG   ARG  20          HG2       ARG  20  -4.731 -12.059   4.539
  161   2HG   ARG  20          HG1       ARG  20  -4.324 -12.325   2.844
  162   1HD   ARG  20          HD2       ARG  20  -1.845 -12.327   3.680
  163   2HD   ARG  20          HD1       ARG  20  -2.564 -12.640   5.272
  164    HE   ARG  20           HE       ARG  20  -3.775 -14.579   4.147
  165   1HH1  ARG  20          HH1       ARG  20  -0.754 -15.002   4.461
  166   2HH1  ARG  20          HH1       ARG  20  -0.354 -15.647   2.905
  167   1HH2  ARG  20          HH2       ARG  20  -3.326 -14.649   1.427
  168   2HH2  ARG  20          HH2       ARG  20  -1.809 -15.448   1.188
  169    H    VAL  21           HN       VAL  21  -4.546  -7.946   2.064
  170    HA   VAL  21           HA       VAL  21  -3.120  -5.893   3.510
  171    HB   VAL  21           HB       VAL  21  -4.706  -5.689   0.933
  172   1HG1  VAL  21          HG1       VAL  21  -3.963  -3.555   1.147
  173   2HG1  VAL  21          HG1       VAL  21  -2.397  -4.220   0.686
  174   3HG1  VAL  21          HG1       VAL  21  -2.792  -3.992   2.390
  175   1HG2  VAL  21          HG2       VAL  21  -1.883  -6.125   0.556
  176   2HG2  VAL  21          HG2       VAL  21  -3.232  -7.097  -0.033
  177   3HG2  VAL  21          HG2       VAL  21  -2.538  -7.425   1.556
  178    H    VAL  22           HN       VAL  22  -3.913  -3.805   4.164
  179    HA   VAL  22           HA       VAL  22  -6.881  -3.614   4.428
  180    HB   VAL  22           HB       VAL  22  -6.338  -2.533   6.633
  181   1HG1  VAL  22          HG1       VAL  22  -6.239  -5.290   5.889
  182   2HG1  VAL  22          HG1       VAL  22  -6.809  -4.582   7.401
  183   3HG1  VAL  22          HG1       VAL  22  -5.110  -5.021   7.217
  184   1HG2  VAL  22          HG2       VAL  22  -4.015  -1.885   6.146
  185   2HG2  VAL  22          HG2       VAL  22  -3.566  -3.585   6.034
  186   3HG2  VAL  22          HG2       VAL  22  -4.089  -2.914   7.573
  187    H    SER  23           HN       SER  23  -3.803  -1.872   4.238
  188    HA   SER  23           HA       SER  23  -4.948   0.273   2.650
  189   1HB   SER  23          HB2       SER  23  -5.921   0.742   4.852
  190   2HB   SER  23          HB1       SER  23  -4.325   0.680   5.589
  191    HG   SER  23           HG       SER  23  -5.343   2.816   4.870
  192    H    TYR  24           HN       TYR  24  -3.247   1.599   1.808
  193    HA   TYR  24           HA       TYR  24  -0.526   0.588   2.405
  194   1HB   TYR  24          HB2       TYR  24  -0.029   1.429   0.204
  195   2HB   TYR  24          HB1       TYR  24  -1.573   0.590   0.114
  196    HD1  TYR  24           HD1      TYR  24   0.058   3.918   0.210
  197    HD2  TYR  24           HD2      TYR  24  -3.630   1.778  -0.306
  198    HE1  TYR  24           HE1      TYR  24  -1.027   5.986  -0.624
  199    HE2  TYR  24           HE2      TYR  24  -4.714   3.845  -1.141
  200    HH   TYR  24           HH       TYR  24  -4.251   6.430  -0.789
  201    H    GLN  25           HN       GLN  25   1.066   2.497   1.660
  202    HA   GLN  25           HA       GLN  25   0.439   5.085   2.951
  203   1HB   GLN  25          HB2       GLN  25   2.567   3.087   3.795
  204   2HB   GLN  25          HB1       GLN  25   2.630   4.786   4.257
  205   1HG   GLN  25          HG2       GLN  25   1.454   4.018   6.070
  206   2HG   GLN  25          HG1       GLN  25   0.088   4.235   4.975
  207   1HE2  GLN  25          HE2       GLN  25  -1.087   2.448   6.015
  208   2HE2  GLN  25          HE2       GLN  25  -0.630   0.835   5.747
  209    H    LEU  26           HN       LEU  26   0.751   6.029   0.862
  210    HA   LEU  26           HA       LEU  26   2.756   5.283  -0.987
  211   1HB   LEU  26          HB2       LEU  26   0.863   7.486  -0.525
  212   2HB   LEU  26          HB1       LEU  26   2.272   7.947  -1.480
  213    HG   LEU  26           HG       LEU  26   0.414   5.617  -2.052
  214   1HD1  LEU  26          HD1       LEU  26   0.282   7.149  -4.241
  215   2HD1  LEU  26          HD1       LEU  26   0.668   8.411  -3.071
  216   3HD1  LEU  26          HD1       LEU  26  -0.775   7.423  -2.856
  217   1HD2  LEU  26          HD2       LEU  26   3.022   6.529  -3.249
  218   2HD2  LEU  26          HD2       LEU  26   1.829   5.710  -4.257
  219   3HD2  LEU  26          HD2       LEU  26   2.500   4.896  -2.847
  220    H    SER  27           HN       SER  27   4.860   5.852  -1.278
  221    HA   SER  27           HA       SER  27   6.076   7.786   0.653
  222   1HB   SER  27          HB2       SER  27   6.651   5.479   1.205
  223   2HB   SER  27          HB1       SER  27   7.093   5.156  -0.468
  224    HG   SER  27           HG       SER  27   8.318   7.200   1.057
  225    H    SER  28           HN       SER  28   7.793   9.092  -0.245
  226    HA   SER  28           HA       SER  28   8.736   8.758  -2.967
  227   1HB   SER  28          HB2       SER  28   6.365   9.421  -3.323
  228   2HB   SER  28          HB1       SER  28   6.654  10.897  -2.405
  229    HG   SER  28           HG       SER  28   7.624  11.724  -4.078
  230    H    ARG  29           HN       ARG  29  10.776   9.227  -1.987
  231    HA   ARG  29           HA       ARG  29  11.180  12.117  -1.332
  232   1HB   ARG  29          HB2       ARG  29  11.525   9.703   0.343
  233   2HB   ARG  29          HB1       ARG  29  12.884  10.828   0.383
  234   1HG   ARG  29          HG2       ARG  29  10.519  12.394   0.513
  235   2HG   ARG  29          HG1       ARG  29  10.322  11.074   1.667
  236   1HD   ARG  29          HD2       ARG  29  11.895  11.936   3.064
  237   2HD   ARG  29          HD1       ARG  29  13.016  12.253   1.723
  238    HE   ARG  29           HE       ARG  29  10.647  14.022   2.190
  239   1HH1  ARG  29          HH1       ARG  29  13.085  14.745   3.772
  240   2HH1  ARG  29          HH1       ARG  29  13.893  15.850   2.712
  241   1HH2  ARG  29          HH2       ARG  29  12.086  14.900  -0.090
  242   2HH2  ARG  29          HH2       ARG  29  13.327  15.939   0.527
  243    H    SER  30           HN       SER  30  13.806  12.285  -1.012
  244    HA   SER  30           HA       SER  30  14.930  11.168  -3.544
  245   1HB   SER  30          HB2       SER  30  16.547  13.036  -3.245
  246   2HB   SER  30          HB1       SER  30  14.879  13.607  -3.236
  247    HG   SER  30           HG       SER  30  16.311  14.391  -1.505
  248    H    THR  31           HN       THR  31  15.796  11.678  -0.108
  249    HA   THR  31           HA       THR  31  18.244  10.119  -0.279
  250    HB   THR  31           HB       THR  31  17.907  10.303   2.297
  251    HG1  THR  31           HG1      THR  31  15.662  10.659   2.177
  252   1HG2  THR  31          HG2       THR  31  18.451  12.749   2.207
  253   2HG2  THR  31          HG2       THR  31  18.050  12.728   0.489
  254   3HG2  THR  31          HG2       THR  31  19.406  11.774   1.088
  255    H    CYS  32           HN       CYS  32  14.985   9.185  -0.270
  256    HA   CYS  32           HA       CYS  32  15.240   6.798   1.401
  257   1HB   CYS  32          HB2       CYS  32  13.199   8.361   0.561
  258   2HB   CYS  32          HB1       CYS  32  13.105   7.083  -0.652
  259    H    LEU  33           HN       LEU  33  13.796   5.070  -0.476
  260    HA   LEU  33           HA       LEU  33  16.029   4.379  -2.335
  261   1HB   LEU  33          HB2       LEU  33  14.330   2.851  -0.421
  262   2HB   LEU  33          HB1       LEU  33  14.767   2.035  -1.923
  263    HG   LEU  33           HG       LEU  33  17.182   2.845  -1.402
  264   1HD1  LEU  33          HD1       LEU  33  15.797   3.159   1.273
  265   2HD1  LEU  33          HD1       LEU  33  16.723   4.376   0.394
  266   3HD1  LEU  33          HD1       LEU  33  17.544   2.987   1.106
  267   1HD2  LEU  33          HD2       LEU  33  17.619   0.750  -0.524
  268   2HD2  LEU  33          HD2       LEU  33  15.966   0.482  -1.078
  269   3HD2  LEU  33          HD2       LEU  33  16.281   0.837   0.621
  270    H    LYS  34           HN       LYS  34  14.949   5.668  -4.004
  271    HA   LYS  34           HA       LYS  34  13.546   5.886  -5.892
  272   1HB   LYS  34          HB2       LYS  34  13.878   3.066  -5.266
  273   2HB   LYS  34          HB1       LYS  34  12.309   3.361  -6.013
  274   1HG   LYS  34          HG2       LYS  34  13.906   2.957  -7.783
  275   2HG   LYS  34          HG1       LYS  34  13.492   4.671  -7.809
  276   1HD   LYS  34          HD2       LYS  34  15.852   4.652  -7.974
  277   2HD   LYS  34          HD1       LYS  34  15.544   4.995  -6.272
  278   1HE   LYS  34          HE2       LYS  34  16.240   2.885  -5.578
  279   2HE   LYS  34          HE1       LYS  34  15.827   2.129  -7.132
  280   1HZ   LYS  34          HZ1       LYS  34  17.990   4.132  -6.741
  281   2HZ   LYS  34          HZ2       LYS  34  17.614   3.321  -8.186
  282   3HZ   LYS  34          HZ3       LYS  34  18.241   2.459  -6.863
  283    H    ALA  35           HN       ALA  35  11.130   5.671  -6.528
  284    HA   ALA  35           HA       ALA  35   9.508   6.326  -4.123
  285   1HB   ALA  35          HB1       ALA  35   8.790   7.935  -5.529
  286   2HB   ALA  35          HB2       ALA  35   8.120   6.695  -6.590
  287   3HB   ALA  35          HB3       ALA  35   9.777   7.251  -6.822
  288    H    GLY  36           HN       GLY  36   8.197   4.762  -3.310
  289   1HA   GLY  36          HA2       GLY  36   6.757   2.968  -5.167
  290   2HA   GLY  36          HA1       GLY  36   7.764   2.197  -3.942
  291    H    VAL  37           HN       VAL  37   5.228   1.491  -3.611
  292    HA   VAL  37           HA       VAL  37   4.000   3.450  -1.703
  293    HB   VAL  37           HB       VAL  37   2.860   0.960  -3.021
  294   1HG1  VAL  37          HG1       VAL  37   0.696   2.236  -2.490
  295   2HG1  VAL  37          HG1       VAL  37   1.684   3.253  -1.441
  296   3HG1  VAL  37          HG1       VAL  37   1.547   1.524  -1.118
  297   1HG2  VAL  37          HG2       VAL  37   2.801   2.172  -4.923
  298   2HG2  VAL  37          HG2       VAL  37   3.450   3.586  -4.094
  299   3HG2  VAL  37          HG2       VAL  37   1.710   3.293  -4.108
  300    H    ILE  38           HN       ILE  38   2.957   2.336   0.256
  301    HA   ILE  38           HA       ILE  38   4.546  -0.069   1.080
  302    HB   ILE  38           HB       ILE  38   3.978   2.532   2.512
  303   1HG1  ILE  38          HG1       ILE  38   6.526   2.015   3.020
  304   2HG1  ILE  38          HG1       ILE  38   6.373   0.958   1.617
  305   1HG2  ILE  38          HG2       ILE  38   4.130  -0.159   3.650
  306   2HG2  ILE  38          HG2       ILE  38   3.685   1.359   4.431
  307   3HG2  ILE  38          HG2       ILE  38   5.383   0.905   4.290
  308   1HD1  ILE  38          HD1       ILE  38   5.245   3.683   1.309
  309   2HD1  ILE  38          HD1       ILE  38   6.155   2.707   0.159
  310   3HD1  ILE  38          HD1       ILE  38   6.997   3.586   1.429
  311    H    PHE  39           HN       PHE  39   3.124  -1.727   1.354
  312    HA   PHE  39           HA       PHE  39   0.332  -1.069   2.162
  313   1HB   PHE  39          HB2       PHE  39   1.691  -3.311   0.694
  314   2HB   PHE  39          HB1       PHE  39   0.079  -3.537   1.369
  315    HD1  PHE  39           HD1      PHE  39  -1.842  -2.384   0.470
  316    HD2  PHE  39           HD2      PHE  39   2.094  -1.620  -1.061
  317    HE1  PHE  39           HE1      PHE  39  -2.828  -1.198  -1.467
  318    HE2  PHE  39           HE2      PHE  39   1.109  -0.428  -2.997
  319    HZ   PHE  39           HZ       PHE  39  -1.357  -0.218  -3.197
  320    H    THR  40           HN       THR  40  -0.543  -1.896   4.013
  321    HA   THR  40           HA       THR  40   1.260  -3.470   5.788
  322    HB   THR  40           HB       THR  40  -1.004  -1.511   6.246
  323    HG1  THR  40           HG1      THR  40   1.037  -0.626   5.930
  324   1HG2  THR  40          HG2       THR  40  -0.464  -1.929   8.719
  325   2HG2  THR  40          HG2       THR  40   0.321  -3.413   8.184
  326   3HG2  THR  40          HG2       THR  40  -1.403  -3.176   7.897
  327    H    THR  41           HN       THR  41   0.422  -5.387   6.700
  328    HA   THR  41           HA       THR  41  -2.005  -6.465   5.380
  329    HB   THR  41           HB       THR  41  -0.253  -7.988   7.271
  330    HG1  THR  41           HG1      THR  41   0.447  -7.015   4.715
  331   1HG2  THR  41          HG2       THR  41  -2.023  -9.240   6.296
  332   2HG2  THR  41          HG2       THR  41  -0.579  -9.691   5.391
  333   3HG2  THR  41          HG2       THR  41  -1.731  -8.549   4.701
  334    H    LYS  42           HN       LYS  42  -3.680  -7.496   6.698
  335    HA   LYS  42           HA       LYS  42  -4.535  -6.009   8.971
  336   1HB   LYS  42          HB2       LYS  42  -5.545  -7.886   7.241
  337   2HB   LYS  42          HB1       LYS  42  -5.425  -8.813   8.738
  338   1HG   LYS  42          HG2       LYS  42  -6.464  -6.219   9.364
  339   2HG   LYS  42          HG1       LYS  42  -7.400  -6.885   8.024
  340   1HD   LYS  42          HD2       LYS  42  -7.247  -9.087   9.567
  341   2HD   LYS  42          HD1       LYS  42  -7.148  -7.858  10.828
  342   1HE   LYS  42          HE2       LYS  42  -9.435  -7.872  10.699
  343   2HE   LYS  42          HE1       LYS  42  -9.186  -6.879   9.247
  344   1HZ   LYS  42          HZ1       LYS  42  -8.941  -8.966   7.974
  345   2HZ   LYS  42          HZ2       LYS  42 -10.489  -8.787   8.651
  346   3HZ   LYS  42          HZ3       LYS  42  -9.366  -9.843   9.364
  347    H    LYS  43           HN       LYS  43  -2.802  -9.099   8.714
  348    HA   LYS  43           HA       LYS  43  -2.822  -9.913  11.411
  349   1HB   LYS  43          HB2       LYS  43  -1.991 -11.226   9.501
  350   2HB   LYS  43          HB1       LYS  43  -0.640 -10.109   9.311
  351   1HG   LYS  43          HG2       LYS  43   0.539 -11.293  10.814
  352   2HG   LYS  43          HG1       LYS  43  -0.683 -10.937  12.037
  353   1HD   LYS  43          HD2       LYS  43  -1.287 -13.079  10.042
  354   2HD   LYS  43          HD1       LYS  43  -0.134 -13.447  11.324
  355   1HE   LYS  43          HE2       LYS  43  -2.805 -12.178  11.961
  356   2HE   LYS  43          HE1       LYS  43  -2.624 -13.938  11.826
  357   1HZ   LYS  43          HZ1       LYS  43  -1.038 -13.987  13.511
  358   2HZ   LYS  43          HZ2       LYS  43  -2.189 -12.886  14.099
  359   3HZ   LYS  43          HZ3       LYS  43  -0.737 -12.321  13.422
  360    H    GLY  44           HN       GLY  44  -0.454  -7.811   9.764
  361   1HA   GLY  44          HA2       GLY  44   0.055  -5.806  11.417
  362   2HA   GLY  44          HA1       GLY  44   0.716  -7.116  12.394
  363    H    GLN  45           HN       GLN  45   0.859  -6.687   8.866
  364    HA   GLN  45           HA       GLN  45   3.851  -6.706   9.099
  365   1HB   GLN  45          HB2       GLN  45   2.013  -8.401   7.782
  366   2HB   GLN  45          HB1       GLN  45   2.790  -7.456   6.511
  367   1HG   GLN  45          HG2       GLN  45   5.013  -8.029   7.661
  368   2HG   GLN  45          HG1       GLN  45   4.101  -9.229   8.578
  369   1HE2  GLN  45          HE2       GLN  45   5.804 -10.601   7.190
  370   2HE2  GLN  45          HE2       GLN  45   5.221 -11.169   5.702
  371    H    GLN  46           HN       GLN  46   4.948  -5.500   7.279
  372    HA   GLN  46           HA       GLN  46   3.287  -3.438   5.936
  373   1HB   GLN  46          HB2       GLN  46   4.875  -3.075   8.349
  374   2HB   GLN  46          HB1       GLN  46   5.450  -2.026   7.052
  375   1HG   GLN  46          HG2       GLN  46   3.242  -1.089   6.741
  376   2HG   GLN  46          HG1       GLN  46   2.540  -2.253   7.866
  377   1HE2  GLN  46          HE2       GLN  46   5.565  -0.327   8.194
  378   2HE2  GLN  46          HE2       GLN  46   5.090   0.454   9.623
  379    H    SER  47           HN       SER  47   4.012  -4.253   3.910
  380    HA   SER  47           HA       SER  47   6.969  -4.239   3.435
  381   1HB   SER  47          HB2       SER  47   4.720  -5.479   1.823
  382   2HB   SER  47          HB1       SER  47   6.445  -5.775   1.622
  383    HG   SER  47           HG       SER  47   6.450  -6.647   3.737
  384    H    CYS  48           HN       CYS  48   7.645  -3.387   1.275
  385    HA   CYS  48           HA       CYS  48   6.155  -0.916   0.608
  386   1HB   CYS  48          HB2       CYS  48   8.722  -1.302   1.009
  387   2HB   CYS  48          HB1       CYS  48   8.712  -1.869  -0.661
  388    H    GLY  49           HN       GLY  49   4.573  -1.123  -0.967
  389   1HA   GLY  49          HA2       GLY  49   4.772  -3.285  -2.961
  390   2HA   GLY  49          HA1       GLY  49   3.392  -2.218  -2.733
  391    H    ASP  50           HN       ASP  50   5.015  -2.929  -5.162
  392    HA   ASP  50           HA       ASP  50   6.238  -0.342  -5.906
  393   1HB   ASP  50          HB2       ASP  50   6.935  -1.611  -7.891
  394   2HB   ASP  50          HB1       ASP  50   7.262  -2.552  -6.438
  395    HA   PRO  51           HA       PRO  51   2.413   1.049  -7.685
  396   1HB   PRO  51          HB2       PRO  51   3.411   3.120  -9.173
  397   2HB   PRO  51          HB1       PRO  51   3.202   3.203  -7.412
  398   1HG   PRO  51          HG2       PRO  51   5.667   2.675  -9.000
  399   2HG   PRO  51          HG1       PRO  51   5.453   3.658  -7.543
  400   1HD   PRO  51          HD2       PRO  51   6.502   1.159  -7.487
  401   2HD   PRO  51          HD1       PRO  51   5.566   1.842  -6.141
  402    H    LYS  52           HN       LYS  52   5.256   0.300  -9.645
  403    HA   LYS  52           HA       LYS  52   4.067   0.376 -12.234
  404   1HB   LYS  52          HB2       LYS  52   5.926  -1.195 -12.776
  405   2HB   LYS  52          HB1       LYS  52   6.475   0.155 -11.781
  406   1HG   LYS  52          HG2       LYS  52   6.713  -1.158  -9.878
  407   2HG   LYS  52          HG1       LYS  52   5.539  -2.352 -10.432
  408   1HD   LYS  52          HD2       LYS  52   7.340  -3.595 -11.017
  409   2HD   LYS  52          HD1       LYS  52   7.485  -2.488 -12.383
  410   1HE   LYS  52          HE2       LYS  52   8.662  -1.401  -9.921
  411   2HE   LYS  52          HE1       LYS  52   9.450  -2.892 -10.476
  412   1HZ   LYS  52          HZ1       LYS  52   9.791  -1.996 -12.604
  413   2HZ   LYS  52          HZ2       LYS  52  10.239  -0.750 -11.540
  414   3HZ   LYS  52          HZ3       LYS  52   8.736  -0.697 -12.331
  415    H    GLN  53           HN       GLN  53   3.610  -1.808  -9.569
  416    HA   GLN  53           HA       GLN  53   2.552  -3.995 -11.225
  417   1HB   GLN  53          HB2       GLN  53   3.238  -3.426  -8.409
  418   2HB   GLN  53          HB1       GLN  53   1.901  -4.551  -8.637
  419   1HG   GLN  53          HG2       GLN  53   4.560  -4.823 -10.061
  420   2HG   GLN  53          HG1       GLN  53   4.183  -5.646  -8.548
  421   1HE2  GLN  53          HE2       GLN  53   2.986  -7.583  -8.691
  422   2HE2  GLN  53          HE2       GLN  53   2.283  -8.160 -10.124
  423    H    GLU  54           HN       GLU  54   0.293  -4.751 -10.888
  424    HA   GLU  54           HA       GLU  54  -1.569  -2.458 -10.874
  425   1HB   GLU  54          HB2       GLU  54  -1.484  -5.289 -11.792
  426   2HB   GLU  54          HB1       GLU  54  -3.074  -4.621 -11.424
  427   1HG   GLU  54          HG2       GLU  54  -1.528  -2.691 -12.913
  428   2HG   GLU  54          HG1       GLU  54  -1.560  -4.228 -13.778
  429    H    TRP  55           HN       TRP  55  -0.539  -4.857  -8.574
  430    HA   TRP  55           HA       TRP  55  -3.120  -4.995  -7.198
  431   1HB   TRP  55          HB2       TRP  55  -1.916  -6.367  -5.634
  432   2HB   TRP  55          HB1       TRP  55  -1.375  -6.797  -7.247
  433    HD1  TRP  55           HD1      TRP  55   1.123  -6.404  -7.845
  434    HE1  TRP  55           HE1      TRP  55   3.182  -5.717  -6.445
  435    HE3  TRP  55           HE3      TRP  55  -1.179  -4.766  -3.600
  436    HZ2  TRP  55           HZ2      TRP  55   3.765  -4.655  -3.896
  437    HZ3  TRP  55           HZ3      TRP  55   0.155  -3.929  -1.696
  438    HH2  TRP  55           HH2      TRP  55   2.630  -3.858  -1.836
  439    H    VAL  56           HN       VAL  56  -0.403  -2.828  -7.204
  440    HA   VAL  56           HA       VAL  56  -1.110  -1.639  -4.597
  441    HB   VAL  56           HB       VAL  56   0.690  -0.769  -6.894
  442   1HG1  VAL  56          HG1       VAL  56   0.539   1.284  -5.930
  443   2HG1  VAL  56          HG1       VAL  56   1.467   0.595  -4.599
  444   3HG1  VAL  56          HG1       VAL  56  -0.292   0.645  -4.515
  445   1HG2  VAL  56          HG2       VAL  56   2.224  -1.196  -4.634
  446   2HG2  VAL  56          HG2       VAL  56   2.030  -2.343  -5.959
  447   3HG2  VAL  56          HG2       VAL  56   1.013  -2.472  -4.523
  448    H    GLN  57           HN       GLN  57  -1.270  -0.763  -8.052
  449    HA   GLN  57           HA       GLN  57  -2.883   1.579  -7.800
  450   1HB   GLN  57          HB2       GLN  57  -1.752  -0.092  -9.804
  451   2HB   GLN  57          HB1       GLN  57  -3.478  -0.010 -10.160
  452   1HG   GLN  57          HG2       GLN  57  -2.612   2.613  -9.427
  453   2HG   GLN  57          HG1       GLN  57  -1.485   1.984 -10.631
  454   1HE2  GLN  57          HE2       GLN  57  -3.997   3.941 -10.655
  455   2HE2  GLN  57          HE2       GLN  57  -4.832   3.428 -12.041
  456    H    ARG  58           HN       ARG  58  -3.773  -1.854  -8.330
  457    HA   ARG  58           HA       ARG  58  -6.589  -1.588  -8.424
  458   1HB   ARG  58          HB2       ARG  58  -5.444  -3.661  -8.926
  459   2HB   ARG  58          HB1       ARG  58  -4.729  -3.717  -7.315
  460   1HG   ARG  58          HG2       ARG  58  -6.974  -3.985  -6.325
  461   2HG   ARG  58          HG1       ARG  58  -7.691  -3.934  -7.936
  462   1HD   ARG  58          HD2       ARG  58  -6.109  -5.912  -8.495
  463   2HD   ARG  58          HD1       ARG  58  -5.927  -6.075  -6.737
  464    HE   ARG  58           HE       ARG  58  -8.651  -5.857  -7.041
  465   1HH1  ARG  58          HH1       ARG  58  -6.236  -8.168  -7.461
  466   2HH1  ARG  58          HH1       ARG  58  -7.258  -9.349  -8.211
  467   1HH2  ARG  58          HH2       ARG  58  -9.982  -7.215  -8.461
  468   2HH2  ARG  58          HH2       ARG  58  -9.380  -8.809  -8.777
  469    H    TYR  59           HN       TYR  59  -4.601  -2.420  -5.556
  470    HA   TYR  59           HA       TYR  59  -6.623  -2.147  -3.586
  471   1HB   TYR  59          HB2       TYR  59  -3.632  -1.613  -3.569
  472   2HB   TYR  59          HB1       TYR  59  -4.603  -1.703  -2.107
  473    HD1  TYR  59           HD1      TYR  59  -5.971  -3.981  -4.479
  474    HD2  TYR  59           HD2      TYR  59  -2.682  -3.501  -1.752
  475    HE1  TYR  59           HE1      TYR  59  -5.665  -6.439  -4.393
  476    HE2  TYR  59           HE2      TYR  59  -2.383  -5.959  -1.673
  477    HH   TYR  59           HH       TYR  59  -3.469  -7.943  -2.133
  478    H    MET  60           HN       MET  60  -4.250   0.204  -4.755
  479    HA   MET  60           HA       MET  60  -5.051   2.476  -3.244
  480   1HB   MET  60          HB2       MET  60  -3.683   1.969  -5.883
  481   2HB   MET  60          HB1       MET  60  -3.916   3.610  -5.285
  482   1HG   MET  60          HG2       MET  60  -2.858   2.838  -3.100
  483   2HG   MET  60          HG1       MET  60  -2.397   1.361  -3.938
  484   1HE   MET  60          HE1       MET  60  -2.653   4.840  -3.737
  485   2HE   MET  60          HE2       MET  60  -1.782   5.545  -5.096
  486   3HE   MET  60          HE3       MET  60  -0.956   5.304  -3.558
  487    H    LYS  61           HN       LYS  61  -6.435   0.994  -6.121
  488    HA   LYS  61           HA       LYS  61  -8.033   3.298  -6.914
  489   1HB   LYS  61          HB2       LYS  61  -7.217   1.167  -8.225
  490   2HB   LYS  61          HB1       LYS  61  -8.670   0.425  -7.554
  491   1HG   LYS  61          HG2       LYS  61  -9.783   1.348  -9.290
  492   2HG   LYS  61          HG1       LYS  61  -9.558   2.897  -8.476
  493   1HD   LYS  61          HD2       LYS  61  -8.315   3.570 -10.225
  494   2HD   LYS  61          HD1       LYS  61  -7.116   2.356  -9.780
  495   1HE   LYS  61          HE2       LYS  61  -9.414   1.208 -11.205
  496   2HE   LYS  61          HE1       LYS  61  -8.503   2.384 -12.172
  497   1HZ   LYS  61          HZ1       LYS  61  -6.454   1.229 -11.239
  498   2HZ   LYS  61          HZ2       LYS  61  -7.329   0.397 -12.435
  499   3HZ   LYS  61          HZ3       LYS  61  -7.495  -0.036 -10.802
  500    H    ASN  62           HN       ASN  62  -8.709   0.232  -5.183
  501    HA   ASN  62           HA       ASN  62 -11.467   0.962  -4.594
  502   1HB   ASN  62          HB2       ASN  62 -10.444  -1.361  -4.809
  503   2HB   ASN  62          HB1       ASN  62  -9.675  -1.082  -3.247
  504   1HD2  ASN  62          HD2       ASN  62 -12.950  -0.971  -4.764
  505   2HD2  ASN  62          HD2       ASN  62 -13.771  -1.492  -3.373
  506    H    LEU  63           HN       LEU  63  -8.344   1.392  -3.075
  507    HA   LEU  63           HA       LEU  63  -9.287   2.047  -0.419
  508   1HB   LEU  63          HB2       LEU  63  -6.787   2.255  -2.055
  509   2HB   LEU  63          HB1       LEU  63  -6.875   3.193  -0.557
  510    HG   LEU  63           HG       LEU  63  -7.774   0.365  -0.399
  511   1HD1  LEU  63          HD1       LEU  63  -5.227   1.060  -1.539
  512   2HD1  LEU  63          HD1       LEU  63  -5.870  -0.542  -1.179
  513   3HD1  LEU  63          HD1       LEU  63  -4.970   0.342   0.052
  514   1HD2  LEU  63          HD2       LEU  63  -5.885   1.949   1.361
  515   2HD2  LEU  63          HD2       LEU  63  -6.840   0.533   1.801
  516   3HD2  LEU  63          HD2       LEU  63  -7.639   2.076   1.497
  517    H    ASP  64           HN       ASP  64  -8.817   3.842  -3.408
  518    HA   ASP  64           HA       ASP  64  -8.930   6.498  -2.267
  519   1HB   ASP  64          HB2       ASP  64  -8.928   5.152  -4.887
  520   2HB   ASP  64          HB1       ASP  64  -9.823   6.673  -4.874
  521    H    ALA  65           HN       ALA  65 -11.376   4.360  -3.764
  522    HA   ALA  65           HA       ALA  65 -13.541   6.282  -3.248
  523   1HB   ALA  65          HB1       ALA  65 -14.889   4.492  -4.306
  524   2HB   ALA  65          HB2       ALA  65 -13.501   3.407  -4.223
  525   3HB   ALA  65          HB3       ALA  65 -13.442   4.839  -5.252
  526    H    LYS  66           HN       LYS  66 -11.863   4.319  -1.195
  527    HA   LYS  66           HA       LYS  66 -14.239   3.319   0.294
  528   1HB   LYS  66          HB2       LYS  66 -12.333   1.821  -0.206
  529   2HB   LYS  66          HB1       LYS  66 -11.249   2.918   0.651
  530   1HG   LYS  66          HG2       LYS  66 -11.812   2.019   2.635
  531   2HG   LYS  66          HG1       LYS  66 -13.529   2.265   2.309
  532   1HD   LYS  66          HD2       LYS  66 -13.644   0.183   1.062
  533   2HD   LYS  66          HD1       LYS  66 -11.902  -0.044   1.211
  534   1HE   LYS  66          HE2       LYS  66 -12.031  -0.588   3.482
  535   2HE   LYS  66          HE1       LYS  66 -13.574   0.263   3.699
  536   1HZ   LYS  66          HZ1       LYS  66 -13.206  -2.138   1.988
  537   2HZ   LYS  66          HZ2       LYS  66 -14.673  -1.354   2.336
  538   3HZ   LYS  66          HZ3       LYS  66 -13.835  -2.179   3.562
  539    H    GLN  67           HN       GLN  67 -11.842   5.837   0.355
  540    HA   GLN  67           HA       GLN  67 -11.645   6.453   3.102
  541   1HB   GLN  67          HB2       GLN  67 -10.857   7.502   0.664
  542   2HB   GLN  67          HB1       GLN  67 -11.925   8.755   1.297
  543   1HG   GLN  67          HG2       GLN  67  -9.756   9.280   2.141
  544   2HG   GLN  67          HG1       GLN  67 -10.626   8.550   3.492
  545   1HE2  GLN  67          HE2       GLN  67  -8.126   8.215   4.058
  546   2HE2  GLN  67          HE2       GLN  67  -7.471   6.731   3.560
  547    H    LYS  68           HN       LYS  68 -14.056   7.656   0.736
  548    HA   LYS  68           HA       LYS  68 -15.596   9.076   2.759
  549   1HB   LYS  68          HB2       LYS  68 -15.332   9.060   0.009
  550   2HB   LYS  68          HB1       LYS  68 -16.913   8.312   0.239
  551   1HG   LYS  68          HG2       LYS  68 -17.780  10.197   1.351
  552   2HG   LYS  68          HG1       LYS  68 -16.176  10.837   1.712
  553   1HD   LYS  68          HD2       LYS  68 -15.811  11.230  -0.712
  554   2HD   LYS  68          HD1       LYS  68 -17.446  10.654  -1.036
  555   1HE   LYS  68          HE2       LYS  68 -17.533  12.657   1.046
  556   2HE   LYS  68          HE1       LYS  68 -16.689  13.298  -0.379
  557   1HZ   LYS  68          HZ1       LYS  68 -19.228  13.391  -0.388
  558   2HZ   LYS  68          HZ2       LYS  68 -19.171  11.711  -0.641
  559   3HZ   LYS  68          HZ3       LYS  68 -18.467  12.768  -1.768
  560    H    LYS  69           HN       LYS  69 -17.777   8.468   3.440
  561    HA   LYS  69           HA       LYS  69 -18.063   5.685   4.144
  562   1HB   LYS  69          HB2       LYS  69 -19.881   8.108   4.203
  563   2HB   LYS  69          HB1       LYS  69 -20.339   6.551   4.895
  564   1HG   LYS  69          HG2       LYS  69 -17.671   7.380   5.739
  565   2HG   LYS  69          HG1       LYS  69 -18.907   8.556   6.193
  566   1HD   LYS  69          HD2       LYS  69 -20.073   7.024   7.512
  567   2HD   LYS  69          HD1       LYS  69 -19.403   5.632   6.660
  568   1HE   LYS  69          HE2       LYS  69 -18.159   5.568   8.640
  569   2HE   LYS  69          HE1       LYS  69 -17.106   6.583   7.632
  570   1HZ   LYS  69          HZ1       LYS  69 -19.084   7.440   9.661
  571   2HZ   LYS  69          HZ2       LYS  69 -18.523   8.503   8.458
  572   3HZ   LYS  69          HZ3       LYS  69 -17.435   7.827   9.575
  573    H    ALA  70           HN       ALA  70 -19.996   4.355   3.505
  574    HA   ALA  70           HA       ALA  70 -20.218   4.006   0.689
  575   1HB   ALA  70          HB1       ALA  70 -22.261   2.624   1.468
  576   2HB   ALA  70          HB2       ALA  70 -21.830   3.149   3.097
  577   3HB   ALA  70          HB3       ALA  70 -20.693   2.192   2.150
  578    H    SER  71           HN       SER  71 -21.664   4.846  -0.811
  579    HA   SER  71           HA       SER  71 -23.485   7.010   0.143
  580   1HB   SER  71          HB2       SER  71 -23.239   7.870  -2.074
  581   2HB   SER  71          HB1       SER  71 -21.638   7.293  -1.617
  582    HG   SER  71           HG       SER  71 -23.208   6.509  -3.640
  583    HA   PRO  72           HA       PRO  72 -27.028   4.572  -0.790
  584   1HB   PRO  72          HB2       PRO  72 -28.821   6.510  -1.487
  585   2HB   PRO  72          HB1       PRO  72 -28.307   6.221   0.187
  586   1HG   PRO  72          HG2       PRO  72 -27.412   8.302  -1.735
  587   2HG   PRO  72          HG1       PRO  72 -27.706   8.422   0.006
  588   1HD   PRO  72          HD2       PRO  72 -25.219   8.224  -1.089
  589   2HD   PRO  72          HD1       PRO  72 -25.621   7.648   0.543
  590    H    ARG  73           HN       ARG  73 -25.623   3.911  -2.805
  591    HA   ARG  73           HA       ARG  73 -27.310   4.153  -5.176
  592   1HB   ARG  73          HB2       ARG  73 -25.801   6.288  -4.857
  593   2HB   ARG  73          HB1       ARG  73 -24.520   5.236  -5.463
  594   1HG   ARG  73          HG2       ARG  73 -26.436   4.676  -7.277
  595   2HG   ARG  73          HG1       ARG  73 -26.894   6.332  -6.877
  596   1HD   ARG  73          HD2       ARG  73 -25.333   6.575  -8.660
  597   2HD   ARG  73          HD1       ARG  73 -24.363   6.878  -7.203
  598    HE   ARG  73           HE       ARG  73 -24.319   4.088  -7.636
  599   1HH1  ARG  73          HH1       ARG  73 -23.993   6.359 -10.075
  600   2HH1  ARG  73          HH1       ARG  73 -22.376   5.920 -10.516
  601   1HH2  ARG  73          HH2       ARG  73 -21.942   3.776  -7.824
  602   2HH2  ARG  73          HH2       ARG  73 -21.215   4.457  -9.243
  Start of MODEL   16
    1   1H    VAL   1          HT1       VAL   1  -7.351   8.325   7.999
    2   2H    VAL   1          HT2       VAL   1  -7.009   8.757   6.393
    3   3H    VAL   1          HT3       VAL   1  -6.885   9.913   7.632
    4    HA   VAL   1           HA       VAL   1  -4.975   8.882   8.554
    5    HB   VAL   1           HB       VAL   1  -4.260   6.672   7.554
    6   1HG1  VAL   1          HG1       VAL   1  -5.680   5.436   8.950
    7   2HG1  VAL   1          HG1       VAL   1  -7.082   6.437   8.570
    8   3HG1  VAL   1          HG1       VAL   1  -5.813   7.062   9.622
    9   1HG2  VAL   1          HG2       VAL   1  -6.975   6.189   6.495
   10   2HG2  VAL   1          HG2       VAL   1  -5.410   5.690   5.850
   11   3HG2  VAL   1          HG2       VAL   1  -6.010   7.319   5.541
   12    H    VAL   2           HN       VAL   2  -3.006   9.608   7.749
   13    HA   VAL   2           HA       VAL   2  -2.552   9.730   4.819
   14    HB   VAL   2           HB       VAL   2  -3.818  11.752   5.262
   15   1HG1  VAL   2          HG1       VAL   2  -2.232  11.725   7.736
   16   2HG1  VAL   2          HG1       VAL   2  -3.821  12.421   7.424
   17   3HG1  VAL   2          HG1       VAL   2  -2.365  13.320   6.998
   18   1HG2  VAL   2          HG2       VAL   2  -2.045  13.503   4.812
   19   2HG2  VAL   2          HG2       VAL   2  -1.983  12.106   3.736
   20   3HG2  VAL   2          HG2       VAL   2  -0.834  12.247   5.069
   21    H    ILE   3           HN       ILE   3  -0.511   9.255   4.454
   22    HA   ILE   3           HA       ILE   3   1.448   9.131   6.650
   23    HB   ILE   3           HB       ILE   3   1.213   7.260   5.138
   24   1HG1  ILE   3          HG1       ILE   3   3.720   8.823   4.444
   25   2HG1  ILE   3          HG1       ILE   3   3.518   7.773   5.847
   26   1HG2  ILE   3          HG2       ILE   3   0.415   7.751   3.079
   27   2HG2  ILE   3          HG2       ILE   3   2.091   8.078   2.636
   28   3HG2  ILE   3          HG2       ILE   3   1.038   9.399   3.145
   29   1HD1  ILE   3          HD1       ILE   3   4.414   6.998   3.315
   30   2HD1  ILE   3          HD1       ILE   3   2.753   6.411   3.399
   31   3HD1  ILE   3          HD1       ILE   3   3.923   5.928   4.627
   32    HA   PRO   4           HA       PRO   4   3.292  12.992   5.491
   33   1HB   PRO   4          HB2       PRO   4   5.682  12.714   6.792
   34   2HB   PRO   4          HB1       PRO   4   4.161  13.096   7.623
   35   1HG   PRO   4          HG2       PRO   4   5.597  10.503   7.407
   36   2HG   PRO   4          HG1       PRO   4   4.688  11.185   8.763
   37   1HD   PRO   4          HD2       PRO   4   3.713   9.253   7.084
   38   2HD   PRO   4          HD1       PRO   4   2.694  10.386   7.996
   39    H    SER   5           HN       SER   5   6.274  11.108   5.725
   40    HA   SER   5           HA       SER   5   6.450  10.586   2.855
   41   1HB   SER   5          HB2       SER   5   6.994  13.168   3.807
   42   2HB   SER   5          HB1       SER   5   8.579  12.447   3.543
   43    HG   SER   5           HG       SER   5   7.588  11.752   1.446
   44    HA   PRO   6           HA       PRO   6   9.480   8.425   5.677
   45   1HB   PRO   6          HB2       PRO   6   8.290   5.980   5.828
   46   2HB   PRO   6          HB1       PRO   6   7.948   7.291   6.971
   47   1HG   PRO   6          HG2       PRO   6   6.326   6.269   4.741
   48   2HG   PRO   6          HG1       PRO   6   5.823   7.046   6.244
   49   1HD   PRO   6          HD2       PRO   6   5.951   8.242   3.708
   50   2HD   PRO   6          HD1       PRO   6   5.748   9.079   5.263
   51    H    CYS   7           HN       CYS   7  10.070   5.761   5.064
   52    HA   CYS   7           HA       CYS   7  10.216   5.618   2.083
   53   1HB   CYS   7          HB2       CYS   7  12.383   6.060   4.066
   54   2HB   CYS   7          HB1       CYS   7  12.735   4.883   2.802
   55    H    CYS   8           HN       CYS   8  11.866   3.394   1.886
   56    HA   CYS   8           HA       CYS   8  10.568   1.319   3.617
   57   1HB   CYS   8          HB2       CYS   8  10.168   1.884   0.827
   58   2HB   CYS   8          HB1       CYS   8  10.949   0.310   0.976
   59    H    MET   9           HN       MET   9  11.737  -0.912   2.951
   60    HA   MET   9           HA       MET   9  14.689  -0.368   2.967
   61   1HB   MET   9          HB2       MET   9  13.558  -1.217   5.074
   62   2HB   MET   9          HB1       MET   9  13.168  -2.692   4.188
   63   1HG   MET   9          HG2       MET   9  15.452  -3.274   3.929
   64   2HG   MET   9          HG1       MET   9  15.996  -1.651   4.359
   65   1HE   MET   9          HE1       MET   9  15.186  -5.271   6.676
   66   2HE   MET   9          HE2       MET   9  14.588  -4.823   5.078
   67   3HE   MET   9          HE3       MET   9  13.596  -4.514   6.501
   68    H    PHE  10           HN       PHE  10  12.152  -2.662   1.935
   69    HA   PHE  10           HA       PHE  10  13.812  -3.367  -0.429
   70   1HB   PHE  10          HB2       PHE  10  13.686  -5.740   0.096
   71   2HB   PHE  10          HB1       PHE  10  14.345  -4.902   1.498
   72    HD1  PHE  10           HD1      PHE  10  11.468  -6.721   0.138
   73    HD2  PHE  10           HD2      PHE  10  12.973  -4.550   3.524
   74    HE1  PHE  10           HE1      PHE  10   9.615  -7.608   1.528
   75    HE2  PHE  10           HE2      PHE  10  11.120  -5.436   4.916
   76    HZ   PHE  10           HZ       PHE  10   9.441  -6.964   3.917
   77    H    PHE  11           HN       PHE  11  12.510  -4.253  -2.168
   78    HA   PHE  11           HA       PHE  11   9.707  -3.407  -2.085
   79   1HB   PHE  11          HB2       PHE  11  11.759  -4.052  -4.018
   80   2HB   PHE  11          HB1       PHE  11  10.282  -4.929  -4.410
   81    HD1  PHE  11           HD1      PHE  11  11.824  -2.315  -5.609
   82    HD2  PHE  11           HD2      PHE  11   8.215  -3.036  -3.396
   83    HE1  PHE  11           HE1      PHE  11  10.834  -0.246  -6.545
   84    HE2  PHE  11           HE2      PHE  11   7.231  -0.964  -4.330
   85    HZ   PHE  11           HZ       PHE  11   8.538   0.434  -5.906
   86    H    VAL  12           HN       VAL  12   7.895  -4.803  -2.194
   87    HA   VAL  12           HA       VAL  12   7.895  -7.209  -0.743
   88    HB   VAL  12           HB       VAL  12   5.699  -7.557  -1.974
   89   1HG1  VAL  12          HG1       VAL  12   5.311  -6.310  -0.089
   90   2HG1  VAL  12          HG1       VAL  12   4.954  -5.065  -1.284
   91   3HG1  VAL  12          HG1       VAL  12   6.534  -5.109  -0.502
   92   1HG2  VAL  12          HG2       VAL  12   6.993  -5.900  -3.877
   93   2HG2  VAL  12          HG2       VAL  12   5.667  -4.948  -3.213
   94   3HG2  VAL  12          HG2       VAL  12   5.344  -6.519  -3.947
   95    H    SER  13           HN       SER  13   8.357  -9.334  -1.272
   96    HA   SER  13           HA       SER  13   9.881 -10.008  -3.583
   97   1HB   SER  13          HB2       SER  13   9.547 -12.290  -2.762
   98   2HB   SER  13          HB1       SER  13   9.768 -11.211  -1.387
   99    HG   SER  13           HG       SER  13   7.983 -12.550  -1.046
  100    H    LYS  14           HN       LYS  14   6.432  -9.839  -3.023
  101    HA   LYS  14           HA       LYS  14   5.870 -10.124  -5.864
  102   1HB   LYS  14          HB2       LYS  14   4.591 -12.237  -5.615
  103   2HB   LYS  14          HB1       LYS  14   6.290 -12.462  -5.199
  104   1HG   LYS  14          HG2       LYS  14   5.785 -12.310  -2.827
  105   2HG   LYS  14          HG1       LYS  14   4.101 -11.914  -3.174
  106   1HD   LYS  14          HD2       LYS  14   3.615 -14.111  -3.212
  107   2HD   LYS  14          HD1       LYS  14   4.701 -14.307  -4.588
  108   1HE   LYS  14          HE2       LYS  14   5.721 -15.745  -3.066
  109   2HE   LYS  14          HE1       LYS  14   6.554 -14.234  -2.648
  110   1HZ   LYS  14          HZ1       LYS  14   5.539 -15.343  -0.700
  111   2HZ   LYS  14          HZ2       LYS  14   4.010 -15.146  -1.412
  112   3HZ   LYS  14          HZ3       LYS  14   4.926 -13.785  -0.968
  113    H    ARG  15           HN       ARG  15   3.443 -10.053  -6.229
  114    HA   ARG  15           HA       ARG  15   2.164  -7.918  -4.970
  115   1HB   ARG  15          HB2       ARG  15   1.551  -9.139  -7.079
  116   2HB   ARG  15          HB1       ARG  15   0.902 -10.448  -6.094
  117   1HG   ARG  15          HG2       ARG  15  -0.150  -7.884  -5.235
  118   2HG   ARG  15          HG1       ARG  15  -0.473  -8.158  -6.945
  119   1HD   ARG  15          HD2       ARG  15  -0.953 -10.447  -5.079
  120   2HD   ARG  15          HD1       ARG  15  -2.124  -9.113  -5.077
  121    HE   ARG  15           HE       ARG  15  -1.287 -10.328  -7.671
  122   1HH1  ARG  15          HH1       ARG  15  -3.473  -8.174  -7.022
  123   2HH1  ARG  15          HH1       ARG  15  -4.899  -9.124  -7.277
  124   1HH2  ARG  15          HH2       ARG  15  -3.208 -12.150  -7.267
  125   2HH2  ARG  15          HH2       ARG  15  -4.748 -11.373  -7.421
  126    H    ILE  16           HN       ILE  16   0.330  -7.909  -3.432
  127    HA   ILE  16           HA       ILE  16   0.658  -9.930  -1.251
  128    HB   ILE  16           HB       ILE  16  -1.001  -7.480  -0.867
  129   1HG1  ILE  16          HG1       ILE  16   1.997  -7.310  -1.330
  130   2HG1  ILE  16          HG1       ILE  16   0.743  -6.491  -2.252
  131   1HG2  ILE  16          HG2       ILE  16   0.572  -9.348   0.667
  132   2HG2  ILE  16          HG2       ILE  16  -0.597  -8.156   1.233
  133   3HG2  ILE  16          HG2       ILE  16   1.092  -7.702   1.018
  134   1HD1  ILE  16          HD1       ILE  16   1.140  -6.053   0.718
  135   2HD1  ILE  16          HD1       ILE  16   0.155  -5.097  -0.389
  136   3HD1  ILE  16          HD1       ILE  16   1.914  -5.053  -0.511
  137    HA   PRO  17           HA       PRO  17  -3.475 -11.253  -2.121
  138   1HB   PRO  17          HB2       PRO  17  -4.140 -12.405   0.263
  139   2HB   PRO  17          HB1       PRO  17  -2.996 -13.130  -0.882
  140   1HG   PRO  17          HG2       PRO  17  -2.492 -11.842   1.689
  141   2HG   PRO  17          HG1       PRO  17  -1.491 -12.971   0.774
  142   1HD   PRO  17          HD2       PRO  17  -1.210 -10.141   0.974
  143   2HD   PRO  17          HD1       PRO  17  -0.221 -11.268   0.025
  144    H    GLU  18           HN       GLU  18  -5.110  -9.768  -2.315
  145    HA   GLU  18           HA       GLU  18  -5.640  -7.476  -0.891
  146   1HB   GLU  18          HB2       GLU  18  -6.730  -8.634  -2.971
  147   2HB   GLU  18          HB1       GLU  18  -7.896  -9.245  -1.799
  148   1HG   GLU  18          HG2       GLU  18  -8.787  -7.168  -1.396
  149   2HG   GLU  18          HG1       GLU  18  -7.249  -6.345  -1.648
  150    H    ASN  19           HN       ASN  19  -6.993 -10.690  -0.083
  151    HA   ASN  19           HA       ASN  19  -8.668  -9.944   2.058
  152   1HB   ASN  19          HB2       ASN  19  -7.482 -12.290   0.901
  153   2HB   ASN  19          HB1       ASN  19  -7.389 -12.415   2.657
  154   1HD2  ASN  19          HD2       ASN  19  -9.779 -11.462   0.122
  155   2HD2  ASN  19          HD2       ASN  19 -11.113 -12.150   0.917
  156    H    ARG  20           HN       ARG  20  -5.162 -10.082   1.956
  157    HA   ARG  20           HA       ARG  20  -4.994  -9.948   4.921
  158   1HB   ARG  20          HB2       ARG  20  -2.993 -10.258   2.672
  159   2HB   ARG  20          HB1       ARG  20  -2.552 -10.223   4.375
  160   1HG   ARG  20          HG2       ARG  20  -4.472 -12.080   4.518
  161   2HG   ARG  20          HG1       ARG  20  -3.988 -12.333   2.840
  162   1HD   ARG  20          HD2       ARG  20  -1.907 -13.135   3.421
  163   2HD   ARG  20          HD1       ARG  20  -1.792 -12.090   4.853
  164    HE   ARG  20           HE       ARG  20  -3.946 -13.947   5.211
  165   1HH1  ARG  20          HH1       ARG  20  -1.323 -13.154   6.828
  166   2HH1  ARG  20          HH1       ARG  20  -0.702 -14.745   7.122
  167   1HH2  ARG  20          HH2       ARG  20  -2.806 -16.270   4.824
  168   2HH2  ARG  20          HH2       ARG  20  -1.544 -16.512   5.985
  169    H    VAL  21           HN       VAL  21  -4.397  -7.986   2.043
  170    HA   VAL  21           HA       VAL  21  -2.947  -5.880   3.410
  171    HB   VAL  21           HB       VAL  21  -4.555  -5.836   0.839
  172   1HG1  VAL  21          HG1       VAL  21  -2.422  -4.082   2.058
  173   2HG1  VAL  21          HG1       VAL  21  -3.981  -3.606   1.385
  174   3HG1  VAL  21          HG1       VAL  21  -2.679  -4.123   0.313
  175   1HG2  VAL  21          HG2       VAL  21  -1.651  -6.113   0.651
  176   2HG2  VAL  21          HG2       VAL  21  -2.915  -7.053  -0.142
  177   3HG2  VAL  21          HG2       VAL  21  -2.393  -7.474   1.490
  178    H    VAL  22           HN       VAL  22  -3.750  -3.828   4.104
  179    HA   VAL  22           HA       VAL  22  -6.724  -3.618   4.354
  180    HB   VAL  22           HB       VAL  22  -6.075  -2.429   6.548
  181   1HG1  VAL  22          HG1       VAL  22  -5.550  -5.385   6.213
  182   2HG1  VAL  22          HG1       VAL  22  -7.126  -4.633   6.473
  183   3HG1  VAL  22          HG1       VAL  22  -5.904  -4.580   7.743
  184   1HG2  VAL  22          HG2       VAL  22  -3.545  -4.047   6.232
  185   2HG2  VAL  22          HG2       VAL  22  -3.947  -2.911   7.518
  186   3HG2  VAL  22          HG2       VAL  22  -3.609  -2.317   5.894
  187    H    SER  23           HN       SER  23  -3.640  -1.897   4.041
  188    HA   SER  23           HA       SER  23  -4.827   0.266   2.524
  189   1HB   SER  23          HB2       SER  23  -5.770   0.856   4.652
  190   2HB   SER  23          HB1       SER  23  -4.243   0.566   5.479
  191    HG   SER  23           HG       SER  23  -3.949   2.626   5.152
  192    H    TYR  24           HN       TYR  24  -3.131   1.675   1.699
  193    HA   TYR  24           HA       TYR  24  -0.427   0.590   2.176
  194   1HB   TYR  24          HB2       TYR  24   0.046   1.460   0.001
  195   2HB   TYR  24          HB1       TYR  24  -1.547   0.729  -0.082
  196    HD1  TYR  24           HD1      TYR  24  -3.558   2.099  -0.313
  197    HD2  TYR  24           HD2      TYR  24   0.328   3.900  -0.016
  198    HE1  TYR  24           HE1      TYR  24  -4.509   4.266  -1.047
  199    HE2  TYR  24           HE2      TYR  24  -0.622   6.070  -0.751
  200    HH   TYR  24           HH       TYR  24  -3.625   6.900  -0.612
  201    H    GLN  25           HN       GLN  25   1.180   2.535   1.417
  202    HA   GLN  25           HA       GLN  25   0.678   5.073   2.832
  203   1HB   GLN  25          HB2       GLN  25   2.235   2.777   3.870
  204   2HB   GLN  25          HB1       GLN  25   3.095   4.316   3.924
  205   1HG   GLN  25          HG2       GLN  25   1.107   5.327   5.066
  206   2HG   GLN  25          HG1       GLN  25   0.374   3.724   5.124
  207   1HE2  GLN  25          HE2       GLN  25   0.628   4.456   7.607
  208   2HE2  GLN  25          HE2       GLN  25   2.048   3.914   8.362
  209    H    LEU  26           HN       LEU  26   1.112   6.084   0.801
  210    HA   LEU  26           HA       LEU  26   3.207   5.331  -0.972
  211   1HB   LEU  26          HB2       LEU  26   1.347   7.598  -0.541
  212   2HB   LEU  26          HB1       LEU  26   2.777   7.964  -1.505
  213    HG   LEU  26           HG       LEU  26   0.806   5.717  -2.028
  214   1HD1  LEU  26          HD1       LEU  26   1.170   7.564  -4.194
  215   2HD1  LEU  26          HD1       LEU  26   0.791   8.477  -2.733
  216   3HD1  LEU  26          HD1       LEU  26  -0.303   7.212  -3.292
  217   1HD2  LEU  26          HD2       LEU  26   2.220   5.692  -4.232
  218   2HD2  LEU  26          HD2       LEU  26   2.862   4.887  -2.802
  219   3HD2  LEU  26          HD2       LEU  26   3.452   6.486  -3.249
  220    H    SER  27           HN       SER  27   5.311   6.018  -1.193
  221    HA   SER  27           HA       SER  27   6.391   8.082   0.645
  222   1HB   SER  27          HB2       SER  27   7.169   5.164   0.517
  223   2HB   SER  27          HB1       SER  27   8.218   6.386   1.228
  224    HG   SER  27           HG       SER  27   6.963   6.446   2.912
  225    H    SER  28           HN       SER  28   7.640   9.388  -0.638
  226    HA   SER  28           HA       SER  28   9.689   8.337  -2.393
  227   1HB   SER  28          HB2       SER  28   8.449   9.359  -4.460
  228   2HB   SER  28          HB1       SER  28   7.965   7.765  -3.889
  229    HG   SER  28           HG       SER  28   6.133   8.574  -3.169
  230    H    ARG  29           HN       ARG  29  10.276  10.105  -0.571
  231    HA   ARG  29           HA       ARG  29  10.894  12.567  -2.013
  232   1HB   ARG  29          HB2       ARG  29   8.541  12.914  -1.368
  233   2HB   ARG  29          HB1       ARG  29   8.946  12.563   0.312
  234   1HG   ARG  29          HG2       ARG  29  10.161  14.544   0.575
  235   2HG   ARG  29          HG1       ARG  29  10.413  14.731  -1.162
  236   1HD   ARG  29          HD2       ARG  29   8.594  16.078  -1.247
  237   2HD   ARG  29          HD1       ARG  29   7.589  14.719  -0.702
  238    HE   ARG  29           HE       ARG  29   8.956  15.695   1.573
  239   1HH1  ARG  29          HH2       ARG  29   8.272  18.269   0.032
  240   2HH1  ARG  29          HH2       ARG  29   6.759  18.686   0.763
  241   1HH2  ARG  29          HH1       ARG  29   6.289  15.561   2.195
  242   2HH2  ARG  29          HH1       ARG  29   5.636  17.152   1.993
  243    H    SER  30           HN       SER  30  10.713  10.921   1.133
  244    HA   SER  30           HA       SER  30  12.850  12.510   2.332
  245   1HB   SER  30          HB2       SER  30  11.275  11.617   3.829
  246   2HB   SER  30          HB1       SER  30  11.233  10.063   3.003
  247    HG   SER  30           HG       SER  30  12.749  10.834   5.061
  248    H    THR  31           HN       THR  31  14.489  12.154   0.599
  249    HA   THR  31           HA       THR  31  16.336  11.021  -0.358
  250    HB   THR  31           HB       THR  31  17.746  10.082   1.340
  251    HG1  THR  31           HG1      THR  31  16.440   8.557   2.226
  252   1HG2  THR  31          HG2       THR  31  16.274  11.737   3.255
  253   2HG2  THR  31          HG2       THR  31  16.476  12.518   1.687
  254   3HG2  THR  31          HG2       THR  31  17.889  11.963   2.585
  255    H    CYS  32           HN       CYS  32  13.983   9.778  -1.175
  256    HA   CYS  32           HA       CYS  32  14.569   6.855  -0.855
  257   1HB   CYS  32          HB2       CYS  32  12.205   8.479  -0.658
  258   2HB   CYS  32          HB1       CYS  32  12.006   7.355  -2.001
  259    H    LEU  33           HN       LEU  33  15.792   6.250  -2.623
  260    HA   LEU  33           HA       LEU  33  15.696   7.558  -5.195
  261   1HB   LEU  33          HB2       LEU  33  16.853   5.041  -4.021
  262   2HB   LEU  33          HB1       LEU  33  16.926   5.301  -5.765
  263    HG   LEU  33           HG       LEU  33  17.711   7.748  -4.666
  264   1HD1  LEU  33          HD1       LEU  33  17.959   6.589  -2.478
  265   2HD1  LEU  33          HD1       LEU  33  19.502   7.162  -3.105
  266   3HD1  LEU  33          HD1       LEU  33  19.081   5.454  -3.229
  267   1HD2  LEU  33          HD2       LEU  33  20.057   6.392  -5.293
  268   2HD2  LEU  33          HD2       LEU  33  19.045   7.277  -6.435
  269   3HD2  LEU  33          HD2       LEU  33  18.828   5.541  -6.229
  270    H    LYS  34           HN       LYS  34  15.119   4.085  -4.821
  271    HA   LYS  34           HA       LYS  34  13.280   3.959  -7.027
  272   1HB   LYS  34          HB2       LYS  34  14.734   2.129  -6.111
  273   2HB   LYS  34          HB1       LYS  34  13.684   2.055  -4.697
  274   1HG   LYS  34          HG2       LYS  34  12.469   0.551  -5.871
  275   2HG   LYS  34          HG1       LYS  34  11.890   1.931  -6.804
  276   1HD   LYS  34          HD2       LYS  34  13.930   1.632  -8.293
  277   2HD   LYS  34          HD1       LYS  34  14.206   0.097  -7.466
  278   1HE   LYS  34          HE2       LYS  34  12.002  -0.720  -8.168
  279   2HE   LYS  34          HE1       LYS  34  11.649   0.841  -8.936
  280   1HZ   LYS  34          HZ1       LYS  34  13.874  -1.010  -9.615
  281   2HZ   LYS  34          HZ2       LYS  34  13.696   0.552 -10.260
  282   3HZ   LYS  34          HZ3       LYS  34  12.534  -0.642 -10.587
  283    H    ALA  35           HN       ALA  35  11.596   5.515  -6.568
  284    HA   ALA  35           HA       ALA  35  10.087   5.664  -4.155
  285   1HB   ALA  35          HB1       ALA  35   9.686   6.372  -7.047
  286   2HB   ALA  35          HB2       ALA  35   9.872   7.443  -5.658
  287   3HB   ALA  35          HB3       ALA  35   8.354   6.580  -5.910
  288    H    GLY  36           HN       GLY  36   8.537   4.328  -3.336
  289   1HA   GLY  36          HA2       GLY  36   6.961   2.596  -5.135
  290   2HA   GLY  36          HA1       GLY  36   7.956   1.771  -3.933
  291    H    VAL  37           HN       VAL  37   5.234   1.398  -3.722
  292    HA   VAL  37           HA       VAL  37   4.298   3.364  -1.683
  293    HB   VAL  37           HB       VAL  37   2.830   1.018  -2.925
  294   1HG1  VAL  37          HG1       VAL  37   1.679   1.877  -1.017
  295   2HG1  VAL  37          HG1       VAL  37   0.879   2.593  -2.416
  296   3HG1  VAL  37          HG1       VAL  37   2.023   3.545  -1.472
  297   1HG2  VAL  37          HG2       VAL  37   1.922   3.322  -4.168
  298   2HG2  VAL  37          HG2       VAL  37   3.020   2.145  -4.886
  299   3HG2  VAL  37          HG2       VAL  37   3.664   3.580  -4.090
  300    H    ILE  38           HN       ILE  38   3.127   2.269   0.239
  301    HA   ILE  38           HA       ILE  38   4.615  -0.208   1.056
  302    HB   ILE  38           HB       ILE  38   3.973   2.339   2.571
  303   1HG1  ILE  38          HG1       ILE  38   6.601   1.862   2.935
  304   2HG1  ILE  38          HG1       ILE  38   6.380   1.049   1.386
  305   1HG2  ILE  38          HG2       ILE  38   4.998   1.240   4.527
  306   2HG2  ILE  38          HG2       ILE  38   5.165  -0.255   3.604
  307   3HG2  ILE  38          HG2       ILE  38   3.561   0.359   4.003
  308   1HD1  ILE  38          HD1       ILE  38   5.872   3.950   2.050
  309   2HD1  ILE  38          HD1       ILE  38   5.202   3.194   0.608
  310   3HD1  ILE  38          HD1       ILE  38   6.949   3.282   0.823
  311    H    PHE  39           HN       PHE  39   3.143  -1.840   1.351
  312    HA   PHE  39           HA       PHE  39   0.354  -1.075   2.060
  313   1HB   PHE  39          HB2       PHE  39   1.679  -3.362   0.642
  314   2HB   PHE  39          HB1       PHE  39   0.042  -3.543   1.281
  315    HD1  PHE  39           HD1      PHE  39   2.170  -1.661  -1.083
  316    HD2  PHE  39           HD2      PHE  39  -1.824  -2.335   0.342
  317    HE1  PHE  39           HE1      PHE  39   1.268  -0.408  -3.021
  318    HE2  PHE  39           HE2      PHE  39  -2.724  -1.081  -1.596
  319    HZ   PHE  39           HZ       PHE  39  -1.182  -0.117  -3.276
  320    H    THR  40           HN       THR  40  -0.473  -1.630   3.999
  321    HA   THR  40           HA       THR  40   1.191  -3.255   5.839
  322    HB   THR  40           HB       THR  40  -1.148  -1.352   6.134
  323    HG1  THR  40           HG1      THR  40   0.428  -0.220   7.349
  324   1HG2  THR  40          HG2       THR  40  -0.196  -3.458   7.957
  325   2HG2  THR  40          HG2       THR  40  -1.721  -2.572   7.959
  326   3HG2  THR  40          HG2       THR  40  -0.285  -1.856   8.693
  327    H    THR  41           HN       THR  41   0.402  -5.206   6.675
  328    HA   THR  41           HA       THR  41  -1.927  -6.375   5.291
  329    HB   THR  41           HB       THR  41  -0.393  -7.862   7.355
  330    HG1  THR  41           HG1      THR  41   0.742  -6.767   5.013
  331   1HG2  THR  41          HG2       THR  41  -0.713  -9.655   5.920
  332   2HG2  THR  41          HG2       THR  41  -0.723  -8.635   4.482
  333   3HG2  THR  41          HG2       THR  41  -2.126  -8.668   5.549
  334    H    LYS  42           HN       LYS  42  -3.484  -7.678   6.700
  335    HA   LYS  42           HA       LYS  42  -4.535  -6.001   8.831
  336   1HB   LYS  42          HB2       LYS  42  -6.257  -7.761   8.904
  337   2HB   LYS  42          HB1       LYS  42  -5.895  -7.326   7.234
  338   1HG   LYS  42          HG2       LYS  42  -4.561  -9.282   6.912
  339   2HG   LYS  42          HG1       LYS  42  -4.532  -9.632   8.640
  340   1HD   LYS  42          HD2       LYS  42  -7.263  -9.438   7.813
  341   2HD   LYS  42          HD1       LYS  42  -6.426 -10.525   6.705
  342   1HE   LYS  42          HE2       LYS  42  -7.248 -11.844   8.580
  343   2HE   LYS  42          HE1       LYS  42  -5.486 -11.720   8.742
  344   1HZ   LYS  42          HZ1       LYS  42  -7.478  -9.934  10.037
  345   2HZ   LYS  42          HZ2       LYS  42  -5.791  -9.786  10.166
  346   3HZ   LYS  42          HZ3       LYS  42  -6.582 -11.140  10.822
  347    H    LYS  43           HN       LYS  43  -2.217  -8.551   8.719
  348    HA   LYS  43           HA       LYS  43  -2.676  -9.538  11.438
  349   1HB   LYS  43          HB2       LYS  43  -0.560  -9.875   9.303
  350   2HB   LYS  43          HB1       LYS  43  -0.422 -10.647  10.883
  351   1HG   LYS  43          HG2       LYS  43  -3.051 -11.169  10.051
  352   2HG   LYS  43          HG1       LYS  43  -2.057 -11.416   8.615
  353   1HD   LYS  43          HD2       LYS  43  -1.621 -13.463   9.485
  354   2HD   LYS  43          HD1       LYS  43  -0.542 -12.606  10.588
  355   1HE   LYS  43          HE2       LYS  43  -3.479 -12.874  11.238
  356   2HE   LYS  43          HE1       LYS  43  -2.337 -14.172  11.641
  357   1HZ   LYS  43          HZ1       LYS  43  -2.097 -11.312  12.416
  358   2HZ   LYS  43          HZ2       LYS  43  -0.917 -12.497  12.711
  359   3HZ   LYS  43          HZ3       LYS  43  -2.441 -12.605  13.457
  360    H    GLY  44           HN       GLY  44  -0.909  -6.921   9.980
  361   1HA   GLY  44          HA2       GLY  44  -0.200  -5.129  11.573
  362   2HA   GLY  44          HA1       GLY  44   0.413  -6.419  12.605
  363    H    GLN  45           HN       GLN  45   0.793  -6.461   9.113
  364    HA   GLN  45           HA       GLN  45   3.750  -6.240   9.520
  365   1HB   GLN  45          HB2       GLN  45   2.127  -8.140   8.301
  366   2HB   GLN  45          HB1       GLN  45   2.758  -7.212   6.940
  367   1HG   GLN  45          HG2       GLN  45   4.990  -7.504   8.522
  368   2HG   GLN  45          HG1       GLN  45   4.158  -9.041   8.765
  369   1HE2  GLN  45          HE2       GLN  45   6.657  -8.599   7.211
  370   2HE2  GLN  45          HE2       GLN  45   6.318  -9.109   5.629
  371    H    GLN  46           HN       GLN  46   4.804  -5.398   7.326
  372    HA   GLN  46           HA       GLN  46   3.219  -3.302   5.977
  373   1HB   GLN  46          HB2       GLN  46   4.189  -2.557   8.302
  374   2HB   GLN  46          HB1       GLN  46   5.723  -2.479   7.434
  375   1HG   GLN  46          HG2       GLN  46   4.978  -0.779   6.006
  376   2HG   GLN  46          HG1       GLN  46   3.278  -1.165   6.278
  377   1HE2  GLN  46          HE2       GLN  46   4.929   1.424   6.736
  378   2HE2  GLN  46          HE2       GLN  46   4.546   1.860   8.332
  379    H    SER  47           HN       SER  47   3.783  -4.217   3.971
  380    HA   SER  47           HA       SER  47   6.686  -4.592   3.377
  381   1HB   SER  47          HB2       SER  47   4.412  -5.343   1.563
  382   2HB   SER  47          HB1       SER  47   5.964  -6.143   1.784
  383    HG   SER  47           HG       SER  47   5.197  -6.667   3.937
  384    H    CYS  48           HN       CYS  48   7.191  -3.999   0.966
  385    HA   CYS  48           HA       CYS  48   6.145  -1.234   0.483
  386   1HB   CYS  48          HB2       CYS  48   8.618  -2.597  -0.634
  387   2HB   CYS  48          HB1       CYS  48   8.266  -0.871  -0.632
  388    H    GLY  49           HN       GLY  49   4.540  -1.242  -1.099
  389   1HA   GLY  49          HA2       GLY  49   4.524  -3.393  -3.115
  390   2HA   GLY  49          HA1       GLY  49   3.260  -2.196  -2.885
  391    H    ASP  50           HN       ASP  50   4.936  -3.094  -5.260
  392    HA   ASP  50           HA       ASP  50   6.337  -0.605  -6.027
  393   1HB   ASP  50          HB2       ASP  50   6.958  -1.979  -7.990
  394   2HB   ASP  50          HB1       ASP  50   7.243  -2.872  -6.495
  395    HA   PRO  51           HA       PRO  51   2.631   0.946  -7.932
  396   1HB   PRO  51          HB2       PRO  51   3.766   2.926  -9.451
  397   2HB   PRO  51          HB1       PRO  51   3.520   3.068  -7.699
  398   1HG   PRO  51          HG2       PRO  51   5.995   2.373  -9.210
  399   2HG   PRO  51          HG1       PRO  51   5.794   3.409  -7.786
  400   1HD   PRO  51          HD2       PRO  51   6.716   0.866  -7.628
  401   2HD   PRO  51          HD1       PRO  51   5.778   1.633  -6.328
  402    H    LYS  52           HN       LYS  52   5.440  -0.136  -9.750
  403    HA   LYS  52           HA       LYS  52   4.334  -0.012 -12.386
  404   1HB   LYS  52          HB2       LYS  52   6.120  -1.606 -12.895
  405   2HB   LYS  52          HB1       LYS  52   6.721  -0.402 -11.756
  406   1HG   LYS  52          HG2       LYS  52   6.277  -1.972  -9.885
  407   2HG   LYS  52          HG1       LYS  52   5.728  -3.180 -11.047
  408   1HD   LYS  52          HD2       LYS  52   8.007  -2.941 -12.174
  409   2HD   LYS  52          HD1       LYS  52   8.509  -2.027 -10.751
  410   1HE   LYS  52          HE2       LYS  52   7.815  -3.985  -9.321
  411   2HE   LYS  52          HE1       LYS  52   7.536  -4.904 -10.815
  412   1HZ   LYS  52          HZ1       LYS  52   9.836  -5.098  -9.840
  413   2HZ   LYS  52          HZ2       LYS  52  10.071  -3.469 -10.262
  414   3HZ   LYS  52          HZ3       LYS  52   9.769  -4.626 -11.469
  415    H    GLN  53           HN       GLN  53   3.548  -2.018  -9.682
  416    HA   GLN  53           HA       GLN  53   2.384  -4.172 -11.345
  417   1HB   GLN  53          HB2       GLN  53   3.153  -3.669  -8.543
  418   2HB   GLN  53          HB1       GLN  53   1.681  -4.621  -8.727
  419   1HG   GLN  53          HG2       GLN  53   4.240  -5.244 -10.218
  420   2HG   GLN  53          HG1       GLN  53   3.831  -5.974  -8.666
  421   1HE2  GLN  53          HE2       GLN  53   4.083  -7.690 -10.860
  422   2HE2  GLN  53          HE2       GLN  53   2.552  -8.256 -11.330
  423    H    GLU  54           HN       GLU  54   0.059  -4.734 -11.030
  424    HA   GLU  54           HA       GLU  54  -1.612  -2.288 -10.976
  425   1HB   GLU  54          HB2       GLU  54  -1.961  -5.185 -11.768
  426   2HB   GLU  54          HB1       GLU  54  -3.331  -4.075 -11.711
  427   1HG   GLU  54          HG2       GLU  54  -2.208  -2.570 -13.290
  428   2HG   GLU  54          HG1       GLU  54  -0.800  -3.633 -13.324
  429    H    TRP  55           HN       TRP  55  -0.738  -4.748  -8.704
  430    HA   TRP  55           HA       TRP  55  -3.328  -4.762  -7.340
  431   1HB   TRP  55          HB2       TRP  55  -2.197  -6.186  -5.759
  432   2HB   TRP  55          HB1       TRP  55  -1.736  -6.674  -7.380
  433    HD1  TRP  55           HD1      TRP  55   0.773  -6.564  -8.008
  434    HE1  TRP  55           HE1      TRP  55   2.909  -6.017  -6.662
  435    HE3  TRP  55           HE3      TRP  55  -1.301  -4.529  -3.820
  436    HZ2  TRP  55           HZ2      TRP  55   3.628  -4.911  -4.171
  437    HZ3  TRP  55           HZ3      TRP  55   0.135  -3.740  -1.969
  438    HH2  TRP  55           HH2      TRP  55   2.604  -3.914  -2.138
  439    H    VAL  56           HN       VAL  56  -0.447  -2.790  -7.273
  440    HA   VAL  56           HA       VAL  56  -1.072  -1.572  -4.673
  441    HB   VAL  56           HB       VAL  56   0.652  -0.715  -7.038
  442   1HG1  VAL  56          HG1       VAL  56   1.492   0.569  -4.668
  443   2HG1  VAL  56          HG1       VAL  56  -0.261   0.757  -4.709
  444   3HG1  VAL  56          HG1       VAL  56   0.718   1.323  -6.059
  445   1HG2  VAL  56          HG2       VAL  56   1.863  -2.447  -6.142
  446   2HG2  VAL  56          HG2       VAL  56   1.072  -2.324  -4.571
  447   3HG2  VAL  56          HG2       VAL  56   2.358  -1.196  -5.001
  448    H    GLN  57           HN       GLN  57  -1.288  -0.599  -8.097
  449    HA   GLN  57           HA       GLN  57  -2.877   1.738  -7.766
  450   1HB   GLN  57          HB2       GLN  57  -1.730   0.200  -9.803
  451   2HB   GLN  57          HB1       GLN  57  -3.460   0.080 -10.128
  452   1HG   GLN  57          HG2       GLN  57  -3.438   2.679  -9.724
  453   2HG   GLN  57          HG1       GLN  57  -1.713   2.527 -10.063
  454   1HE2  GLN  57          HE2       GLN  57  -1.476   3.215 -12.215
  455   2HE2  GLN  57          HE2       GLN  57  -2.407   2.641 -13.513
  456    H    ARG  58           HN       ARG  58  -3.795  -1.690  -8.205
  457    HA   ARG  58           HA       ARG  58  -6.628  -1.336  -8.282
  458   1HB   ARG  58          HB2       ARG  58  -5.469  -3.412  -8.882
  459   2HB   ARG  58          HB1       ARG  58  -4.875  -3.587  -7.230
  460   1HG   ARG  58          HG2       ARG  58  -7.181  -3.790  -6.405
  461   2HG   ARG  58          HG1       ARG  58  -7.796  -3.582  -8.045
  462   1HD   ARG  58          HD2       ARG  58  -5.767  -5.693  -7.879
  463   2HD   ARG  58          HD1       ARG  58  -7.194  -6.026  -6.878
  464    HE   ARG  58           HE       ARG  58  -8.188  -5.029  -9.304
  465   1HH1  ARG  58          HH1       ARG  58  -8.510  -7.850  -8.036
  466   2HH1  ARG  58          HH1       ARG  58  -8.011  -8.838  -9.369
  467   1HH2  ARG  58          HH2       ARG  58  -6.562  -6.215 -11.114
  468   2HH2  ARG  58          HH2       ARG  58  -6.904  -7.912 -11.111
  469    H    TYR  59           HN       TYR  59  -4.575  -2.322  -5.504
  470    HA   TYR  59           HA       TYR  59  -6.541  -2.092  -3.472
  471   1HB   TYR  59          HB2       TYR  59  -3.551  -1.535  -3.489
  472   2HB   TYR  59          HB1       TYR  59  -4.506  -1.711  -2.024
  473    HD1  TYR  59           HD1      TYR  59  -2.555  -3.467  -1.747
  474    HD2  TYR  59           HD2      TYR  59  -5.831  -3.923  -4.499
  475    HE1  TYR  59           HE1      TYR  59  -2.187  -5.918  -1.774
  476    HE2  TYR  59           HE2      TYR  59  -5.452  -6.371  -4.519
  477    HH   TYR  59           HH       TYR  59  -3.560  -7.964  -2.261
  478    H    MET  60           HN       MET  60  -4.170   0.258  -4.630
  479    HA   MET  60           HA       MET  60  -4.882   2.511  -3.059
  480   1HB   MET  60          HB2       MET  60  -3.660   2.039  -5.778
  481   2HB   MET  60          HB1       MET  60  -3.836   3.668  -5.138
  482   1HG   MET  60          HG2       MET  60  -2.677   2.816  -3.022
  483   2HG   MET  60          HG1       MET  60  -2.257   1.378  -3.945
  484   1HE   MET  60          HE1       MET  60  -1.799   5.592  -4.886
  485   2HE   MET  60          HE2       MET  60  -0.709   5.323  -3.527
  486   3HE   MET  60          HE3       MET  60  -2.391   4.812  -3.413
  487    H    LYS  61           HN       LYS  61  -6.261   1.222  -6.060
  488    HA   LYS  61           HA       LYS  61  -7.907   3.483  -6.731
  489   1HB   LYS  61          HB2       LYS  61  -7.271   1.579  -8.220
  490   2HB   LYS  61          HB1       LYS  61  -8.300   0.517  -7.259
  491   1HG   LYS  61          HG2       LYS  61  -9.696   1.154  -9.050
  492   2HG   LYS  61          HG1       LYS  61 -10.175   2.242  -7.750
  493   1HD   LYS  61          HD2       LYS  61  -8.909   4.050  -8.663
  494   2HD   LYS  61          HD1       LYS  61  -8.069   2.982  -9.789
  495   1HE   LYS  61          HE2       LYS  61 -10.746   2.541 -10.397
  496   2HE   LYS  61          HE1       LYS  61 -10.674   4.288 -10.084
  497   1HZ   LYS  61          HZ1       LYS  61  -8.586   2.939 -11.678
  498   2HZ   LYS  61          HZ2       LYS  61  -9.002   4.587 -11.648
  499   3HZ   LYS  61          HZ3       LYS  61 -10.023   3.462 -12.410
  500    H    ASN  62           HN       ASN  62  -8.504   0.524  -4.822
  501    HA   ASN  62           HA       ASN  62 -11.260   1.249  -4.189
  502   1HB   ASN  62          HB2       ASN  62  -9.497  -0.979  -4.004
  503   2HB   ASN  62          HB1       ASN  62 -10.058  -0.634  -2.369
  504   1HD2  ASN  62          HD2       ASN  62 -10.819  -2.730  -4.621
  505   2HD2  ASN  62          HD2       ASN  62 -12.515  -2.707  -4.574
  506    H    LEU  63           HN       LEU  63  -8.112   1.410  -2.553
  507    HA   LEU  63           HA       LEU  63  -8.986   2.280   0.006
  508   1HB   LEU  63          HB2       LEU  63  -6.529   2.297  -1.667
  509   2HB   LEU  63          HB1       LEU  63  -6.539   3.408  -0.292
  510    HG   LEU  63           HG       LEU  63  -7.542   0.667   0.236
  511   1HD1  LEU  63          HD1       LEU  63  -5.681  -0.463  -0.335
  512   2HD1  LEU  63          HD1       LEU  63  -4.663   0.701   0.513
  513   3HD1  LEU  63          HD1       LEU  63  -5.118   0.984  -1.167
  514   1HD2  LEU  63          HD2       LEU  63  -6.762   1.116   2.379
  515   2HD2  LEU  63          HD2       LEU  63  -7.074   2.755   1.811
  516   3HD2  LEU  63          HD2       LEU  63  -5.432   2.115   1.796
  517    H    ASP  64           HN       ASP  64  -8.469   4.042  -3.009
  518    HA   ASP  64           HA       ASP  64  -8.847   6.663  -1.691
  519   1HB   ASP  64          HB2       ASP  64  -7.363   5.814  -3.782
  520   2HB   ASP  64          HB1       ASP  64  -8.808   6.332  -4.649
  521    H    ALA  65           HN       ALA  65 -10.719   4.283  -3.421
  522    HA   ALA  65           HA       ALA  65 -12.878   6.137  -4.154
  523   1HB   ALA  65          HB1       ALA  65 -12.167   4.097  -5.441
  524   2HB   ALA  65          HB2       ALA  65 -13.884   4.105  -5.041
  525   3HB   ALA  65          HB3       ALA  65 -12.767   3.106  -4.114
  526    H    LYS  66           HN       LYS  66 -12.027   4.179  -1.412
  527    HA   LYS  66           HA       LYS  66 -14.678   3.768  -0.338
  528   1HB   LYS  66          HB2       LYS  66 -12.738   2.427   0.296
  529   2HB   LYS  66          HB1       LYS  66 -11.902   3.863   0.890
  530   1HG   LYS  66          HG2       LYS  66 -13.320   4.079   2.746
  531   2HG   LYS  66          HG1       LYS  66 -14.594   3.112   2.004
  532   1HD   LYS  66          HD2       LYS  66 -13.465   1.818   3.760
  533   2HD   LYS  66          HD1       LYS  66 -13.151   1.103   2.180
  534   1HE   LYS  66          HE2       LYS  66 -10.965   2.304   2.092
  535   2HE   LYS  66          HE1       LYS  66 -11.274   2.927   3.726
  536   1HZ   LYS  66          HZ1       LYS  66 -11.457   0.042   3.097
  537   2HZ   LYS  66          HZ2       LYS  66 -11.315   0.783   4.620
  538   3HZ   LYS  66          HZ3       LYS  66  -9.989   0.753   3.559
  539    H    GLN  67           HN       GLN  67 -12.441   6.458  -0.315
  540    HA   GLN  67           HA       GLN  67 -13.309   7.865   1.996
  541   1HB   GLN  67          HB2       GLN  67 -11.782   8.292  -0.441
  542   2HB   GLN  67          HB1       GLN  67 -12.691   9.738  -0.002
  543   1HG   GLN  67          HG2       GLN  67 -10.790  10.064   1.275
  544   2HG   GLN  67          HG1       GLN  67 -11.775   9.158   2.424
  545   1HE2  GLN  67          HE2       GLN  67  -9.777   8.305   3.435
  546   2HE2  GLN  67          HE2       GLN  67  -8.884   7.081   2.671
  547    H    LYS  68           HN       LYS  68 -14.828   7.457  -1.142
  548    HA   LYS  68           HA       LYS  68 -16.597   9.715  -1.057
  549   1HB   LYS  68          HB2       LYS  68 -16.126   8.465  -3.085
  550   2HB   LYS  68          HB1       LYS  68 -16.757   6.983  -2.367
  551   1HG   LYS  68          HG2       LYS  68 -18.988   8.114  -2.142
  552   2HG   LYS  68          HG1       LYS  68 -18.329   9.490  -3.029
  553   1HD   LYS  68          HD2       LYS  68 -17.936   6.827  -4.282
  554   2HD   LYS  68          HD1       LYS  68 -19.595   7.427  -4.242
  555   1HE   LYS  68          HE2       LYS  68 -19.160   8.970  -5.850
  556   2HE   LYS  68          HE1       LYS  68 -17.685   9.508  -5.024
  557   1HZ   LYS  68          HZ1       LYS  68 -17.798   6.884  -6.370
  558   2HZ   LYS  68          HZ2       LYS  68 -16.434   7.809  -5.958
  559   3HZ   LYS  68          HZ3       LYS  68 -17.429   8.285  -7.250
  560    H    LYS  69           HN       LYS  69 -17.964   6.444  -0.965
  561    HA   LYS  69           HA       LYS  69 -19.832   7.366   1.162
  562   1HB   LYS  69          HB2       LYS  69 -21.151   5.428   0.388
  563   2HB   LYS  69          HB1       LYS  69 -20.680   6.444  -0.975
  564   1HG   LYS  69          HG2       LYS  69 -18.978   4.936  -1.653
  565   2HG   LYS  69          HG1       LYS  69 -19.015   4.074  -0.116
  566   1HD   LYS  69          HD2       LYS  69 -21.567   3.697  -0.832
  567   2HD   LYS  69          HD1       LYS  69 -20.870   3.879  -2.443
  568   1HE   LYS  69          HE2       LYS  69 -19.997   1.794  -2.344
  569   2HE   LYS  69          HE1       LYS  69 -19.191   2.166  -0.806
  570   1HZ   LYS  69          HZ1       LYS  69 -21.076   1.615   0.411
  571   2HZ   LYS  69          HZ2       LYS  69 -21.045   0.413  -0.787
  572   3HZ   LYS  69          HZ3       LYS  69 -22.110   1.729  -0.928
  573    H    ALA  70           HN       ALA  70 -20.455   5.599   2.790
  574    HA   ALA  70           HA       ALA  70 -18.073   3.943   3.555
  575   1HB   ALA  70          HB1       ALA  70 -19.207   4.648   5.937
  576   2HB   ALA  70          HB2       ALA  70 -19.570   6.075   4.967
  577   3HB   ALA  70          HB3       ALA  70 -17.898   5.554   5.175
  578    H    SER  71           HN       SER  71 -18.598   1.848   4.165
  579    HA   SER  71           HA       SER  71 -21.436   1.207   4.820
  580   1HB   SER  71          HB2       SER  71 -21.047  -0.782   3.162
  581   2HB   SER  71          HB1       SER  71 -21.429   0.806   2.502
  582    HG   SER  71           HG       SER  71 -19.642   0.369   1.423
  583    HA   PRO  72           HA       PRO  72 -18.059  -1.097   7.163
  584   1HB   PRO  72          HB2       PRO  72 -18.522  -0.041   9.636
  585   2HB   PRO  72          HB1       PRO  72 -17.375   0.667   8.481
  586   1HG   PRO  72          HG2       PRO  72 -20.157   1.485   9.127
  587   2HG   PRO  72          HG1       PRO  72 -18.734   2.483   8.797
  588   1HD   PRO  72          HD2       PRO  72 -20.699   2.017   6.970
  589   2HD   PRO  72          HD1       PRO  72 -19.009   2.354   6.529
  590    H    ARG  73           HN       ARG  73 -21.278  -0.105   8.374
  591    HA   ARG  73           HA       ARG  73 -21.843  -2.993   8.963
  592   1HB   ARG  73          HB2       ARG  73 -21.542  -0.777  10.741
  593   2HB   ARG  73          HB1       ARG  73 -23.246  -1.234  10.743
  594   1HG   ARG  73          HG2       ARG  73 -22.303  -3.679  10.929
  595   2HG   ARG  73          HG1       ARG  73 -20.848  -2.872  11.514
  596   1HD   ARG  73          HD2       ARG  73 -21.922  -2.027  13.419
  597   2HD   ARG  73          HD1       ARG  73 -23.532  -2.149  12.684
  598    HE   ARG  73           HE       ARG  73 -23.535  -4.499  13.145
  599   1HH1  ARG  73          HH1       ARG  73 -22.206  -3.599  15.695
  600   2HH1  ARG  73          HH1       ARG  73 -20.837  -4.659  15.774
  601   1HH2  ARG  73          HH2       ARG  73 -21.043  -5.606  12.446
  602   2HH2  ARG  73          HH2       ARG  73 -20.181  -5.794  13.936
  Start of MODEL   17
    1   1H    VAL   1          HT1       VAL   1  -4.390  14.220   1.583
    2   2H    VAL   1          HT2       VAL   1  -4.868  14.437   3.198
    3   3H    VAL   1          HT3       VAL   1  -4.169  12.969   2.706
    4    HA   VAL   1           HA       VAL   1  -2.684  15.526   2.493
    5    HB   VAL   1           HB       VAL   1  -3.558  15.237   4.785
    6   1HG1  VAL   1          HG1       VAL   1  -2.153  12.551   4.671
    7   2HG1  VAL   1          HG1       VAL   1  -3.900  12.781   4.643
    8   3HG1  VAL   1          HG1       VAL   1  -2.974  13.230   6.076
    9   1HG2  VAL   1          HG2       VAL   1  -1.439  15.326   5.946
   10   2HG2  VAL   1          HG2       VAL   1  -1.204  16.061   4.360
   11   3HG2  VAL   1          HG2       VAL   1  -0.641  14.419   4.661
   12    H    VAL   2           HN       VAL   2  -0.407  15.078   2.218
   13    HA   VAL   2           HA       VAL   2   0.135  12.455   0.963
   14    HB   VAL   2           HB       VAL   2   0.776  14.678  -0.024
   15   1HG1  VAL   2          HG1       VAL   2   3.065  14.856   1.880
   16   2HG1  VAL   2          HG1       VAL   2   1.495  15.413   2.456
   17   3HG1  VAL   2          HG1       VAL   2   2.216  16.141   1.021
   18   1HG2  VAL   2          HG2       VAL   2   2.177  13.230  -1.065
   19   2HG2  VAL   2          HG2       VAL   2   2.543  12.378   0.435
   20   3HG2  VAL   2          HG2       VAL   2   3.416  13.855   0.024
   21    H    ILE   3           HN       ILE   3   1.710  11.011   1.704
   22    HA   ILE   3           HA       ILE   3   2.782  11.489   4.454
   23    HB   ILE   3           HB       ILE   3   0.875  10.001   4.438
   24   1HG1  ILE   3          HG1       ILE   3   3.579   9.149   5.122
   25   2HG1  ILE   3          HG1       ILE   3   2.093   8.950   6.036
   26   1HG2  ILE   3          HG2       ILE   3   2.353   8.586   2.206
   27   2HG2  ILE   3          HG2       ILE   3   0.783   9.381   2.119
   28   3HG2  ILE   3          HG2       ILE   3   0.963   7.890   3.038
   29   1HD1  ILE   3          HD1       ILE   3   3.191   7.121   3.888
   30   2HD1  ILE   3          HD1       ILE   3   1.552   6.981   4.523
   31   3HD1  ILE   3          HD1       ILE   3   2.934   6.747   5.593
   32    HA   PRO   4           HA       PRO   4   6.123  10.110   1.461
   33   1HB   PRO   4          HB2       PRO   4   7.581  12.409   1.333
   34   2HB   PRO   4          HB1       PRO   4   6.227  12.074   0.237
   35   1HG   PRO   4          HG2       PRO   4   6.366  13.884   2.567
   36   2HG   PRO   4          HG1       PRO   4   5.395  14.004   1.095
   37   1HD   PRO   4          HD2       PRO   4   4.492  13.151   3.601
   38   2HD   PRO   4          HD1       PRO   4   3.648  12.948   2.054
   39    H    SER   5           HN       SER   5   6.055  11.864   4.478
   40    HA   SER   5           HA       SER   5   8.655  11.892   5.409
   41   1HB   SER   5          HB2       SER   5   7.183  12.712   6.952
   42   2HB   SER   5          HB1       SER   5   5.944  11.536   6.537
   43    HG   SER   5           HG       SER   5   7.754  11.500   8.536
   44    HA   PRO   6           HA       PRO   6   8.478   7.313   6.708
   45   1HB   PRO   6          HB2       PRO   6   6.388   5.777   5.867
   46   2HB   PRO   6          HB1       PRO   6   6.367   6.698   7.384
   47   1HG   PRO   6          HG2       PRO   6   5.096   7.311   4.781
   48   2HG   PRO   6          HG1       PRO   6   4.529   7.639   6.425
   49   1HD   PRO   6          HD2       PRO   6   5.665   9.510   4.750
   50   2HD   PRO   6          HD1       PRO   6   5.605   9.642   6.521
   51    H    CYS   7           HN       CYS   7   9.058   5.269   5.520
   52    HA   CYS   7           HA       CYS   7   8.757   5.123   2.629
   53   1HB   CYS   7          HB2       CYS   7  10.336   7.016   2.877
   54   2HB   CYS   7          HB1       CYS   7  11.410   5.992   3.827
   55    H    CYS   8           HN       CYS   8   9.952   3.219   1.763
   56    HA   CYS   8           HA       CYS   8  10.501   1.218   3.920
   57   1HB   CYS   8          HB2       CYS   8   9.880  -0.414   2.172
   58   2HB   CYS   8          HB1       CYS   8   8.620   0.806   2.351
   59    H    MET   9           HN       MET   9  12.015  -0.627   2.747
   60    HA   MET   9           HA       MET   9  14.366   0.826   1.579
   61   1HB   MET   9          HB2       MET   9  15.751  -0.741   2.953
   62   2HB   MET   9          HB1       MET   9  14.719   0.294   3.942
   63   1HG   MET   9          HG2       MET   9  13.055  -1.524   4.109
   64   2HG   MET   9          HG1       MET   9  14.092  -2.559   3.128
   65   1HE   MET   9          HE1       MET   9  14.201  -4.372   4.582
   66   2HE   MET   9          HE2       MET   9  13.247  -3.762   5.931
   67   3HE   MET   9          HE3       MET   9  14.839  -4.451   6.230
   68    H    PHE  10           HN       PHE  10  12.570  -2.236   1.814
   69    HA   PHE  10           HA       PHE  10  13.973  -3.152  -0.674
   70   1HB   PHE  10          HB2       PHE  10  13.672  -5.386   0.153
   71   2HB   PHE  10          HB1       PHE  10  14.223  -4.435   1.529
   72    HD1  PHE  10           HD1      PHE  10  11.335  -6.128  -0.020
   73    HD2  PHE  10           HD2      PHE  10  12.727  -3.911   3.384
   74    HE1  PHE  10           HE1      PHE  10   9.295  -6.767   1.233
   75    HE2  PHE  10           HE2      PHE  10  10.687  -4.548   4.637
   76    HZ   PHE  10           HZ       PHE  10   8.968  -5.978   3.562
   77    H    PHE  11           HN       PHE  11  12.494  -4.560  -2.094
   78    HA   PHE  11           HA       PHE  11   9.750  -3.362  -2.114
   79   1HB   PHE  11          HB2       PHE  11  11.818  -3.786  -4.090
   80   2HB   PHE  11          HB1       PHE  11  10.347  -4.629  -4.576
   81    HD1  PHE  11           HD1      PHE  11   8.223  -2.954  -3.466
   82    HD2  PHE  11           HD2      PHE  11  11.902  -1.813  -5.365
   83    HE1  PHE  11           HE1      PHE  11   7.209  -0.797  -4.135
   84    HE2  PHE  11           HE2      PHE  11  10.885   0.344  -6.036
   85    HZ   PHE  11           HZ       PHE  11   8.537   0.855  -5.421
   86    H    VAL  12           HN       VAL  12   7.984  -4.725  -2.139
   87    HA   VAL  12           HA       VAL  12   8.045  -7.296  -1.041
   88    HB   VAL  12           HB       VAL  12   5.767  -7.470  -2.166
   89   1HG1  VAL  12          HG1       VAL  12   6.747  -5.352  -0.372
   90   2HG1  VAL  12          HG1       VAL  12   5.385  -6.457  -0.174
   91   3HG1  VAL  12          HG1       VAL  12   5.201  -4.993  -1.142
   92   1HG2  VAL  12          HG2       VAL  12   5.310  -6.185  -3.965
   93   2HG2  VAL  12          HG2       VAL  12   6.966  -5.582  -3.914
   94   3HG2  VAL  12          HG2       VAL  12   5.690  -4.724  -3.050
   95    H    SER  13           HN       SER  13   8.403  -9.354  -1.875
   96    HA   SER  13           HA       SER  13   9.761  -9.747  -4.353
   97   1HB   SER  13          HB2       SER  13   9.167 -12.160  -3.863
   98   2HB   SER  13          HB1       SER  13   9.899 -11.313  -2.503
   99    HG   SER  13           HG       SER  13   8.131 -11.679  -1.444
  100    H    LYS  14           HN       LYS  14   6.370  -9.538  -3.538
  101    HA   LYS  14           HA       LYS  14   5.641  -9.563  -6.382
  102   1HB   LYS  14          HB2       LYS  14   4.165 -11.505  -6.169
  103   2HB   LYS  14          HB1       LYS  14   5.798 -11.966  -5.691
  104   1HG   LYS  14          HG2       LYS  14   4.882 -11.183  -3.290
  105   2HG   LYS  14          HG1       LYS  14   3.349 -11.664  -4.018
  106   1HD   LYS  14          HD2       LYS  14   4.324 -13.867  -4.595
  107   2HD   LYS  14          HD1       LYS  14   5.836 -13.389  -3.819
  108   1HE   LYS  14          HE2       LYS  14   4.498 -12.999  -1.688
  109   2HE   LYS  14          HE1       LYS  14   3.133 -13.790  -2.500
  110   1HZ   LYS  14          HZ1       LYS  14   4.322 -15.503  -1.419
  111   2HZ   LYS  14          HZ2       LYS  14   5.823 -14.914  -1.958
  112   3HZ   LYS  14          HZ3       LYS  14   4.738 -15.622  -3.059
  113    H    ARG  15           HN       ARG  15   2.877  -9.939  -6.036
  114    HA   ARG  15           HA       ARG  15   2.125  -7.386  -4.832
  115   1HB   ARG  15          HB2       ARG  15  -0.099  -8.043  -5.709
  116   2HB   ARG  15          HB1       ARG  15   1.160  -8.281  -6.922
  117   1HG   ARG  15          HG2       ARG  15   0.436 -10.407  -7.098
  118   2HG   ARG  15          HG1       ARG  15   1.126 -10.679  -5.496
  119   1HD   ARG  15          HD2       ARG  15  -0.948 -10.985  -4.647
  120   2HD   ARG  15          HD1       ARG  15  -1.427  -9.371  -5.207
  121    HE   ARG  15           HE       ARG  15  -1.305 -11.439  -7.300
  122   1HH1  ARG  15          HH2       ARG  15  -3.435 -12.093  -5.212
  123   2HH1  ARG  15          HH2       ARG  15  -4.825 -11.327  -5.905
  124   1HH2  ARG  15          HH1       ARG  15  -2.987  -9.400  -8.126
  125   2HH2  ARG  15          HH1       ARG  15  -4.572  -9.806  -7.557
  126    H    ILE  16           HN       ILE  16  -0.462  -8.199  -3.820
  127    HA   ILE  16           HA       ILE  16   0.186  -9.974  -1.507
  128    HB   ILE  16           HB       ILE  16  -1.274  -7.458  -0.868
  129   1HG1  ILE  16          HG1       ILE  16   1.700  -7.433  -1.501
  130   2HG1  ILE  16          HG1       ILE  16   0.450  -6.512  -2.333
  131   1HG2  ILE  16          HG2       ILE  16  -0.782  -8.324   1.143
  132   2HG2  ILE  16          HG2       ILE  16   0.900  -7.886   0.857
  133   3HG2  ILE  16          HG2       ILE  16   0.324  -9.494   0.427
  134   1HD1  ILE  16          HD1       ILE  16   1.030  -6.226   0.630
  135   2HD1  ILE  16          HD1       ILE  16   0.005  -5.189  -0.363
  136   3HD1  ILE  16          HD1       ILE  16   1.752  -5.194  -0.603
  137    HA   PRO  17           HA       PRO  17  -4.100 -10.923  -2.102
  138   1HB   PRO  17          HB2       PRO  17  -4.654 -12.141   0.277
  139   2HB   PRO  17          HB1       PRO  17  -3.638 -12.879  -0.977
  140   1HG   PRO  17          HG2       PRO  17  -2.880 -11.794   1.609
  141   2HG   PRO  17          HG1       PRO  17  -1.973 -12.847   0.520
  142   1HD   PRO  17          HD2       PRO  17  -1.717 -10.000   0.910
  143   2HD   PRO  17          HD1       PRO  17  -0.704 -11.078  -0.075
  144    H    GLU  18           HN       GLU  18  -5.615  -9.283  -2.108
  145    HA   GLU  18           HA       GLU  18  -5.900  -7.102  -0.431
  146   1HB   GLU  18          HB2       GLU  18  -7.191  -8.121  -2.573
  147   2HB   GLU  18          HB1       GLU  18  -8.404  -8.434  -1.330
  148   1HG   GLU  18          HG2       GLU  18  -8.848  -6.217  -1.016
  149   2HG   GLU  18          HG1       GLU  18  -7.163  -5.746  -1.242
  150    H    ASN  19           HN       ASN  19  -7.183 -10.369   0.156
  151    HA   ASN  19           HA       ASN  19  -8.861  -9.751   2.381
  152   1HB   ASN  19          HB2       ASN  19  -7.246 -12.219   1.666
  153   2HB   ASN  19          HB1       ASN  19  -8.556 -12.189   2.847
  154   1HD2  ASN  19          HD2       ASN  19 -10.681 -11.081   1.835
  155   2HD2  ASN  19          HD2       ASN  19 -11.082 -11.617   0.275
  156    H    ARG  20           HN       ARG  20  -5.421  -9.710   2.116
  157    HA   ARG  20           HA       ARG  20  -5.106  -9.933   5.077
  158   1HB   ARG  20          HB2       ARG  20  -3.268 -10.223   2.691
  159   2HB   ARG  20          HB1       ARG  20  -2.681 -10.226   4.351
  160   1HG   ARG  20          HG2       ARG  20  -4.690 -12.023   4.577
  161   2HG   ARG  20          HG1       ARG  20  -4.240 -12.288   2.894
  162   1HD   ARG  20          HD2       ARG  20  -2.042 -12.943   3.452
  163   2HD   ARG  20          HD1       ARG  20  -2.127 -12.179   5.053
  164    HE   ARG  20           HE       ARG  20  -4.118 -13.962   5.309
  165   1HH1  ARG  20          HH1       ARG  20  -0.775 -14.173   4.847
  166   2HH1  ARG  20          HH1       ARG  20  -0.730 -15.901   4.750
  167   1HH2  ARG  20          HH2       ARG  20  -4.180 -16.255   4.760
  168   2HH2  ARG  20          HH2       ARG  20  -2.658 -17.080   4.700
  169    H    VAL  21           HN       VAL  21  -4.421  -7.858   2.286
  170    HA   VAL  21           HA       VAL  21  -2.886  -5.877   3.725
  171    HB   VAL  21           HB       VAL  21  -4.568  -5.592   1.216
  172   1HG1  VAL  21          HG1       VAL  21  -3.315  -3.627   2.567
  173   2HG1  VAL  21          HG1       VAL  21  -3.413  -3.650   0.807
  174   3HG1  VAL  21          HG1       VAL  21  -1.954  -4.222   1.616
  175   1HG2  VAL  21          HG2       VAL  21  -2.214  -7.206   1.783
  176   2HG2  VAL  21          HG2       VAL  21  -1.876  -6.008   0.535
  177   3HG2  VAL  21          HG2       VAL  21  -3.199  -7.153   0.322
  178    H    VAL  22           HN       VAL  22  -3.606  -3.790   4.483
  179    HA   VAL  22           HA       VAL  22  -6.557  -3.579   4.890
  180    HB   VAL  22           HB       VAL  22  -5.850  -2.441   7.048
  181   1HG1  VAL  22          HG1       VAL  22  -4.848  -5.267   6.905
  182   2HG1  VAL  22          HG1       VAL  22  -6.560  -4.894   6.714
  183   3HG1  VAL  22          HG1       VAL  22  -5.730  -4.478   8.214
  184   1HG2  VAL  22          HG2       VAL  22  -3.189  -3.711   6.372
  185   2HG2  VAL  22          HG2       VAL  22  -3.595  -2.896   7.880
  186   3HG2  VAL  22          HG2       VAL  22  -3.507  -1.977   6.380
  187    H    SER  23           HN       SER  23  -3.501  -1.819   4.478
  188    HA   SER  23           HA       SER  23  -4.761   0.303   2.958
  189   1HB   SER  23          HB2       SER  23  -5.667   0.821   5.152
  190   2HB   SER  23          HB1       SER  23  -4.068   0.706   5.882
  191    HG   SER  23           HG       SER  23  -3.757   2.702   5.322
  192    H    TYR  24           HN       TYR  24  -3.133   1.705   2.063
  193    HA   TYR  24           HA       TYR  24  -0.366   0.763   2.542
  194   1HB   TYR  24          HB2       TYR  24   0.019   1.563   0.316
  195   2HB   TYR  24          HB1       TYR  24  -1.527   0.730   0.294
  196    HD1  TYR  24           HD1      TYR  24  -3.602   1.935  -0.044
  197    HD2  TYR  24           HD2      TYR  24   0.125   4.045   0.265
  198    HE1  TYR  24           HE1      TYR  24  -4.706   3.999  -0.861
  199    HE2  TYR  24           HE2      TYR  24  -0.978   6.111  -0.552
  200    HH   TYR  24           HH       TYR  24  -3.549   6.304  -2.171
  201    H    GLN  25           HN       GLN  25   1.286   2.563   2.042
  202    HA   GLN  25           HA       GLN  25   0.565   5.203   3.221
  203   1HB   GLN  25          HB2       GLN  25   2.414   3.087   4.231
  204   2HB   GLN  25          HB1       GLN  25   3.004   4.747   4.320
  205   1HG   GLN  25          HG2       GLN  25   1.882   4.644   6.335
  206   2HG   GLN  25          HG1       GLN  25   0.558   5.174   5.296
  207   1HE2  GLN  25          HE2       GLN  25  -0.559   3.948   7.301
  208   2HE2  GLN  25          HE2       GLN  25  -0.907   2.310   7.020
  209    H    LEU  26           HN       LEU  26   0.832   6.083   1.090
  210    HA   LEU  26           HA       LEU  26   2.830   5.429  -0.757
  211   1HB   LEU  26          HB2       LEU  26   0.961   7.629  -0.216
  212   2HB   LEU  26          HB1       LEU  26   2.364   8.108  -1.174
  213    HG   LEU  26           HG       LEU  26   0.552   5.752  -1.786
  214   1HD1  LEU  26          HD1       LEU  26   0.127   7.295  -3.857
  215   2HD1  LEU  26          HD1       LEU  26   0.693   8.584  -2.795
  216   3HD1  LEU  26          HD1       LEU  26  -0.725   7.634  -2.353
  217   1HD2  LEU  26          HD2       LEU  26   1.838   5.827  -3.972
  218   2HD2  LEU  26          HD2       LEU  26   2.787   5.311  -2.583
  219   3HD2  LEU  26          HD2       LEU  26   2.951   6.951  -3.197
  220    H    SER  27           HN       SER  27   4.782   6.510  -1.369
  221    HA   SER  27           HA       SER  27   6.084   8.392   0.466
  222   1HB   SER  27          HB2       SER  27   6.300   6.180   1.582
  223   2HB   SER  27          HB1       SER  27   7.065   5.538   0.131
  224    HG   SER  27           HG       SER  27   7.996   7.675   1.756
  225    H    SER  28           HN       SER  28   6.106   9.514  -1.677
  226    HA   SER  28           HA       SER  28   7.363   8.488  -4.017
  227   1HB   SER  28          HB2       SER  28   5.933  10.610  -3.563
  228   2HB   SER  28          HB1       SER  28   7.459  11.368  -3.117
  229    HG   SER  28           HG       SER  28   6.850  10.082  -5.580
  230    H    ARG  29           HN       ARG  29   9.393  10.312  -4.643
  231    HA   ARG  29           HA       ARG  29  11.732   9.098  -3.613
  232   1HB   ARG  29          HB2       ARG  29  10.991  11.018  -5.502
  233   2HB   ARG  29          HB1       ARG  29  12.053  11.895  -4.401
  234   1HG   ARG  29          HG2       ARG  29  13.276   9.386  -4.796
  235   2HG   ARG  29          HG1       ARG  29  12.743   9.914  -6.392
  236   1HD   ARG  29          HD2       ARG  29  13.787  12.245  -5.339
  237   2HD   ARG  29          HD1       ARG  29  14.884  11.006  -4.696
  238    HE   ARG  29           HE       ARG  29  14.539  10.236  -7.324
  239   1HH1  ARG  29          HH1       ARG  29  14.055  13.175  -7.855
  240   2HH1  ARG  29          HH1       ARG  29  15.653  13.730  -8.216
  241   1HH2  ARG  29          HH2       ARG  29  17.211  10.943  -6.866
  242   2HH2  ARG  29          HH2       ARG  29  17.442  12.467  -7.655
  243    H    SER  30           HN       SER  30  11.575   9.052  -1.277
  244    HA   SER  30           HA       SER  30  11.975  11.728   0.025
  245   1HB   SER  30          HB2       SER  30  10.962  10.326   2.019
  246   2HB   SER  30          HB1       SER  30   9.895  10.986   0.785
  247    HG   SER  30           HG       SER  30  10.314   8.438   1.451
  248    H    THR  31           HN       THR  31  14.270  11.575  -0.025
  249    HA   THR  31           HA       THR  31  16.428  10.743   0.501
  250    HB   THR  31           HB       THR  31  15.470  11.881   2.510
  251    HG1  THR  31           HG1      THR  31  17.162   9.650   2.929
  252   1HG2  THR  31          HG2       THR  31  14.801  10.311   4.404
  253   2HG2  THR  31          HG2       THR  31  14.656   9.049   3.182
  254   3HG2  THR  31          HG2       THR  31  13.631  10.481   3.096
  255    H    CYS  32           HN       CYS  32  14.816   8.659  -0.718
  256    HA   CYS  32           HA       CYS  32  15.887   6.266   0.745
  257   1HB   CYS  32          HB2       CYS  32  13.262   6.896  -0.555
  258   2HB   CYS  32          HB1       CYS  32  13.831   5.226  -0.592
  259    H    LEU  33           HN       LEU  33  16.054   4.344  -0.901
  260    HA   LEU  33           HA       LEU  33  17.791   5.190  -3.077
  261   1HB   LEU  33          HB2       LEU  33  16.843   2.684  -1.784
  262   2HB   LEU  33          HB1       LEU  33  17.436   2.539  -3.438
  263    HG   LEU  33           HG       LEU  33  19.261   4.228  -2.092
  264   1HD1  LEU  33          HD1       LEU  33  18.886   3.592   0.080
  265   2HD1  LEU  33          HD1       LEU  33  19.893   2.224  -0.396
  266   3HD1  LEU  33          HD1       LEU  33  18.137   2.067  -0.387
  267   1HD2  LEU  33          HD2       LEU  33  19.656   2.546  -3.934
  268   2HD2  LEU  33          HD2       LEU  33  19.537   1.273  -2.719
  269   3HD2  LEU  33          HD2       LEU  33  20.835   2.463  -2.625
  270    H    LYS  34           HN       LYS  34  14.469   3.994  -2.816
  271    HA   LYS  34           HA       LYS  34  14.110   4.613  -5.727
  272   1HB   LYS  34          HB2       LYS  34  13.932   2.094  -4.300
  273   2HB   LYS  34          HB1       LYS  34  12.383   2.494  -5.039
  274   1HG   LYS  34          HG2       LYS  34  13.196   1.824  -7.024
  275   2HG   LYS  34          HG1       LYS  34  14.376   3.134  -6.951
  276   1HD   LYS  34          HD2       LYS  34  15.599   1.065  -7.205
  277   2HD   LYS  34          HD1       LYS  34  15.837   1.625  -5.550
  278   1HE   LYS  34          HE2       LYS  34  13.657   0.131  -5.118
  279   2HE   LYS  34          HE1       LYS  34  14.279  -0.726  -6.542
  280   1HZ   LYS  34          HZ1       LYS  34  16.427  -0.896  -5.505
  281   2HZ   LYS  34          HZ2       LYS  34  15.264  -1.539  -4.447
  282   3HZ   LYS  34          HZ3       LYS  34  15.908   0.008  -4.167
  283    H    ALA  35           HN       ALA  35  11.397   4.096  -5.898
  284    HA   ALA  35           HA       ALA  35  10.086   5.618  -3.695
  285   1HB   ALA  35          HB1       ALA  35  11.020   6.925  -5.849
  286   2HB   ALA  35          HB2       ALA  35   9.514   7.391  -5.062
  287   3HB   ALA  35          HB3       ALA  35   9.476   6.391  -6.513
  288    H    GLY  36           HN       GLY  36   8.264   4.490  -3.166
  289   1HA   GLY  36          HA2       GLY  36   6.456   3.506  -5.240
  290   2HA   GLY  36          HA1       GLY  36   7.236   2.216  -4.318
  291    H    VAL  37           HN       VAL  37   4.917   1.769  -3.595
  292    HA   VAL  37           HA       VAL  37   4.027   3.739  -1.517
  293    HB   VAL  37           HB       VAL  37   2.555   1.386  -2.735
  294   1HG1  VAL  37          HG1       VAL  37   0.571   2.742  -1.958
  295   2HG1  VAL  37          HG1       VAL  37   1.703   3.821  -1.145
  296   3HG1  VAL  37          HG1       VAL  37   1.585   2.133  -0.650
  297   1HG2  VAL  37          HG2       VAL  37   1.516   3.833  -3.694
  298   2HG2  VAL  37          HG2       VAL  37   2.376   2.607  -4.625
  299   3HG2  VAL  37          HG2       VAL  37   3.264   3.941  -3.889
  300    H    ILE  38           HN       ILE  38   3.075   2.639   0.484
  301    HA   ILE  38           HA       ILE  38   4.679   0.194   1.169
  302    HB   ILE  38           HB       ILE  38   3.947   2.674   2.748
  303   1HG1  ILE  38          HG1       ILE  38   6.588   2.362   3.068
  304   2HG1  ILE  38          HG1       ILE  38   6.418   1.501   1.539
  305   1HG2  ILE  38          HG2       ILE  38   5.364   1.448   4.555
  306   2HG2  ILE  38          HG2       ILE  38   4.955  -0.016   3.661
  307   3HG2  ILE  38          HG2       ILE  38   3.675   0.977   4.360
  308   1HD1  ILE  38          HD1       ILE  38   6.899   3.856   1.096
  309   2HD1  ILE  38          HD1       ILE  38   5.537   4.349   2.099
  310   3HD1  ILE  38          HD1       ILE  38   5.252   3.495   0.585
  311    H    PHE  39           HN       PHE  39   3.268  -1.529   1.380
  312    HA   PHE  39           HA       PHE  39   0.506  -0.925   2.333
  313   1HB   PHE  39          HB2       PHE  39   1.776  -3.026   0.606
  314   2HB   PHE  39          HB1       PHE  39   0.220  -3.348   1.373
  315    HD1  PHE  39           HD1      PHE  39  -1.740  -2.610   0.347
  316    HD2  PHE  39           HD2      PHE  39   1.987  -0.721  -0.625
  317    HE1  PHE  39           HE1      PHE  39  -2.881  -1.240  -1.368
  318    HE2  PHE  39           HE2      PHE  39   0.842   0.647  -2.343
  319    HZ   PHE  39           HZ       PHE  39  -1.593   0.387  -2.721
  320    H    THR  40           HN       THR  40  -0.319  -1.940   4.130
  321    HA   THR  40           HA       THR  40   1.573  -3.627   5.706
  322    HB   THR  40           HB       THR  40  -0.603  -1.654   6.448
  323    HG1  THR  40           HG1      THR  40   1.035  -0.404   6.772
  324   1HG2  THR  40          HG2       THR  40   0.761  -2.495   8.769
  325   2HG2  THR  40          HG2       THR  40   0.317  -3.970   7.910
  326   3HG2  THR  40          HG2       THR  40  -0.926  -2.802   8.355
  327    H    THR  41           HN       THR  41   0.717  -5.528   6.657
  328    HA   THR  41           HA       THR  41  -1.773  -6.539   5.424
  329    HB   THR  41           HB       THR  41   0.017  -8.062   7.287
  330    HG1  THR  41           HG1      THR  41   1.460  -8.373   5.605
  331   1HG2  THR  41          HG2       THR  41  -1.686  -8.644   4.877
  332   2HG2  THR  41          HG2       THR  41  -1.764  -9.367   6.483
  333   3HG2  THR  41          HG2       THR  41  -0.438  -9.778   5.395
  334    H    LYS  42           HN       LYS  42  -3.392  -7.620   6.826
  335    HA   LYS  42           HA       LYS  42  -4.163  -6.056   9.105
  336   1HB   LYS  42          HB2       LYS  42  -5.854  -7.873   9.344
  337   2HB   LYS  42          HB1       LYS  42  -5.707  -7.326   7.673
  338   1HG   LYS  42          HG2       LYS  42  -4.565  -9.253   7.002
  339   2HG   LYS  42          HG1       LYS  42  -4.027  -9.622   8.640
  340   1HD   LYS  42          HD2       LYS  42  -6.494  -9.993   9.213
  341   2HD   LYS  42          HD1       LYS  42  -6.797  -9.961   7.475
  342   1HE   LYS  42          HE2       LYS  42  -5.246 -11.840   7.142
  343   2HE   LYS  42          HE1       LYS  42  -4.873 -11.855   8.877
  344   1HZ   LYS  42          HZ1       LYS  42  -7.153 -12.287   9.385
  345   2HZ   LYS  42          HZ2       LYS  42  -6.660 -13.435   8.235
  346   3HZ   LYS  42          HZ3       LYS  42  -7.615 -12.113   7.762
  347    H    LYS  43           HN       LYS  43  -2.028  -8.778   8.735
  348    HA   LYS  43           HA       LYS  43  -2.161  -9.831  11.414
  349   1HB   LYS  43          HB2       LYS  43  -0.981 -10.455   8.999
  350   2HB   LYS  43          HB1       LYS  43   0.407  -9.970   9.974
  351   1HG   LYS  43          HG2       LYS  43   0.072 -11.665  11.542
  352   2HG   LYS  43          HG1       LYS  43  -1.639 -11.834  11.142
  353   1HD   LYS  43          HD2       LYS  43  -0.777 -12.590   8.802
  354   2HD   LYS  43          HD1       LYS  43   0.758 -12.854   9.630
  355   1HE   LYS  43          HE2       LYS  43  -0.569 -14.234  11.345
  356   2HE   LYS  43          HE1       LYS  43  -1.901 -14.198  10.172
  357   1HZ   LYS  43          HZ1       LYS  43   0.870 -15.152   9.677
  358   2HZ   LYS  43          HZ2       LYS  43  -0.313 -14.972   8.470
  359   3HZ   LYS  43          HZ3       LYS  43  -0.533 -16.103   9.719
  360    H    GLY  44           HN       GLY  44  -0.570  -7.061   9.993
  361   1HA   GLY  44          HA2       GLY  44   0.074  -5.256  11.584
  362   2HA   GLY  44          HA1       GLY  44   0.719  -6.522  12.625
  363    H    GLN  45           HN       GLN  45   1.172  -6.763   9.181
  364    HA   GLN  45           HA       GLN  45   4.103  -6.412   9.594
  365   1HB   GLN  45          HB2       GLN  45   2.446  -8.221   8.209
  366   2HB   GLN  45          HB1       GLN  45   3.240  -7.267   6.956
  367   1HG   GLN  45          HG2       GLN  45   5.430  -7.693   8.166
  368   2HG   GLN  45          HG1       GLN  45   4.559  -8.856   9.169
  369   1HE2  GLN  45          HE2       GLN  45   5.310 -10.854   8.372
  370   2HE2  GLN  45          HE2       GLN  45   5.221 -11.321   6.742
  371    H    GLN  46           HN       GLN  46   5.015  -5.634   7.192
  372    HA   GLN  46           HA       GLN  46   3.475  -3.386   6.090
  373   1HB   GLN  46          HB2       GLN  46   4.362  -2.480   8.197
  374   2HB   GLN  46          HB1       GLN  46   5.989  -2.993   7.751
  375   1HG   GLN  46          HG2       GLN  46   5.198  -1.529   5.545
  376   2HG   GLN  46          HG1       GLN  46   4.475  -0.634   6.882
  377   1HE2  GLN  46          HE2       GLN  46   7.578  -2.469   6.704
  378   2HE2  GLN  46          HE2       GLN  46   8.549  -1.155   7.163
  379    H    SER  47           HN       SER  47   3.866  -4.124   3.983
  380    HA   SER  47           HA       SER  47   6.728  -4.540   3.187
  381   1HB   SER  47          HB2       SER  47   5.920  -6.150   1.676
  382   2HB   SER  47          HB1       SER  47   4.829  -6.344   3.046
  383    HG   SER  47           HG       SER  47   3.515  -4.693   1.865
  384    H    CYS  48           HN       CYS  48   7.487  -3.431   1.334
  385    HA   CYS  48           HA       CYS  48   6.077  -0.961   0.650
  386   1HB   CYS  48          HB2       CYS  48   8.623  -1.493   0.930
  387   2HB   CYS  48          HB1       CYS  48   8.509  -2.065  -0.735
  388    H    GLY  49           HN       GLY  49   4.531  -0.882  -0.945
  389   1HA   GLY  49          HA2       GLY  49   4.370  -3.090  -2.896
  390   2HA   GLY  49          HA1       GLY  49   3.173  -1.816  -2.685
  391    H    ASP  50           HN       ASP  50   4.767  -2.827  -5.068
  392    HA   ASP  50           HA       ASP  50   6.324  -0.433  -5.823
  393   1HB   ASP  50          HB2       ASP  50   7.230  -2.600  -6.363
  394   2HB   ASP  50          HB1       ASP  50   5.716  -3.112  -7.103
  395    HA   PRO  51           HA       PRO  51   2.649   1.306  -7.666
  396   1HB   PRO  51          HB2       PRO  51   3.873   3.403  -8.946
  397   2HB   PRO  51          HB1       PRO  51   3.514   3.401  -7.208
  398   1HG   PRO  51          HG2       PRO  51   6.082   2.820  -8.608
  399   2HG   PRO  51          HG1       PRO  51   5.790   3.739  -7.120
  400   1HD   PRO  51          HD2       PRO  51   6.701   1.191  -7.100
  401   2HD   PRO  51          HD1       PRO  51   5.659   1.846  -5.817
  402    H    LYS  52           HN       LYS  52   5.525   0.260  -9.326
  403    HA   LYS  52           HA       LYS  52   4.590   0.575 -12.040
  404   1HB   LYS  52          HB2       LYS  52   6.528  -1.449 -10.867
  405   2HB   LYS  52          HB1       LYS  52   6.487  -0.869 -12.532
  406   1HG   LYS  52          HG2       LYS  52   6.635   1.407 -10.807
  407   2HG   LYS  52          HG1       LYS  52   7.882   0.264 -10.311
  408   1HD   LYS  52          HD2       LYS  52   8.343   0.081 -12.893
  409   2HD   LYS  52          HD1       LYS  52   7.525   1.642 -12.953
  410   1HE   LYS  52          HE2       LYS  52   9.673   2.407 -12.559
  411   2HE   LYS  52          HE1       LYS  52   9.205   2.102 -10.876
  412   1HZ   LYS  52          HZ1       LYS  52  11.136   0.863 -11.099
  413   2HZ   LYS  52          HZ2       LYS  52  10.784   0.395 -12.694
  414   3HZ   LYS  52          HZ3       LYS  52   9.933  -0.296 -11.394
  415    H    GLN  53           HN       GLN  53   3.993  -1.738  -9.493
  416    HA   GLN  53           HA       GLN  53   2.937  -3.833 -11.250
  417   1HB   GLN  53          HB2       GLN  53   3.388  -3.310  -8.360
  418   2HB   GLN  53          HB1       GLN  53   2.089  -4.433  -8.747
  419   1HG   GLN  53          HG2       GLN  53   4.848  -4.676  -9.956
  420   2HG   GLN  53          HG1       GLN  53   4.401  -5.476  -8.449
  421   1HE2  GLN  53          HE2       GLN  53   5.079  -7.135 -10.573
  422   2HE2  GLN  53          HE2       GLN  53   3.691  -7.882 -11.202
  423    H    GLU  54           HN       GLU  54   0.613  -4.537 -10.997
  424    HA   GLU  54           HA       GLU  54  -1.158  -2.170 -11.121
  425   1HB   GLU  54          HB2       GLU  54  -0.891  -4.579 -12.484
  426   2HB   GLU  54          HB1       GLU  54  -2.337  -4.822 -11.503
  427   1HG   GLU  54          HG2       GLU  54  -3.462  -3.011 -12.485
  428   2HG   GLU  54          HG1       GLU  54  -1.968  -2.266 -13.053
  429    H    TRP  55           HN       TRP  55  -0.407  -4.658  -8.771
  430    HA   TRP  55           HA       TRP  55  -3.050  -4.620  -7.523
  431   1HB   TRP  55          HB2       TRP  55  -1.989  -6.031  -5.879
  432   2HB   TRP  55          HB1       TRP  55  -1.405  -6.509  -7.463
  433    HD1  TRP  55           HD1      TRP  55   1.123  -6.167  -7.999
  434    HE1  TRP  55           HE1      TRP  55   3.162  -5.570  -6.531
  435    HE3  TRP  55           HE3      TRP  55  -1.246  -4.535  -3.777
  436    HZ2  TRP  55           HZ2      TRP  55   3.712  -4.569  -3.956
  437    HZ3  TRP  55           HZ3      TRP  55   0.072  -3.762  -1.824
  438    HH2  TRP  55           HH2      TRP  55   2.553  -3.773  -1.908
  439    H    VAL  56           HN       VAL  56  -0.012  -2.798  -7.038
  440    HA   VAL  56           HA       VAL  56  -0.906  -1.558  -4.562
  441    HB   VAL  56           HB       VAL  56   1.020  -0.541  -6.692
  442   1HG1  VAL  56          HG1       VAL  56   0.089   0.446  -4.102
  443   2HG1  VAL  56          HG1       VAL  56   1.004   1.289  -5.350
  444   3HG1  VAL  56          HG1       VAL  56   1.843   0.287  -4.165
  445   1HG2  VAL  56          HG2       VAL  56   1.734  -2.738  -5.906
  446   2HG2  VAL  56          HG2       VAL  56   1.475  -2.254  -4.230
  447   3HG2  VAL  56          HG2       VAL  56   2.766  -1.508  -5.172
  448    H    GLN  57           HN       GLN  57  -1.032  -0.736  -8.011
  449    HA   GLN  57           HA       GLN  57  -2.442   1.767  -7.736
  450   1HB   GLN  57          HB2       GLN  57  -1.183   0.250  -9.700
  451   2HB   GLN  57          HB1       GLN  57  -2.880   0.160 -10.167
  452   1HG   GLN  57          HG2       GLN  57  -1.393   2.729  -9.550
  453   2HG   GLN  57          HG1       GLN  57  -1.718   2.122 -11.174
  454   1HE2  GLN  57          HE2       GLN  57  -4.384   1.177 -10.831
  455   2HE2  GLN  57          HE2       GLN  57  -5.394   2.498 -10.490
  456    H    ARG  58           HN       ARG  58  -3.508  -1.505  -8.709
  457    HA   ARG  58           HA       ARG  58  -6.290  -1.111  -8.854
  458   1HB   ARG  58          HB2       ARG  58  -5.136  -3.162  -9.510
  459   2HB   ARG  58          HB1       ARG  58  -4.604  -3.434  -7.852
  460   1HG   ARG  58          HG2       ARG  58  -7.238  -3.319  -7.395
  461   2HG   ARG  58          HG1       ARG  58  -7.289  -3.850  -9.076
  462   1HD   ARG  58          HD2       ARG  58  -5.387  -5.534  -8.149
  463   2HD   ARG  58          HD1       ARG  58  -6.339  -5.310  -6.668
  464    HE   ARG  58           HE       ARG  58  -8.173  -5.668  -8.797
  465   1HH1  ARG  58          HH2       ARG  58  -6.870  -7.278  -6.217
  466   2HH1  ARG  58          HH2       ARG  58  -7.067  -8.875  -6.857
  467   1HH2  ARG  58          HH1       ARG  58  -7.938  -7.780 -10.031
  468   2HH2  ARG  58          HH1       ARG  58  -7.666  -9.160  -9.018
  469    H    TYR  59           HN       TYR  59  -4.247  -1.861  -6.047
  470    HA   TYR  59           HA       TYR  59  -6.324  -2.018  -4.081
  471   1HB   TYR  59          HB2       TYR  59  -3.362  -1.484  -4.152
  472   2HB   TYR  59          HB1       TYR  59  -4.241  -1.331  -2.638
  473    HD1  TYR  59           HD1      TYR  59  -3.161  -3.162  -1.525
  474    HD2  TYR  59           HD2      TYR  59  -5.172  -3.794  -5.271
  475    HE1  TYR  59           HE1      TYR  59  -3.053  -5.610  -1.163
  476    HE2  TYR  59           HE2      TYR  59  -5.063  -6.245  -4.902
  477    HH   TYR  59           HH       TYR  59  -3.215  -7.776  -3.224
  478    H    MET  60           HN       MET  60  -4.041   0.622  -4.827
  479    HA   MET  60           HA       MET  60  -5.030   2.637  -3.168
  480   1HB   MET  60          HB2       MET  60  -3.289   2.335  -5.365
  481   2HB   MET  60          HB1       MET  60  -4.364   3.672  -5.757
  482   1HG   MET  60          HG2       MET  60  -3.695   4.935  -3.903
  483   2HG   MET  60          HG1       MET  60  -3.124   3.515  -3.027
  484   1HE   MET  60          HE1       MET  60  -1.769   1.976  -3.968
  485   2HE   MET  60          HE2       MET  60  -0.076   2.460  -4.010
  486   3HE   MET  60          HE3       MET  60  -0.924   2.117  -5.516
  487    H    LYS  61           HN       LYS  61  -6.425   1.335  -6.104
  488    HA   LYS  61           HA       LYS  61  -8.277   3.501  -6.630
  489   1HB   LYS  61          HB2       LYS  61  -7.389   1.558  -8.119
  490   2HB   LYS  61          HB1       LYS  61  -8.660   0.598  -7.362
  491   1HG   LYS  61          HG2       LYS  61 -10.321   2.334  -8.056
  492   2HG   LYS  61          HG1       LYS  61  -9.031   3.173  -8.917
  493   1HD   LYS  61          HD2       LYS  61  -8.794   1.456 -10.499
  494   2HD   LYS  61          HD1       LYS  61  -9.568   0.261  -9.457
  495   1HE   LYS  61          HE2       LYS  61 -11.728   1.545  -9.699
  496   2HE   LYS  61          HE1       LYS  61 -10.918   2.562 -10.908
  497   1HZ   LYS  61          HZ1       LYS  61 -10.320   0.560 -12.133
  498   2HZ   LYS  61          HZ2       LYS  61 -12.006   0.680 -11.969
  499   3HZ   LYS  61          HZ3       LYS  61 -11.133  -0.402 -10.994
  500    H    ASN  62           HN       ASN  62  -8.794   0.210  -5.279
  501    HA   ASN  62           HA       ASN  62 -11.489   0.682  -4.421
  502   1HB   ASN  62          HB2       ASN  62  -9.634  -1.400  -4.528
  503   2HB   ASN  62          HB1       ASN  62  -9.927  -1.190  -2.802
  504   1HD2  ASN  62          HD2       ASN  62 -11.749  -1.497  -5.901
  505   2HD2  ASN  62          HD2       ASN  62 -13.069  -2.311  -5.212
  506    H    LEU  63           HN       LEU  63  -8.347   1.169  -2.876
  507    HA   LEU  63           HA       LEU  63  -9.290   1.732  -0.227
  508   1HB   LEU  63          HB2       LEU  63  -6.841   2.031  -1.881
  509   2HB   LEU  63          HB1       LEU  63  -6.933   3.059  -0.446
  510    HG   LEU  63           HG       LEU  63  -7.637   0.153  -0.211
  511   1HD1  LEU  63          HD1       LEU  63  -4.902   0.552   0.527
  512   2HD1  LEU  63          HD1       LEU  63  -5.107   1.097  -1.138
  513   3HD1  LEU  63          HD1       LEU  63  -5.555  -0.547  -0.686
  514   1HD2  LEU  63          HD2       LEU  63  -6.379   2.232   1.609
  515   2HD2  LEU  63          HD2       LEU  63  -6.662   0.552   2.066
  516   3HD2  LEU  63          HD2       LEU  63  -8.026   1.608   1.706
  517    H    ASP  64           HN       ASP  64  -8.647   3.805  -3.042
  518    HA   ASP  64           HA       ASP  64  -9.353   6.256  -1.578
  519   1HB   ASP  64          HB2       ASP  64  -8.470   5.459  -4.333
  520   2HB   ASP  64          HB1       ASP  64  -9.179   7.056  -4.098
  521    H    ALA  65           HN       ALA  65 -10.874   4.028  -3.867
  522    HA   ALA  65           HA       ALA  65 -13.163   5.656  -4.499
  523   1HB   ALA  65          HB1       ALA  65 -12.194   3.554  -5.633
  524   2HB   ALA  65          HB2       ALA  65 -13.951   3.646  -5.514
  525   3HB   ALA  65          HB3       ALA  65 -13.042   2.636  -4.389
  526    H    LYS  66           HN       LYS  66 -12.281   3.888  -1.656
  527    HA   LYS  66           HA       LYS  66 -14.817   3.117  -0.633
  528   1HB   LYS  66          HB2       LYS  66 -12.293   2.805   0.134
  529   2HB   LYS  66          HB1       LYS  66 -12.664   4.208   1.138
  530   1HG   LYS  66          HG2       LYS  66 -13.830   2.932   2.578
  531   2HG   LYS  66          HG1       LYS  66 -14.837   2.314   1.268
  532   1HD   LYS  66          HD2       LYS  66 -12.063   1.268   1.892
  533   2HD   LYS  66          HD1       LYS  66 -13.549   0.528   2.489
  534   1HE   LYS  66          HE2       LYS  66 -14.271  -0.055   0.294
  535   2HE   LYS  66          HE1       LYS  66 -13.081   1.023  -0.464
  536   1HZ   LYS  66          HZ1       LYS  66 -12.491  -1.445  -0.299
  537   2HZ   LYS  66          HZ2       LYS  66 -12.246  -1.150   1.357
  538   3HZ   LYS  66          HZ3       LYS  66 -11.319  -0.323   0.197
  539    H    GLN  67           HN       GLN  67 -13.083   6.213  -0.422
  540    HA   GLN  67           HA       GLN  67 -15.476   7.415   0.915
  541   1HB   GLN  67          HB2       GLN  67 -12.525   7.938   0.842
  542   2HB   GLN  67          HB1       GLN  67 -13.608   9.291   1.174
  543   1HG   GLN  67          HG2       GLN  67 -13.240   8.480   3.325
  544   2HG   GLN  67          HG1       GLN  67 -14.706   7.605   2.878
  545   1HE2  GLN  67          HE2       GLN  67 -11.218   7.092   2.083
  546   2HE2  GLN  67          HE2       GLN  67 -11.196   5.470   2.582
  547    H    LYS  68           HN       LYS  68 -12.959   8.457  -1.423
  548    HA   LYS  68           HA       LYS  68 -14.538  10.547  -2.584
  549   1HB   LYS  68          HB2       LYS  68 -11.944   9.564  -2.705
  550   2HB   LYS  68          HB1       LYS  68 -12.564   9.254  -4.328
  551   1HG   LYS  68          HG2       LYS  68 -13.165  11.574  -4.619
  552   2HG   LYS  68          HG1       LYS  68 -12.796  11.930  -2.931
  553   1HD   LYS  68          HD2       LYS  68 -10.860  12.657  -4.036
  554   2HD   LYS  68          HD1       LYS  68 -10.415  11.029  -3.521
  555   1HE   LYS  68          HE2       LYS  68  -9.944  10.598  -5.701
  556   2HE   LYS  68          HE1       LYS  68 -11.692  10.669  -6.000
  557   1HZ   LYS  68          HZ1       LYS  68 -10.510  12.297  -7.357
  558   2HZ   LYS  68          HZ2       LYS  68  -9.849  13.002  -5.960
  559   3HZ   LYS  68          HZ3       LYS  68 -11.525  13.066  -6.237
  560    H    LYS  69           HN       LYS  69 -16.632   9.443  -2.961
  561    HA   LYS  69           HA       LYS  69 -16.761   7.247  -4.905
  562   1HB   LYS  69          HB2       LYS  69 -19.198   7.548  -4.521
  563   2HB   LYS  69          HB1       LYS  69 -18.309   7.472  -2.998
  564   1HG   LYS  69          HG2       LYS  69 -19.043   9.518  -2.427
  565   2HG   LYS  69          HG1       LYS  69 -18.373  10.198  -3.910
  566   1HD   LYS  69          HD2       LYS  69 -20.545  10.619  -4.434
  567   2HD   LYS  69          HD1       LYS  69 -20.591   8.910  -4.869
  568   1HE   LYS  69          HE2       LYS  69 -20.963   8.943  -2.083
  569   2HE   LYS  69          HE1       LYS  69 -21.973  10.264  -2.705
  570   1HZ   LYS  69          HZ1       LYS  69 -21.897   7.482  -3.753
  571   2HZ   LYS  69          HZ2       LYS  69 -22.821   8.751  -4.404
  572   3HZ   LYS  69          HZ3       LYS  69 -23.157   8.166  -2.847
  573    H    ALA  70           HN       ALA  70 -15.415   9.177  -6.242
  574    HA   ALA  70           HA       ALA  70 -17.474  10.375  -8.070
  575   1HB   ALA  70          HB1       ALA  70 -14.817  11.453  -7.075
  576   2HB   ALA  70          HB2       ALA  70 -16.419  12.094  -6.712
  577   3HB   ALA  70          HB3       ALA  70 -15.768  12.217  -8.347
  578    H    SER  71           HN       SER  71 -16.483   7.816  -8.567
  579    HA   SER  71           HA       SER  71 -14.099   7.791 -10.193
  580   1HB   SER  71          HB2       SER  71 -16.125   6.000  -9.193
  581   2HB   SER  71          HB1       SER  71 -15.828   5.667 -10.896
  582    HG   SER  71           HG       SER  71 -13.860   5.028 -10.430
  583    HA   PRO  72           HA       PRO  72 -17.087   7.782 -13.910
  584   1HB   PRO  72          HB2       PRO  72 -19.742   8.242 -13.463
  585   2HB   PRO  72          HB1       PRO  72 -19.023   6.619 -13.457
  586   1HG   PRO  72          HG2       PRO  72 -19.765   8.367 -11.174
  587   2HG   PRO  72          HG1       PRO  72 -19.907   6.611 -11.348
  588   1HD   PRO  72          HD2       PRO  72 -17.930   7.837  -9.917
  589   2HD   PRO  72          HD1       PRO  72 -17.750   6.243 -10.677
  590    H    ARG  73           HN       ARG  73 -17.202   9.661 -15.146
  591    HA   ARG  73           HA       ARG  73 -18.244  12.160 -13.948
  592   1HB   ARG  73          HB2       ARG  73 -15.655  11.531 -13.514
  593   2HB   ARG  73          HB1       ARG  73 -15.496  12.309 -15.090
  594   1HG   ARG  73          HG2       ARG  73 -17.203  14.017 -13.750
  595   2HG   ARG  73          HG1       ARG  73 -16.100  13.498 -12.475
  596   1HD   ARG  73          HD2       ARG  73 -14.691  14.090 -14.975
  597   2HD   ARG  73          HD1       ARG  73 -15.565  15.496 -14.331
  598    HE   ARG  73           HE       ARG  73 -13.594  13.886 -12.750
  599   1HH1  ARG  73          HH2       ARG  73 -15.578  15.488 -11.165
  600   2HH1  ARG  73          HH2       ARG  73 -14.735  16.984 -10.937
  601   1HH2  ARG  73          HH1       ARG  73 -12.412  16.359 -13.434
  602   2HH2  ARG  73          HH1       ARG  73 -12.940  17.476 -12.221
  Start of MODEL   18
    1   1H    VAL   1          HT1       VAL   1  -4.627   6.794  10.506
    2   2H    VAL   1          HT2       VAL   1  -4.476   6.999   8.827
    3   3H    VAL   1          HT3       VAL   1  -4.889   8.319   9.813
    4    HA   VAL   1           HA       VAL   1  -2.742   8.447  10.752
    5    HB   VAL   1           HB       VAL   1  -2.592   6.035  11.150
    6   1HG1  VAL   1          HG1       VAL   1  -2.273   5.914   8.138
    7   2HG1  VAL   1          HG1       VAL   1  -3.548   5.177   9.107
    8   3HG1  VAL   1          HG1       VAL   1  -1.897   4.564   9.210
    9   1HG2  VAL   1          HG2       VAL   1  -0.499   7.525  10.923
   10   2HG2  VAL   1          HG2       VAL   1  -0.271   6.758   9.352
   11   3HG2  VAL   1          HG2       VAL   1  -0.252   5.781  10.821
   12    H    VAL   2           HN       VAL   2  -0.732   9.107   9.580
   13    HA   VAL   2           HA       VAL   2  -1.048   9.235   6.603
   14    HB   VAL   2           HB       VAL   2  -1.965  11.292   7.544
   15   1HG1  VAL   2          HG1       VAL   2   0.243  12.529   8.785
   16   2HG1  VAL   2          HG1       VAL   2   0.177  10.897   9.453
   17   3HG1  VAL   2          HG1       VAL   2  -1.232  11.954   9.567
   18   1HG2  VAL   2          HG2       VAL   2  -0.335  11.348   5.548
   19   2HG2  VAL   2          HG2       VAL   2   0.853  11.979   6.689
   20   3HG2  VAL   2          HG2       VAL   2  -0.632  12.877   6.375
   21    H    ILE   3           HN       ILE   3   0.663   7.904   6.191
   22    HA   ILE   3           HA       ILE   3   3.185   7.918   7.568
   23    HB   ILE   3           HB       ILE   3   2.324   6.015   6.322
   24   1HG1  ILE   3          HG1       ILE   3   4.366   6.278   4.400
   25   2HG1  ILE   3          HG1       ILE   3   4.903   7.225   5.789
   26   1HG2  ILE   3          HG2       ILE   3   1.673   8.047   4.417
   27   2HG2  ILE   3          HG2       ILE   3   1.200   6.348   4.406
   28   3HG2  ILE   3          HG2       ILE   3   2.697   6.853   3.619
   29   1HD1  ILE   3          HD1       ILE   3   3.687   4.600   6.426
   30   2HD1  ILE   3          HD1       ILE   3   5.095   5.392   7.135
   31   3HD1  ILE   3          HD1       ILE   3   5.245   4.538   5.599
   32    HA   PRO   4           HA       PRO   4   4.780  11.522   5.478
   33   1HB   PRO   4          HB2       PRO   4   7.275  11.496   6.597
   34   2HB   PRO   4          HB1       PRO   4   5.831  12.052   7.464
   35   1HG   PRO   4          HG2       PRO   4   7.339   9.531   7.741
   36   2HG   PRO   4          HG1       PRO   4   6.377  10.411   8.929
   37   1HD   PRO   4          HD2       PRO   4   5.588   8.118   7.523
   38   2HD   PRO   4          HD1       PRO   4   4.535   9.186   8.474
   39    H    SER   5           HN       SER   5   7.724   9.607   5.875
   40    HA   SER   5           HA       SER   5   7.711   8.533   3.166
   41   1HB   SER   5          HB2       SER   5   9.368  10.046   2.255
   42   2HB   SER   5          HB1       SER   5   8.066  11.029   2.919
   43    HG   SER   5           HG       SER   5  10.688  10.781   3.700
   44    HA   PRO   6           HA       PRO   6  10.810   6.990   6.401
   45   1HB   PRO   6          HB2       PRO   6   9.602   4.619   7.015
   46   2HB   PRO   6          HB1       PRO   6   9.289   6.124   7.905
   47   1HG   PRO   6          HG2       PRO   6   7.682   4.824   5.767
   48   2HG   PRO   6          HG1       PRO   6   7.147   5.630   7.249
   49   1HD   PRO   6          HD2       PRO   6   7.048   6.807   4.804
   50   2HD   PRO   6          HD1       PRO   6   7.269   7.721   6.313
   51    H    CYS   7           HN       CYS   7   9.111   5.686   3.657
   52    HA   CYS   7           HA       CYS   7   9.800   4.234   1.926
   53   1HB   CYS   7          HB2       CYS   7  12.286   5.502   3.040
   54   2HB   CYS   7          HB1       CYS   7  12.440   4.263   1.794
   55    H    CYS   8           HN       CYS   8  11.200   2.185   1.541
   56    HA   CYS   8           HA       CYS   8  11.477   0.645   4.104
   57   1HB   CYS   8          HB2       CYS   8  10.561  -1.274   2.800
   58   2HB   CYS   8          HB1       CYS   8   9.426   0.075   2.874
   59    H    MET   9           HN       MET   9  12.583  -1.650   3.190
   60    HA   MET   9           HA       MET   9  15.173  -0.730   2.018
   61   1HB   MET   9          HB2       MET   9  15.258  -1.767   4.222
   62   2HB   MET   9          HB1       MET   9  14.337  -3.155   3.644
   63   1HG   MET   9          HG2       MET   9  16.126  -4.005   2.420
   64   2HG   MET   9          HG1       MET   9  16.893  -2.427   2.253
   65   1HE   MET   9          HE1       MET   9  16.403  -5.579   4.009
   66   2HE   MET   9          HE2       MET   9  15.604  -4.716   5.322
   67   3HE   MET   9          HE3       MET   9  17.171  -5.473   5.600
   68    H    PHE  10           HN       PHE  10  13.690  -3.969   2.023
   69    HA   PHE  10           HA       PHE  10  14.387  -4.279  -0.831
   70   1HB   PHE  10          HB2       PHE  10  13.864  -6.624  -0.373
   71   2HB   PHE  10          HB1       PHE  10  14.846  -5.991   0.948
   72    HD1  PHE  10           HD1      PHE  10  11.337  -6.746  -0.084
   73    HD2  PHE  10           HD2      PHE  10  14.012  -5.922   3.175
   74    HE1  PHE  10           HE1      PHE  10   9.550  -7.329   1.534
   75    HE2  PHE  10           HE2      PHE  10  12.228  -6.507   4.791
   76    HZ   PHE  10           HZ       PHE  10   9.996  -7.211   3.970
   77    H    PHE  11           HN       PHE  11  12.608  -5.526  -2.147
   78    HA   PHE  11           HA       PHE  11  10.022  -4.069  -1.769
   79   1HB   PHE  11          HB2       PHE  11  11.792  -4.567  -3.979
   80   2HB   PHE  11          HB1       PHE  11  10.247  -5.343  -4.320
   81    HD1  PHE  11           HD1      PHE  11  11.744  -2.669  -5.399
   82    HD2  PHE  11           HD2      PHE  11   8.402  -3.499  -2.829
   83    HE1  PHE  11           HE1      PHE  11  10.762  -0.464  -5.958
   84    HE2  PHE  11           HE2      PHE  11   7.426  -1.293  -3.389
   85    HZ   PHE  11           HZ       PHE  11   8.602   0.225  -4.956
   86    H    VAL  12           HN       VAL  12   8.070  -5.315  -1.845
   87    HA   VAL  12           HA       VAL  12   7.999  -7.832  -0.651
   88    HB   VAL  12           HB       VAL  12   5.716  -7.962  -1.731
   89   1HG1  VAL  12          HG1       VAL  12   5.484  -6.783   0.206
   90   2HG1  VAL  12          HG1       VAL  12   5.197  -5.441  -0.902
   91   3HG1  VAL  12          HG1       VAL  12   6.794  -5.672  -0.191
   92   1HG2  VAL  12          HG2       VAL  12   5.570  -6.971  -3.767
   93   2HG2  VAL  12          HG2       VAL  12   6.996  -5.976  -3.480
   94   3HG2  VAL  12          HG2       VAL  12   5.425  -5.459  -2.871
   95    H    SER  13           HN       SER  13   8.089  -9.966  -1.400
   96    HA   SER  13           HA       SER  13   9.608 -10.595  -3.716
   97   1HB   SER  13          HB2       SER  13   8.900 -12.888  -3.193
   98   2HB   SER  13          HB1       SER  13   9.237 -12.014  -1.700
   99    HG   SER  13           HG       SER  13   7.266 -13.078  -1.517
  100    H    LYS  14           HN       LYS  14   6.189  -9.970  -3.313
  101    HA   LYS  14           HA       LYS  14   5.768  -9.885  -6.187
  102   1HB   LYS  14          HB2       LYS  14   4.252 -11.840  -6.275
  103   2HB   LYS  14          HB1       LYS  14   5.874 -12.319  -5.779
  104   1HG   LYS  14          HG2       LYS  14   5.186 -12.315  -3.427
  105   2HG   LYS  14          HG1       LYS  14   3.570 -11.774  -3.886
  106   1HD   LYS  14          HD2       LYS  14   3.918 -13.979  -5.497
  107   2HD   LYS  14          HD1       LYS  14   4.750 -14.465  -4.019
  108   1HE   LYS  14          HE2       LYS  14   2.607 -15.080  -3.406
  109   2HE   LYS  14          HE1       LYS  14   2.509 -13.370  -2.941
  110   1HZ   LYS  14          HZ1       LYS  14   1.832 -12.908  -5.282
  111   2HZ   LYS  14          HZ2       LYS  14   0.695 -13.806  -4.395
  112   3HZ   LYS  14          HZ3       LYS  14   1.698 -14.581  -5.528
  113    H    ARG  15           HN       ARG  15   2.999 -10.359  -6.206
  114    HA   ARG  15           HA       ARG  15   1.994  -7.910  -4.986
  115   1HB   ARG  15          HB2       ARG  15   1.218  -8.574  -7.153
  116   2HB   ARG  15          HB1       ARG  15   0.882 -10.216  -6.616
  117   1HG   ARG  15          HG2       ARG  15  -0.584  -8.056  -5.197
  118   2HG   ARG  15          HG1       ARG  15  -1.035  -8.330  -6.876
  119   1HD   ARG  15          HD2       ARG  15  -1.228 -10.805  -6.321
  120   2HD   ARG  15          HD1       ARG  15  -1.077 -10.345  -4.614
  121    HE   ARG  15           HE       ARG  15  -3.079  -8.850  -4.988
  122   1HH1  ARG  15          HH2       ARG  15  -3.144  -9.116  -7.987
  123   2HH1  ARG  15          HH2       ARG  15  -4.417 -10.268  -8.214
  124   1HH2  ARG  15          HH1       ARG  15  -4.392 -11.336  -4.911
  125   2HH2  ARG  15          HH1       ARG  15  -5.125 -11.527  -6.470
  126    H    ILE  16           HN       ILE  16   0.154  -7.886  -3.474
  127    HA   ILE  16           HA       ILE  16   0.310 -10.101  -1.477
  128    HB   ILE  16           HB       ILE  16  -1.227  -7.622  -0.902
  129   1HG1  ILE  16          HG1       ILE  16   1.782  -7.530  -1.315
  130   2HG1  ILE  16          HG1       ILE  16   0.577  -6.604  -2.198
  131   1HG2  ILE  16          HG2       ILE  16  -0.885  -8.549   1.108
  132   2HG2  ILE  16          HG2       ILE  16   0.799  -8.049   0.980
  133   3HG2  ILE  16          HG2       ILE  16   0.316  -9.661   0.456
  134   1HD1  ILE  16          HD1       ILE  16   0.018  -5.295  -0.288
  135   2HD1  ILE  16          HD1       ILE  16   1.781  -5.367  -0.304
  136   3HD1  ILE  16          HD1       ILE  16   0.866  -6.388   0.806
  137    HA   PRO  17           HA       PRO  17  -3.926 -11.057  -2.371
  138   1HB   PRO  17          HB2       PRO  17  -4.582 -12.404  -0.091
  139   2HB   PRO  17          HB1       PRO  17  -3.498 -13.066  -1.329
  140   1HG   PRO  17          HG2       PRO  17  -2.880 -12.110   1.346
  141   2HG   PRO  17          HG1       PRO  17  -1.911 -13.100   0.252
  142   1HD   PRO  17          HD2       PRO  17  -1.701 -10.276   0.797
  143   2HD   PRO  17          HD1       PRO  17  -0.632 -11.297  -0.189
  144    H    GLU  18           HN       GLU  18  -5.583  -9.567  -2.328
  145    HA   GLU  18           HA       GLU  18  -5.944  -7.385  -0.671
  146   1HB   GLU  18          HB2       GLU  18  -7.996  -9.188  -1.982
  147   2HB   GLU  18          HB1       GLU  18  -8.351  -7.569  -1.379
  148   1HG   GLU  18          HG2       GLU  18  -7.121  -6.529  -3.037
  149   2HG   GLU  18          HG1       GLU  18  -6.023  -7.898  -3.227
  150    H    ASN  19           HN       ASN  19  -7.348 -10.631  -0.103
  151    HA   ASN  19           HA       ASN  19  -8.912 -10.117   2.158
  152   1HB   ASN  19          HB2       ASN  19  -8.323 -12.263   0.735
  153   2HB   ASN  19          HB1       ASN  19  -7.147 -12.541   2.021
  154   1HD2  ASN  19          HD2       ASN  19 -10.583 -12.494   1.260
  155   2HD2  ASN  19          HD2       ASN  19 -11.114 -13.080   2.763
  156    H    ARG  20           HN       ARG  20  -5.417 -10.053   1.935
  157    HA   ARG  20           HA       ARG  20  -5.183 -10.057   4.909
  158   1HB   ARG  20          HB2       ARG  20  -3.256 -10.416   2.605
  159   2HB   ARG  20          HB1       ARG  20  -2.748 -10.367   4.289
  160   1HG   ARG  20          HG2       ARG  20  -4.830 -12.164   4.364
  161   2HG   ARG  20          HG1       ARG  20  -4.084 -12.518   2.807
  162   1HD   ARG  20          HD2       ARG  20  -2.043 -13.138   3.775
  163   2HD   ARG  20          HD1       ARG  20  -2.344 -12.193   5.247
  164    HE   ARG  20           HE       ARG  20  -4.294 -14.335   4.780
  165   1HH1  ARG  20          HH2       ARG  20  -1.221 -15.095   5.125
  166   2HH1  ARG  20          HH2       ARG  20  -1.257 -15.589   6.785
  167   1HH2  ARG  20          HH1       ARG  20  -4.391 -14.236   7.394
  168   2HH2  ARG  20          HH1       ARG  20  -3.052 -15.105   8.069
  169    H    VAL  21           HN       VAL  21  -4.600  -8.068   2.048
  170    HA   VAL  21           HA       VAL  21  -3.097  -6.007   3.454
  171    HB   VAL  21           HB       VAL  21  -4.636  -5.882   0.843
  172   1HG1  VAL  21          HG1       VAL  21  -2.847  -4.079   2.294
  173   2HG1  VAL  21          HG1       VAL  21  -3.889  -3.748   0.911
  174   3HG1  VAL  21          HG1       VAL  21  -2.276  -4.417   0.661
  175   1HG2  VAL  21          HG2       VAL  21  -2.526  -7.612   1.548
  176   2HG2  VAL  21          HG2       VAL  21  -1.777  -6.314   0.613
  177   3HG2  VAL  21          HG2       VAL  21  -3.101  -7.254  -0.081
  178    H    VAL  22           HN       VAL  22  -3.871  -3.922   4.095
  179    HA   VAL  22           HA       VAL  22  -6.842  -3.660   4.258
  180    HB   VAL  22           HB       VAL  22  -6.262  -2.472   6.461
  181   1HG1  VAL  22          HG1       VAL  22  -6.827  -4.395   7.496
  182   2HG1  VAL  22          HG1       VAL  22  -5.419  -5.248   6.862
  183   3HG1  VAL  22          HG1       VAL  22  -6.868  -5.078   5.870
  184   1HG2  VAL  22          HG2       VAL  22  -3.689  -4.022   6.111
  185   2HG2  VAL  22          HG2       VAL  22  -4.151  -3.059   7.511
  186   3HG2  VAL  22          HG2       VAL  22  -3.816  -2.269   5.971
  187    H    SER  23           HN       SER  23  -3.715  -1.980   4.082
  188    HA   SER  23           HA       SER  23  -4.800   0.166   2.468
  189   1HB   SER  23          HB2       SER  23  -5.863   0.783   4.536
  190   2HB   SER  23          HB1       SER  23  -4.377   0.514   5.444
  191    HG   SER  23           HG       SER  23  -5.197   2.759   4.394
  192    H    TYR  24           HN       TYR  24  -3.081   1.570   1.728
  193    HA   TYR  24           HA       TYR  24  -0.374   0.534   2.352
  194   1HB   TYR  24          HB2       TYR  24   0.177   1.422   0.198
  195   2HB   TYR  24          HB1       TYR  24  -1.382   0.631   0.037
  196    HD1  TYR  24           HD1      TYR  24  -3.379   1.881  -0.460
  197    HD2  TYR  24           HD2      TYR  24   0.319   3.909   0.351
  198    HE1  TYR  24           HE1      TYR  24  -4.373   4.011  -1.251
  199    HE2  TYR  24           HE2      TYR  24  -0.675   6.038  -0.442
  200    HH   TYR  24           HH       TYR  24  -2.659   6.620  -2.126
  201    H    GLN  25           HN       GLN  25   1.317   2.359   1.912
  202    HA   GLN  25           HA       GLN  25   0.617   4.955   3.168
  203   1HB   GLN  25          HB2       GLN  25   2.687   2.957   4.155
  204   2HB   GLN  25          HB1       GLN  25   2.550   4.612   4.748
  205   1HG   GLN  25          HG2       GLN  25  -0.009   3.845   5.062
  206   2HG   GLN  25          HG1       GLN  25   0.775   2.272   5.235
  207   1HE2  GLN  25          HE2       GLN  25  -0.008   5.155   6.906
  208   2HE2  GLN  25          HE2       GLN  25   0.979   4.910   8.265
  209    H    LEU  26           HN       LEU  26   1.112   5.810   1.052
  210    HA   LEU  26           HA       LEU  26   3.311   5.172  -0.567
  211   1HB   LEU  26          HB2       LEU  26   1.458   7.441  -0.148
  212   2HB   LEU  26          HB1       LEU  26   2.942   7.836  -1.016
  213    HG   LEU  26           HG       LEU  26   1.028   5.597  -1.734
  214   1HD1  LEU  26          HD1       LEU  26   0.865   7.115  -3.849
  215   2HD1  LEU  26          HD1       LEU  26   1.480   8.382  -2.787
  216   3HD1  LEU  26          HD1       LEU  26  -0.043   7.576  -2.409
  217   1HD2  LEU  26          HD2       LEU  26   3.693   6.506  -2.810
  218   2HD2  LEU  26          HD2       LEU  26   2.530   5.709  -3.869
  219   3HD2  LEU  26          HD2       LEU  26   3.148   4.868  -2.449
  220    H    SER  27           HN       SER  27   5.410   6.007  -0.771
  221    HA   SER  27           HA       SER  27   6.421   7.861   1.314
  222   1HB   SER  27          HB2       SER  27   7.151   4.973   0.895
  223   2HB   SER  27          HB1       SER  27   8.334   6.091   1.568
  224    HG   SER  27           HG       SER  27   6.856   4.922   3.070
  225    H    SER  28           HN       SER  28   6.103   8.437  -1.417
  226    HA   SER  28           HA       SER  28   8.785   8.048  -2.661
  227   1HB   SER  28          HB2       SER  28   6.107   9.070  -3.650
  228   2HB   SER  28          HB1       SER  28   7.550   8.983  -4.655
  229    HG   SER  28           HG       SER  28   6.528   6.766  -3.218
  230    H    ARG  29           HN       ARG  29   9.891   9.607  -1.242
  231    HA   ARG  29           HA       ARG  29   9.087  12.459  -1.692
  232   1HB   ARG  29          HB2       ARG  29   9.349  11.154   0.630
  233   2HB   ARG  29          HB1       ARG  29  11.044  11.589   0.399
  234   1HG   ARG  29          HG2       ARG  29  10.483  13.580   1.317
  235   2HG   ARG  29          HG1       ARG  29   9.723  13.933  -0.236
  236   1HD   ARG  29          HD2       ARG  29   7.634  12.744   0.705
  237   2HD   ARG  29          HD1       ARG  29   8.415  12.910   2.290
  238    HE   ARG  29           HE       ARG  29   7.856  15.243   0.495
  239   1HH1  ARG  29          HH1       ARG  29   6.210  14.282   2.987
  240   2HH1  ARG  29          HH1       ARG  29   6.725  15.462   4.145
  241   1HH2  ARG  29          HH2       ARG  29   9.409  16.549   2.237
  242   2HH2  ARG  29          HH2       ARG  29   8.536  16.746   3.720
  243    H    SER  30           HN       SER  30  10.891  13.987  -2.028
  244    HA   SER  30           HA       SER  30  12.791  13.129  -3.986
  245   1HB   SER  30          HB2       SER  30  11.808  15.444  -3.502
  246   2HB   SER  30          HB1       SER  30  12.971  15.554  -2.184
  247    HG   SER  30           HG       SER  30  13.426  16.222  -4.605
  248    H    THR  31           HN       THR  31  12.882  13.149  -0.500
  249    HA   THR  31           HA       THR  31  15.775  13.089  -0.222
  250    HB   THR  31           HB       THR  31  15.194  12.554   2.111
  251    HG1  THR  31           HG1      THR  31  13.535  11.088   1.717
  252   1HG2  THR  31          HG2       THR  31  13.211  14.511   0.922
  253   2HG2  THR  31          HG2       THR  31  14.901  14.883   1.259
  254   3HG2  THR  31          HG2       THR  31  13.802  14.495   2.583
  255    H    CYS  32           HN       CYS  32  13.291  10.705  -0.849
  256    HA   CYS  32           HA       CYS  32  15.057   8.433  -0.154
  257   1HB   CYS  32          HB2       CYS  32  12.214   8.957  -0.802
  258   2HB   CYS  32          HB1       CYS  32  12.830   7.398  -1.352
  259    H    LEU  33           HN       LEU  33  15.069   6.625  -1.939
  260    HA   LEU  33           HA       LEU  33  15.631   7.887  -4.591
  261   1HB   LEU  33          HB2       LEU  33  17.293   6.470  -2.738
  262   2HB   LEU  33          HB1       LEU  33  17.133   5.494  -4.199
  263    HG   LEU  33           HG       LEU  33  17.568   7.766  -5.436
  264   1HD1  LEU  33          HD1       LEU  33  17.652   8.661  -2.813
  265   2HD1  LEU  33          HD1       LEU  33  18.298   9.522  -4.209
  266   3HD1  LEU  33          HD1       LEU  33  19.357   8.503  -3.235
  267   1HD2  LEU  33          HD2       LEU  33  19.439   5.845  -4.142
  268   2HD2  LEU  33          HD2       LEU  33  20.153   7.323  -4.788
  269   3HD2  LEU  33          HD2       LEU  33  19.242   6.247  -5.848
  270    H    LYS  34           HN       LYS  34  14.495   5.020  -2.858
  271    HA   LYS  34           HA       LYS  34  13.625   3.734  -5.391
  272   1HB   LYS  34          HB2       LYS  34  13.457   2.860  -2.487
  273   2HB   LYS  34          HB1       LYS  34  13.202   1.831  -3.896
  274   1HG   LYS  34          HG2       LYS  34  15.788   3.330  -3.436
  275   2HG   LYS  34          HG1       LYS  34  15.519   1.697  -2.825
  276   1HD   LYS  34          HD2       LYS  34  15.056   0.908  -5.113
  277   2HD   LYS  34          HD1       LYS  34  15.314   2.541  -5.732
  278   1HE   LYS  34          HE2       LYS  34  17.538   2.136  -5.851
  279   2HE   LYS  34          HE1       LYS  34  17.573   1.817  -4.105
  280   1HZ   LYS  34          HZ1       LYS  34  16.607  -0.414  -4.643
  281   2HZ   LYS  34          HZ2       LYS  34  18.208  -0.188  -5.169
  282   3HZ   LYS  34          HZ3       LYS  34  16.926  -0.096  -6.278
  283    H    ALA  35           HN       ALA  35  11.932   5.402  -5.826
  284    HA   ALA  35           HA       ALA  35   9.800   6.040  -4.048
  285   1HB   ALA  35          HB1       ALA  35  10.064   5.895  -7.064
  286   2HB   ALA  35          HB2       ALA  35  10.216   7.320  -6.037
  287   3HB   ALA  35          HB3       ALA  35   8.640   6.562  -6.265
  288    H    GLY  36           HN       GLY  36   8.609   4.418  -3.066
  289   1HA   GLY  36          HA2       GLY  36   7.106   2.582  -4.833
  290   2HA   GLY  36          HA1       GLY  36   8.120   1.831  -3.600
  291    H    VAL  37           HN       VAL  37   5.433   1.317  -3.385
  292    HA   VAL  37           HA       VAL  37   4.431   3.269  -1.337
  293    HB   VAL  37           HB       VAL  37   2.931   1.035  -2.735
  294   1HG1  VAL  37          HG1       VAL  37   1.713   1.861  -0.876
  295   2HG1  VAL  37          HG1       VAL  37   1.033   2.711  -2.264
  296   3HG1  VAL  37          HG1       VAL  37   2.182   3.527  -1.203
  297   1HG2  VAL  37          HG2       VAL  37   3.986   3.492  -3.861
  298   2HG2  VAL  37          HG2       VAL  37   2.222   3.515  -3.881
  299   3HG2  VAL  37          HG2       VAL  37   3.096   2.198  -4.664
  300    H    ILE  38           HN       ILE  38   3.570   2.348   0.681
  301    HA   ILE  38           HA       ILE  38   4.752  -0.344   1.293
  302    HB   ILE  38           HB       ILE  38   4.185   2.123   2.965
  303   1HG1  ILE  38          HG1       ILE  38   6.690   1.756   3.436
  304   2HG1  ILE  38          HG1       ILE  38   6.661   0.620   2.088
  305   1HG2  ILE  38          HG2       ILE  38   4.934  -0.691   3.795
  306   2HG2  ILE  38          HG2       ILE  38   3.598   0.295   4.392
  307   3HG2  ILE  38          HG2       ILE  38   5.258   0.709   4.817
  308   1HD1  ILE  38          HD1       ILE  38   7.179   3.248   1.764
  309   2HD1  ILE  38          HD1       ILE  38   5.425   3.277   1.596
  310   3HD1  ILE  38          HD1       ILE  38   6.395   2.272   0.522
  311    H    PHE  39           HN       PHE  39   3.273  -1.960   1.689
  312    HA   PHE  39           HA       PHE  39   0.447  -1.129   2.200
  313   1HB   PHE  39          HB2       PHE  39   1.787  -3.410   0.793
  314   2HB   PHE  39          HB1       PHE  39   0.143  -3.611   1.399
  315    HD1  PHE  39           HD1      PHE  39   2.302  -1.598  -0.844
  316    HD2  PHE  39           HD2      PHE  39  -1.712  -2.486   0.393
  317    HE1  PHE  39           HE1      PHE  39   1.423  -0.314  -2.772
  318    HE2  PHE  39           HE2      PHE  39  -2.587  -1.202  -1.536
  319    HZ   PHE  39           HZ       PHE  39  -1.023  -0.117  -3.118
  320    H    THR  40           HN       THR  40  -0.642  -1.937   3.960
  321    HA   THR  40           HA       THR  40   0.963  -3.509   5.915
  322    HB   THR  40           HB       THR  40  -1.366  -1.584   6.121
  323    HG1  THR  40           HG1      THR  40   0.506  -0.495   6.045
  324   1HG2  THR  40          HG2       THR  40  -0.492  -2.134   8.703
  325   2HG2  THR  40          HG2       THR  40  -0.544  -3.720   7.934
  326   3HG2  THR  40          HG2       THR  40  -1.991  -2.713   7.973
  327    H    THR  41           HN       THR  41   0.050  -5.393   6.801
  328    HA   THR  41           HA       THR  41  -2.198  -6.573   5.286
  329    HB   THR  41           HB       THR  41  -0.621  -7.927   7.451
  330    HG1  THR  41           HG1      THR  41   0.921  -8.367   5.692
  331   1HG2  THR  41          HG2       THR  41  -2.159  -9.393   6.495
  332   2HG2  THR  41          HG2       THR  41  -0.714  -9.712   5.534
  333   3HG2  THR  41          HG2       THR  41  -1.990  -8.680   4.892
  334    H    LYS  42           HN       LYS  42  -3.607  -8.083   6.852
  335    HA   LYS  42           HA       LYS  42  -4.932  -6.300   8.752
  336   1HB   LYS  42          HB2       LYS  42  -5.476  -8.642   7.212
  337   2HB   LYS  42          HB1       LYS  42  -5.799  -9.033   8.901
  338   1HG   LYS  42          HG2       LYS  42  -6.859  -6.458   8.535
  339   2HG   LYS  42          HG1       LYS  42  -7.330  -7.359   7.094
  340   1HD   LYS  42          HD2       LYS  42  -8.051  -9.233   8.692
  341   2HD   LYS  42          HD1       LYS  42  -7.902  -8.040   9.981
  342   1HE   LYS  42          HE2       LYS  42  -9.381  -6.866   7.804
  343   2HE   LYS  42          HE1       LYS  42 -10.122  -8.416   8.252
  344   1HZ   LYS  42          HZ1       LYS  42  -9.357  -6.236  10.122
  345   2HZ   LYS  42          HZ2       LYS  42  -9.976  -7.748  10.588
  346   3HZ   LYS  42          HZ3       LYS  42 -10.940  -6.670   9.695
  347    H    LYS  43           HN       LYS  43  -2.551  -8.847   8.894
  348    HA   LYS  43           HA       LYS  43  -2.920  -9.563  11.680
  349   1HB   LYS  43          HB2       LYS  43  -1.713 -10.705   9.615
  350   2HB   LYS  43          HB1       LYS  43  -0.320  -9.792  10.193
  351   1HG   LYS  43          HG2       LYS  43  -1.978 -11.547  12.016
  352   2HG   LYS  43          HG1       LYS  43  -0.571 -12.152  11.140
  353   1HD   LYS  43          HD2       LYS  43   0.492  -9.906  12.214
  354   2HD   LYS  43          HD1       LYS  43  -0.705 -10.296  13.452
  355   1HE   LYS  43          HE2       LYS  43   1.064 -11.595  14.216
  356   2HE   LYS  43          HE1       LYS  43   0.325 -12.760  13.099
  357   1HZ   LYS  43          HZ1       LYS  43   2.285 -10.762  12.151
  358   2HZ   LYS  43          HZ2       LYS  43   1.815 -12.218  11.415
  359   3HZ   LYS  43          HZ3       LYS  43   2.801 -12.241  12.798
  360    H    GLY  44           HN       GLY  44  -1.324  -6.950  10.019
  361   1HA   GLY  44          HA2       GLY  44  -0.824  -4.945  11.409
  362   2HA   GLY  44          HA1       GLY  44  -0.179  -6.051  12.619
  363    H    GLN  45           HN       GLN  45   0.480  -6.789   9.305
  364    HA   GLN  45           HA       GLN  45   3.359  -6.261   9.779
  365   1HB   GLN  45          HB2       GLN  45   1.707  -8.128   8.349
  366   2HB   GLN  45          HB1       GLN  45   2.805  -7.354   7.207
  367   1HG   GLN  45          HG2       GLN  45   4.535  -7.811   9.226
  368   2HG   GLN  45          HG1       GLN  45   3.414  -9.144   9.503
  369   1HE2  GLN  45          HE2       GLN  45   5.456  -7.663   6.952
  370   2HE2  GLN  45          HE2       GLN  45   5.650  -9.093   6.059
  371    H    GLN  46           HN       GLN  46   4.476  -5.518   7.552
  372    HA   GLN  46           HA       GLN  46   2.909  -3.496   6.081
  373   1HB   GLN  46          HB2       GLN  46   4.106  -2.827   8.478
  374   2HB   GLN  46          HB1       GLN  46   5.332  -2.355   7.301
  375   1HG   GLN  46          HG2       GLN  46   4.117  -0.579   6.638
  376   2HG   GLN  46          HG1       GLN  46   2.682  -1.579   6.407
  377   1HE2  GLN  46          HE2       GLN  46   3.134   1.153   7.810
  378   2HE2  GLN  46          HE2       GLN  46   2.398   0.947   9.326
  379    H    SER  47           HN       SER  47   3.564  -4.578   4.157
  380    HA   SER  47           HA       SER  47   6.480  -4.927   3.665
  381   1HB   SER  47          HB2       SER  47   4.298  -5.663   1.743
  382   2HB   SER  47          HB1       SER  47   5.801  -6.510   2.097
  383    HG   SER  47           HG       SER  47   3.405  -6.958   3.102
  384    H    CYS  48           HN       CYS  48   7.101  -4.359   1.273
  385    HA   CYS  48           HA       CYS  48   6.108  -1.588   0.719
  386   1HB   CYS  48          HB2       CYS  48   8.623  -2.585   1.147
  387   2HB   CYS  48          HB1       CYS  48   8.534  -2.646  -0.614
  388    H    GLY  49           HN       GLY  49   4.688  -1.486  -1.005
  389   1HA   GLY  49          HA2       GLY  49   4.757  -3.649  -3.036
  390   2HA   GLY  49          HA1       GLY  49   3.449  -2.494  -2.820
  391    H    ASP  50           HN       ASP  50   5.172  -3.243  -5.175
  392    HA   ASP  50           HA       ASP  50   6.578  -0.708  -5.777
  393   1HB   ASP  50          HB2       ASP  50   7.201  -1.984  -7.845
  394   2HB   ASP  50          HB1       ASP  50   7.609  -2.841  -6.360
  395    HA   PRO  51           HA       PRO  51   2.971   0.945  -7.746
  396   1HB   PRO  51          HB2       PRO  51   4.178   2.921  -9.213
  397   2HB   PRO  51          HB1       PRO  51   3.905   3.039  -7.462
  398   1HG   PRO  51          HG2       PRO  51   6.386   2.302  -8.943
  399   2HG   PRO  51          HG1       PRO  51   6.191   3.327  -7.512
  400   1HD   PRO  51          HD2       PRO  51   7.044   0.765  -7.361
  401   2HD   PRO  51          HD1       PRO  51   6.090   1.534  -6.074
  402    H    LYS  52           HN       LYS  52   5.779  -0.193  -9.536
  403    HA   LYS  52           HA       LYS  52   4.743   0.028 -12.188
  404   1HB   LYS  52          HB2       LYS  52   6.440  -1.664 -12.698
  405   2HB   LYS  52          HB1       LYS  52   7.092  -0.524 -11.521
  406   1HG   LYS  52          HG2       LYS  52   6.866  -2.056  -9.737
  407   2HG   LYS  52          HG1       LYS  52   5.760  -3.087 -10.643
  408   1HD   LYS  52          HD2       LYS  52   7.479  -3.939 -12.012
  409   2HD   LYS  52          HD1       LYS  52   8.578  -2.624 -11.604
  410   1HE   LYS  52          HE2       LYS  52   9.472  -4.136 -10.133
  411   2HE   LYS  52          HE1       LYS  52   8.071  -3.723  -9.123
  412   1HZ   LYS  52          HZ1       LYS  52   6.825  -5.418 -10.510
  413   2HZ   LYS  52          HZ2       LYS  52   7.953  -6.037  -9.400
  414   3HZ   LYS  52          HZ3       LYS  52   8.340  -5.956 -11.054
  415    H    GLN  53           HN       GLN  53   4.030  -2.182  -9.562
  416    HA   GLN  53           HA       GLN  53   2.626  -4.098 -11.290
  417   1HB   GLN  53          HB2       GLN  53   3.638  -3.892  -8.577
  418   2HB   GLN  53          HB1       GLN  53   1.988  -4.524  -8.586
  419   1HG   GLN  53          HG2       GLN  53   2.569  -6.418  -9.758
  420   2HG   GLN  53          HG1       GLN  53   3.871  -5.608 -10.626
  421   1HE2  GLN  53          HE2       GLN  53   5.656  -6.932 -10.082
  422   2HE2  GLN  53          HE2       GLN  53   6.159  -7.228  -8.488
  423    H    GLU  54           HN       GLU  54   0.304  -4.541 -10.961
  424    HA   GLU  54           HA       GLU  54  -1.242  -2.025 -10.799
  425   1HB   GLU  54          HB2       GLU  54  -3.008  -3.501 -11.716
  426   2HB   GLU  54          HB1       GLU  54  -1.508  -3.630 -12.635
  427   1HG   GLU  54          HG2       GLU  54  -1.055  -5.761 -11.871
  428   2HG   GLU  54          HG1       GLU  54  -1.908  -5.508 -10.347
  429    H    TRP  55           HN       TRP  55  -0.578  -4.704  -8.674
  430    HA   TRP  55           HA       TRP  55  -3.130  -4.585  -7.286
  431   1HB   TRP  55          HB2       TRP  55  -2.121  -6.150  -5.789
  432   2HB   TRP  55          HB1       TRP  55  -1.581  -6.549  -7.409
  433    HD1  TRP  55           HD1      TRP  55   0.940  -6.584  -7.855
  434    HE1  TRP  55           HE1      TRP  55   3.025  -6.170  -6.392
  435    HE3  TRP  55           HE3      TRP  55  -1.240  -4.502  -3.732
  436    HZ2  TRP  55           HZ2      TRP  55   3.676  -5.144  -3.854
  437    HZ3  TRP  55           HZ3      TRP  55   0.146  -3.817  -1.800
  438    HH2  TRP  55           HH2      TRP  55   2.609  -4.123  -1.855
  439    H    VAL  56           HN       VAL  56  -0.261  -2.658  -7.216
  440    HA   VAL  56           HA       VAL  56  -0.819  -1.543  -4.539
  441    HB   VAL  56           HB       VAL  56   0.973  -0.692  -6.856
  442   1HG1  VAL  56          HG1       VAL  56   0.146   0.688  -4.423
  443   2HG1  VAL  56          HG1       VAL  56   1.083   1.299  -5.787
  444   3HG1  VAL  56          HG1       VAL  56   1.893   0.451  -4.470
  445   1HG2  VAL  56          HG2       VAL  56   1.304  -2.387  -4.419
  446   2HG2  VAL  56          HG2       VAL  56   2.660  -1.362  -4.891
  447   3HG2  VAL  56          HG2       VAL  56   2.031  -2.566  -6.016
  448    H    GLN  57           HN       GLN  57  -0.887  -0.415  -7.916
  449    HA   GLN  57           HA       GLN  57  -2.384   1.973  -7.552
  450   1HB   GLN  57          HB2       GLN  57  -1.347   0.314  -9.634
  451   2HB   GLN  57          HB1       GLN  57  -3.048   0.591 -10.006
  452   1HG   GLN  57          HG2       GLN  57  -2.516   3.085  -9.433
  453   2HG   GLN  57          HG1       GLN  57  -0.836   2.608  -9.687
  454   1HE2  GLN  57          HE2       GLN  57  -3.958   1.887 -11.369
  455   2HE2  GLN  57          HE2       GLN  57  -3.361   2.227 -12.922
  456    H    ARG  58           HN       ARG  58  -3.471  -1.363  -8.270
  457    HA   ARG  58           HA       ARG  58  -6.265  -0.912  -8.390
  458   1HB   ARG  58          HB2       ARG  58  -5.188  -3.017  -8.998
  459   2HB   ARG  58          HB1       ARG  58  -4.618  -3.241  -7.345
  460   1HG   ARG  58          HG2       ARG  58  -6.943  -3.390  -6.551
  461   2HG   ARG  58          HG1       ARG  58  -7.529  -3.142  -8.197
  462   1HD   ARG  58          HD2       ARG  58  -5.554  -5.344  -7.821
  463   2HD   ARG  58          HD1       ARG  58  -7.184  -5.612  -7.174
  464    HE   ARG  58           HE       ARG  58  -7.546  -4.484  -9.723
  465   1HH1  ARG  58          HH1       ARG  58  -7.434  -7.437  -8.185
  466   2HH1  ARG  58          HH1       ARG  58  -7.123  -8.379  -9.606
  467   1HH2  ARG  58          HH2       ARG  58  -6.569  -5.620 -11.635
  468   2HH2  ARG  58          HH2       ARG  58  -6.634  -7.351 -11.560
  469    H    TYR  59           HN       TYR  59  -4.417  -2.118  -5.553
  470    HA   TYR  59           HA       TYR  59  -6.433  -1.833  -3.591
  471   1HB   TYR  59          HB2       TYR  59  -3.421  -1.422  -3.498
  472   2HB   TYR  59          HB1       TYR  59  -4.422  -1.544  -2.060
  473    HD1  TYR  59           HD1      TYR  59  -5.745  -3.672  -4.627
  474    HD2  TYR  59           HD2      TYR  59  -2.634  -3.415  -1.669
  475    HE1  TYR  59           HE1      TYR  59  -5.494  -6.141  -4.647
  476    HE2  TYR  59           HE2      TYR  59  -2.393  -5.878  -1.693
  477    HH   TYR  59           HH       TYR  59  -2.876  -7.743  -3.213
  478    H    MET  60           HN       MET  60  -3.852   0.431  -4.450
  479    HA   MET  60           HA       MET  60  -4.545   2.679  -2.908
  480   1HB   MET  60          HB2       MET  60  -3.279   2.216  -5.609
  481   2HB   MET  60          HB1       MET  60  -3.399   3.836  -4.930
  482   1HG   MET  60          HG2       MET  60  -2.320   2.908  -2.824
  483   2HG   MET  60          HG1       MET  60  -1.976   1.447  -3.737
  484   1HE   MET  60          HE1       MET  60  -1.159   5.638  -4.619
  485   2HE   MET  60          HE2       MET  60  -0.204   5.229  -3.195
  486   3HE   MET  60          HE3       MET  60  -1.929   4.873  -3.223
  487    H    LYS  61           HN       LYS  61  -5.911   1.514  -5.970
  488    HA   LYS  61           HA       LYS  61  -7.455   3.874  -6.591
  489   1HB   LYS  61          HB2       LYS  61  -6.748   1.864  -8.053
  490   2HB   LYS  61          HB1       LYS  61  -8.112   1.015  -7.328
  491   1HG   LYS  61          HG2       LYS  61  -9.628   2.817  -8.098
  492   2HG   LYS  61          HG1       LYS  61  -8.259   3.630  -8.859
  493   1HD   LYS  61          HD2       LYS  61  -8.685   0.764  -9.554
  494   2HD   LYS  61          HD1       LYS  61  -9.837   1.928 -10.212
  495   1HE   LYS  61          HE2       LYS  61  -8.307   2.747 -11.683
  496   2HE   LYS  61          HE1       LYS  61  -7.043   2.823 -10.439
  497   1HZ   LYS  61          HZ1       LYS  61  -8.005   0.251 -11.549
  498   2HZ   LYS  61          HZ2       LYS  61  -6.585   0.551 -10.665
  499   3HZ   LYS  61          HZ3       LYS  61  -6.726   1.107 -12.264
  500    H    ASN  62           HN       ASN  62  -8.375   0.730  -5.110
  501    HA   ASN  62           HA       ASN  62 -11.075   1.539  -4.483
  502   1HB   ASN  62          HB2       ASN  62  -9.554  -0.768  -4.489
  503   2HB   ASN  62          HB1       ASN  62  -9.777  -0.475  -2.764
  504   1HD2  ASN  62          HD2       ASN  62 -11.684  -0.639  -5.820
  505   2HD2  ASN  62          HD2       ASN  62 -13.093  -1.235  -5.081
  506    H    LEU  63           HN       LEU  63  -8.021   1.546  -2.676
  507    HA   LEU  63           HA       LEU  63  -9.019   2.320  -0.127
  508   1HB   LEU  63          HB2       LEU  63  -6.479   2.266  -1.647
  509   2HB   LEU  63          HB1       LEU  63  -6.509   3.388  -0.282
  510    HG   LEU  63           HG       LEU  63  -7.560   0.604   0.080
  511   1HD1  LEU  63          HD1       LEU  63  -4.711   1.077   0.756
  512   2HD1  LEU  63          HD1       LEU  63  -5.073   0.901  -0.962
  513   3HD1  LEU  63          HD1       LEU  63  -5.502  -0.387   0.169
  514   1HD2  LEU  63          HD2       LEU  63  -7.648   1.291   2.226
  515   2HD2  LEU  63          HD2       LEU  63  -7.140   2.894   1.691
  516   3HD2  LEU  63          HD2       LEU  63  -5.935   1.709   2.197
  517    H    ASP  64           HN       ASP  64  -8.418   4.187  -3.047
  518    HA   ASP  64           HA       ASP  64  -8.591   6.774  -1.635
  519   1HB   ASP  64          HB2       ASP  64  -7.300   5.909  -3.846
  520   2HB   ASP  64          HB1       ASP  64  -8.763   6.547  -4.599
  521    H    ALA  65           HN       ALA  65 -10.680   4.659  -3.541
  522    HA   ALA  65           HA       ALA  65 -12.785   6.727  -3.755
  523   1HB   ALA  65          HB1       ALA  65 -11.943   4.463  -5.189
  524   2HB   ALA  65          HB2       ALA  65 -13.367   5.449  -5.526
  525   3HB   ALA  65          HB3       ALA  65 -13.508   4.015  -4.509
  526    H    LYS  66           HN       LYS  66 -11.986   3.945  -1.776
  527    HA   LYS  66           HA       LYS  66 -14.671   3.609  -0.686
  528   1HB   LYS  66          HB2       LYS  66 -12.869   1.853  -0.936
  529   2HB   LYS  66          HB1       LYS  66 -12.001   2.655   0.374
  530   1HG   LYS  66          HG2       LYS  66 -13.889   2.307   1.887
  531   2HG   LYS  66          HG1       LYS  66 -14.827   1.580   0.581
  532   1HD   LYS  66          HD2       LYS  66 -13.863  -0.422   0.928
  533   2HD   LYS  66          HD1       LYS  66 -12.252   0.285   0.791
  534   1HE   LYS  66          HE2       LYS  66 -12.125   0.747   3.110
  535   2HE   LYS  66          HE1       LYS  66 -13.879   0.588   3.323
  536   1HZ   LYS  66          HZ1       LYS  66 -12.426  -1.403   3.960
  537   2HZ   LYS  66          HZ2       LYS  66 -12.252  -1.652   2.289
  538   3HZ   LYS  66          HZ3       LYS  66 -13.793  -1.702   3.002
  539    H    GLN  67           HN       GLN  67 -11.598   4.628   0.825
  540    HA   GLN  67           HA       GLN  67 -12.993   5.797   3.111
  541   1HB   GLN  67          HB2       GLN  67 -10.340   4.995   2.304
  542   2HB   GLN  67          HB1       GLN  67 -10.285   6.615   3.001
  543   1HG   GLN  67          HG2       GLN  67 -11.387   5.858   5.016
  544   2HG   GLN  67          HG1       GLN  67 -11.688   4.270   4.311
  545   1HE2  GLN  67          HE2       GLN  67  -9.236   6.306   5.811
  546   2HE2  GLN  67          HE2       GLN  67  -8.037   5.110   5.907
  547    H    LYS  68           HN       LYS  68 -14.218   7.225   1.315
  548    HA   LYS  68           HA       LYS  68 -12.887   9.465   0.126
  549   1HB   LYS  68          HB2       LYS  68 -15.225   8.460  -0.266
  550   2HB   LYS  68          HB1       LYS  68 -15.735   9.391   1.142
  551   1HG   LYS  68          HG2       LYS  68 -15.696  11.350   0.005
  552   2HG   LYS  68          HG1       LYS  68 -14.167  10.959  -0.781
  553   1HD   LYS  68          HD2       LYS  68 -15.995   9.172  -1.910
  554   2HD   LYS  68          HD1       LYS  68 -16.880  10.693  -1.804
  555   1HE   LYS  68          HE2       LYS  68 -15.733  11.480  -3.589
  556   2HE   LYS  68          HE1       LYS  68 -14.208  11.259  -2.705
  557   1HZ   LYS  68          HZ1       LYS  68 -15.637   8.960  -3.890
  558   2HZ   LYS  68          HZ2       LYS  68 -14.005   9.074  -3.433
  559   3HZ   LYS  68          HZ3       LYS  68 -14.561   9.883  -4.820
  560    H    LYS  69           HN       LYS  69 -12.239  11.407   1.020
  561    HA   LYS  69           HA       LYS  69 -12.626  11.788   3.946
  562   1HB   LYS  69          HB2       LYS  69 -10.458  11.942   2.310
  563   2HB   LYS  69          HB1       LYS  69 -10.967  13.631   2.313
  564   1HG   LYS  69          HG2       LYS  69 -10.580  13.893   4.579
  565   2HG   LYS  69          HG1       LYS  69 -10.858  12.187   4.930
  566   1HD   LYS  69          HD2       LYS  69  -8.723  11.574   3.964
  567   2HD   LYS  69          HD1       LYS  69  -8.457  13.225   3.402
  568   1HE   LYS  69          HE2       LYS  69  -8.120  14.047   5.598
  569   2HE   LYS  69          HE1       LYS  69  -8.873  12.620   6.338
  570   1HZ   LYS  69          HZ1       LYS  69  -6.331  12.698   6.252
  571   2HZ   LYS  69          HZ2       LYS  69  -6.499  12.374   4.592
  572   3HZ   LYS  69          HZ3       LYS  69  -7.090  11.270   5.740
  573    H    ALA  70           HN       ALA  70 -12.555  14.428   4.326
  574    HA   ALA  70           HA       ALA  70 -13.901  16.373   4.312
  575   1HB   ALA  70          HB1       ALA  70 -13.986  17.335   2.194
  576   2HB   ALA  70          HB2       ALA  70 -14.452  15.821   1.417
  577   3HB   ALA  70          HB3       ALA  70 -12.780  16.077   1.918
  578    H    SER  71           HN       SER  71 -15.412  14.588   5.465
  579    HA   SER  71           HA       SER  71 -17.809  13.927   3.893
  580   1HB   SER  71          HB2       SER  71 -17.443  12.201   5.329
  581   2HB   SER  71          HB1       SER  71 -16.529  13.206   6.447
  582    HG   SER  71           HG       SER  71 -18.460  13.958   7.290
  583    HA   PRO  72           HA       PRO  72 -19.771  16.970   6.953
  584   1HB   PRO  72          HB2       PRO  72 -18.188  18.379   8.666
  585   2HB   PRO  72          HB1       PRO  72 -18.840  16.774   9.048
  586   1HG   PRO  72          HG2       PRO  72 -16.115  17.563   8.248
  587   2HG   PRO  72          HG1       PRO  72 -16.656  16.225   9.270
  588   1HD   PRO  72          HD2       PRO  72 -15.849  16.039   6.600
  589   2HD   PRO  72          HD1       PRO  72 -16.726  14.795   7.516
  590    H    ARG  73           HN       ARG  73 -20.401  18.773   5.815
  591    HA   ARG  73           HA       ARG  73 -18.449  20.925   5.253
  592   1HB   ARG  73          HB2       ARG  73 -18.465  19.047   3.437
  593   2HB   ARG  73          HB1       ARG  73 -20.021  19.736   2.972
  594   1HG   ARG  73          HG2       ARG  73 -18.085  21.847   3.367
  595   2HG   ARG  73          HG1       ARG  73 -17.458  20.660   2.224
  596   1HD   ARG  73          HD2       ARG  73 -20.230  21.113   1.613
  597   2HD   ARG  73          HD1       ARG  73 -19.400  22.679   1.717
  598    HE   ARG  73           HE       ARG  73 -17.618  21.082   0.319
  599   1HH1  ARG  73          HH2       ARG  73 -20.464  22.841  -0.176
  600   2HH1  ARG  73          HH2       ARG  73 -20.687  22.333  -1.816
  601   1HH2  ARG  73          HH1       ARG  73 -18.097  20.031  -1.736
  602   2HH2  ARG  73          HH1       ARG  73 -19.349  20.743  -2.699
  Start of MODEL   19
    1   1H    VAL   1          HT1       VAL   1  -3.222  13.910   4.419
    2   2H    VAL   1          HT2       VAL   1  -4.901  13.670   4.319
    3   3H    VAL   1          HT3       VAL   1  -3.942  13.577   2.920
    4    HA   VAL   1           HA       VAL   1  -3.597  11.728   5.217
    5    HB   VAL   1           HB       VAL   1  -4.962  10.182   3.707
    6   1HG1  VAL   1          HG1       VAL   1  -6.513  12.601   4.638
    7   2HG1  VAL   1          HG1       VAL   1  -5.785  11.464   5.772
    8   3HG1  VAL   1          HG1       VAL   1  -7.021  10.911   4.643
    9   1HG2  VAL   1          HG2       VAL   1  -5.826  12.806   2.453
   10   2HG2  VAL   1          HG2       VAL   1  -6.377  11.187   2.022
   11   3HG2  VAL   1          HG2       VAL   1  -4.720  11.675   1.675
   12    H    VAL   2           HN       VAL   2  -1.275  12.015   4.652
   13    HA   VAL   2           HA       VAL   2  -0.469  10.156   2.506
   14    HB   VAL   2           HB       VAL   2  -0.831  12.346   1.388
   15   1HG1  VAL   2          HG1       VAL   2  -0.157  13.543   3.641
   16   2HG1  VAL   2          HG1       VAL   2   0.180  14.322   2.096
   17   3HG1  VAL   2          HG1       VAL   2   1.467  13.476   2.955
   18   1HG2  VAL   2          HG2       VAL   2   1.931  11.199   1.682
   19   2HG2  VAL   2          HG2       VAL   2   1.694  12.638   0.693
   20   3HG2  VAL   2          HG2       VAL   2   0.848  11.143   0.291
   21    H    ILE   3           HN       ILE   3   1.528   9.289   2.896
   22    HA   ILE   3           HA       ILE   3   3.015  10.242   5.314
   23    HB   ILE   3           HB       ILE   3   1.751   8.169   5.597
   24   1HG1  ILE   3          HG1       ILE   3   4.726   7.713   5.236
   25   2HG1  ILE   3          HG1       ILE   3   3.922   8.249   6.710
   26   1HG2  ILE   3          HG2       ILE   3   1.387   6.911   3.770
   27   2HG2  ILE   3          HG2       ILE   3   3.067   6.382   3.853
   28   3HG2  ILE   3          HG2       ILE   3   2.635   7.776   2.877
   29   1HD1  ILE   3          HD1       ILE   3   2.510   6.000   6.186
   30   2HD1  ILE   3          HD1       ILE   3   3.949   6.024   7.206
   31   3HD1  ILE   3          HD1       ILE   3   4.075   5.547   5.513
   32    HA   PRO   4           HA       PRO   4   5.981  10.138   1.769
   33   1HB   PRO   4          HB2       PRO   4   6.631  12.787   1.742
   34   2HB   PRO   4          HB1       PRO   4   5.230  12.137   0.869
   35   1HG   PRO   4          HG2       PRO   4   5.317  13.771   3.298
   36   2HG   PRO   4          HG1       PRO   4   3.992  13.513   2.157
   37   1HD   PRO   4          HD2       PRO   4   4.375  12.286   4.722
   38   2HD   PRO   4          HD1       PRO   4   3.048  12.033   3.571
   39    H    SER   5           HN       SER   5   6.064  11.040   5.067
   40    HA   SER   5           HA       SER   5   8.740  11.962   5.378
   41   1HB   SER   5          HB2       SER   5   6.506  10.974   6.994
   42   2HB   SER   5          HB1       SER   5   8.080  10.640   7.709
   43    HG   SER   5           HG       SER   5   7.222  13.165   6.723
   44    HA   PRO   6           HA       PRO   6  10.020   7.492   6.394
   45   1HB   PRO   6          HB2       PRO   6   8.246   5.466   5.951
   46   2HB   PRO   6          HB1       PRO   6   8.353   6.351   7.485
   47   1HG   PRO   6          HG2       PRO   6   6.414   6.648   5.261
   48   2HG   PRO   6          HG1       PRO   6   6.158   6.763   7.008
   49   1HD   PRO   6          HD2       PRO   6   6.352   8.932   5.342
   50   2HD   PRO   6          HD1       PRO   6   6.747   8.973   7.074
   51    H    CYS   7           HN       CYS   7  10.578   5.466   5.012
   52    HA   CYS   7           HA       CYS   7  10.015   5.909   2.109
   53   1HB   CYS   7          HB2       CYS   7  12.256   6.842   3.306
   54   2HB   CYS   7          HB1       CYS   7  12.785   5.201   2.944
   55    H    CYS   8           HN       CYS   8  11.971   3.907   1.339
   56    HA   CYS   8           HA       CYS   8  10.905   1.435   2.645
   57   1HB   CYS   8          HB2       CYS   8  10.702   2.425  -0.156
   58   2HB   CYS   8          HB1       CYS   8  11.031   0.705   0.044
   59    H    MET   9           HN       MET   9  12.386  -0.320   2.617
   60    HA   MET   9           HA       MET   9  15.166   0.388   1.746
   61   1HB   MET   9          HB2       MET   9  15.890  -1.016   3.600
   62   2HB   MET   9          HB1       MET   9  14.673   0.107   4.200
   63   1HG   MET   9          HG2       MET   9  12.970  -1.767   3.710
   64   2HG   MET   9          HG1       MET   9  14.367  -2.833   3.594
   65   1HE   MET   9          HE1       MET   9  12.073  -1.588   7.112
   66   2HE   MET   9          HE2       MET   9  11.839  -2.941   6.010
   67   3HE   MET   9          HE3       MET   9  11.810  -1.292   5.389
   68    H    PHE  10           HN       PHE  10  12.621  -2.044   1.636
   69    HA   PHE  10           HA       PHE  10  14.101  -3.418  -0.544
   70   1HB   PHE  10          HB2       PHE  10  14.107  -5.504   0.548
   71   2HB   PHE  10          HB1       PHE  10  14.478  -4.390   1.857
   72    HD1  PHE  10           HD1      PHE  10  12.210  -3.356   2.992
   73    HD2  PHE  10           HD2      PHE  10  12.536  -7.144   1.002
   74    HE1  PHE  10           HE1      PHE  10  10.228  -4.173   4.231
   75    HE2  PHE  10           HE2      PHE  10  10.552  -7.966   2.242
   76    HZ   PHE  10           HZ       PHE  10   9.397  -6.480   3.856
   77    H    PHE  11           HN       PHE  11  12.685  -4.339  -2.093
   78    HA   PHE  11           HA       PHE  11   9.877  -3.461  -1.896
   79   1HB   PHE  11          HB2       PHE  11  11.846  -4.069  -3.929
   80   2HB   PHE  11          HB1       PHE  11  10.353  -4.948  -4.256
   81    HD1  PHE  11           HD1      PHE  11  11.821  -2.314  -5.508
   82    HD2  PHE  11           HD2      PHE  11   8.335  -3.076  -3.115
   83    HE1  PHE  11           HE1      PHE  11  10.778  -0.235  -6.362
   84    HE2  PHE  11           HE2      PHE  11   7.298  -0.996  -3.967
   85    HZ   PHE  11           HZ       PHE  11   8.516   0.428  -5.592
   86    H    VAL  12           HN       VAL  12   8.101  -4.862  -1.862
   87    HA   VAL  12           HA       VAL  12   8.177  -7.280  -0.464
   88    HB   VAL  12           HB       VAL  12   5.937  -7.636  -1.609
   89   1HG1  VAL  12          HG1       VAL  12   5.318  -5.045  -0.939
   90   2HG1  VAL  12          HG1       VAL  12   6.837  -5.292  -0.078
   91   3HG1  VAL  12          HG1       VAL  12   5.472  -6.371   0.212
   92   1HG2  VAL  12          HG2       VAL  12   6.824  -6.503  -3.769
   93   2HG2  VAL  12          HG2       VAL  12   6.485  -4.983  -2.947
   94   3HG2  VAL  12          HG2       VAL  12   5.178  -6.119  -3.267
   95    H    SER  13           HN       SER  13   8.479  -9.447  -1.056
   96    HA   SER  13           HA       SER  13  10.039 -10.106  -3.346
   97   1HB   SER  13          HB2       SER  13   9.269 -11.315  -1.031
   98   2HB   SER  13          HB1       SER  13   8.245 -12.168  -2.183
   99    HG   SER  13           HG       SER  13  11.028 -12.096  -1.939
  100    H    LYS  14           HN       LYS  14   6.611  -9.684  -2.925
  101    HA   LYS  14           HA       LYS  14   6.145  -9.970  -5.796
  102   1HB   LYS  14          HB2       LYS  14   4.602 -11.878  -5.550
  103   2HB   LYS  14          HB1       LYS  14   6.204 -12.314  -4.953
  104   1HG   LYS  14          HG2       LYS  14   5.519 -11.965  -2.659
  105   2HG   LYS  14          HG1       LYS  14   3.964 -11.308  -3.174
  106   1HD   LYS  14          HD2       LYS  14   3.873 -13.683  -4.448
  107   2HD   LYS  14          HD1       LYS  14   4.890 -14.135  -3.079
  108   1HE   LYS  14          HE2       LYS  14   2.440 -12.519  -2.487
  109   2HE   LYS  14          HE1       LYS  14   2.224 -14.233  -2.892
  110   1HZ   LYS  14          HZ1       LYS  14   4.147 -14.632  -1.303
  111   2HZ   LYS  14          HZ2       LYS  14   2.653 -14.222  -0.604
  112   3HZ   LYS  14          HZ3       LYS  14   3.881 -13.055  -0.739
  113    H    ARG  15           HN       ARG  15   3.292 -10.460  -5.437
  114    HA   ARG  15           HA       ARG  15   2.489  -7.745  -4.597
  115   1HB   ARG  15          HB2       ARG  15   0.816 -10.065  -5.614
  116   2HB   ARG  15          HB1       ARG  15   0.411  -8.351  -5.677
  117   1HG   ARG  15          HG2       ARG  15   2.572  -8.097  -7.085
  118   2HG   ARG  15          HG1       ARG  15   2.484  -9.847  -7.278
  119   1HD   ARG  15          HD2       ARG  15  -0.009  -8.265  -7.796
  120   2HD   ARG  15          HD1       ARG  15   1.271  -8.246  -9.024
  121    HE   ARG  15           HE       ARG  15   1.208 -10.815  -8.803
  122   1HH1  ARG  15          HH1       ARG  15  -0.962 -10.745  -6.685
  123   2HH1  ARG  15          HH1       ARG  15  -2.374 -11.081  -7.630
  124   1HH2  ARG  15          HH2       ARG  15  -0.837 -10.388 -10.660
  125   2HH2  ARG  15          HH2       ARG  15  -2.304 -10.879  -9.879
  126    H    ILE  16           HN       ILE  16  -0.201  -8.609  -3.808
  127    HA   ILE  16           HA       ILE  16   0.222 -10.162  -1.308
  128    HB   ILE  16           HB       ILE  16  -1.260  -7.595  -0.981
  129   1HG1  ILE  16          HG1       ILE  16   1.760  -7.662  -1.345
  130   2HG1  ILE  16          HG1       ILE  16   0.605  -6.738  -2.300
  131   1HG2  ILE  16          HG2       ILE  16   0.692  -7.943   1.003
  132   2HG2  ILE  16          HG2       ILE  16   0.176  -9.573   0.584
  133   3HG2  ILE  16          HG2       ILE  16  -1.011  -8.381   1.109
  134   1HD1  ILE  16          HD1       ILE  16   0.048  -5.345  -0.398
  135   2HD1  ILE  16          HD1       ILE  16   1.804  -5.373  -0.554
  136   3HD1  ILE  16          HD1       ILE  16   1.014  -6.353   0.681
  137    HA   PRO  17           HA       PRO  17  -3.978 -11.145  -2.281
  138   1HB   PRO  17          HB2       PRO  17  -4.759 -12.272   0.083
  139   2HB   PRO  17          HB1       PRO  17  -3.638 -13.057  -1.047
  140   1HG   PRO  17          HG2       PRO  17  -3.108 -11.893   1.559
  141   2HG   PRO  17          HG1       PRO  17  -2.110 -12.975   0.584
  142   1HD   PRO  17          HD2       PRO  17  -1.882 -10.111   0.907
  143   2HD   PRO  17          HD1       PRO  17  -0.788 -11.225   0.056
  144    H    GLU  18           HN       GLU  18  -5.419  -9.460  -2.519
  145    HA   GLU  18           HA       GLU  18  -5.873  -7.236  -0.950
  146   1HB   GLU  18          HB2       GLU  18  -6.842  -8.019  -3.221
  147   2HB   GLU  18          HB1       GLU  18  -8.138  -8.736  -2.259
  148   1HG   GLU  18          HG2       GLU  18  -7.566  -6.019  -1.394
  149   2HG   GLU  18          HG1       GLU  18  -7.976  -6.069  -3.109
  150    H    ASN  19           HN       ASN  19  -7.271 -10.464  -0.422
  151    HA   ASN  19           HA       ASN  19  -9.182  -9.721   1.575
  152   1HB   ASN  19          HB2       ASN  19  -8.613 -11.938   0.202
  153   2HB   ASN  19          HB1       ASN  19  -7.722 -12.330   1.673
  154   1HD2  ASN  19          HD2       ASN  19  -9.614 -14.072   1.612
  155   2HD2  ASN  19          HD2       ASN  19 -11.025 -13.642   2.452
  156    H    ARG  20           HN       ARG  20  -5.747  -9.743   1.686
  157    HA   ARG  20           HA       ARG  20  -5.729  -9.942   4.663
  158   1HB   ARG  20          HB2       ARG  20  -3.692 -10.291   2.461
  159   2HB   ARG  20          HB1       ARG  20  -3.233 -10.221   4.157
  160   1HG   ARG  20          HG2       ARG  20  -5.236 -12.030   4.303
  161   2HG   ARG  20          HG1       ARG  20  -4.646 -12.358   2.673
  162   1HD   ARG  20          HD2       ARG  20  -2.550 -13.052   3.424
  163   2HD   ARG  20          HD1       ARG  20  -2.649 -12.078   4.905
  164    HE   ARG  20           HE       ARG  20  -4.718 -13.811   5.269
  165   1HH1  ARG  20          HH1       ARG  20  -1.329 -13.975   5.142
  166   2HH1  ARG  20          HH1       ARG  20  -1.244 -15.685   5.406
  167   1HH2  ARG  20          HH2       ARG  20  -4.674 -16.152   5.225
  168   2HH2  ARG  20          HH2       ARG  20  -3.137 -16.917   5.453
  169    H    VAL  21           HN       VAL  21  -4.719  -7.926   1.930
  170    HA   VAL  21           HA       VAL  21  -3.330  -5.929   3.484
  171    HB   VAL  21           HB       VAL  21  -4.719  -5.717   0.795
  172   1HG1  VAL  21          HG1       VAL  21  -3.442  -3.812   0.415
  173   2HG1  VAL  21          HG1       VAL  21  -2.198  -4.289   1.571
  174   3HG1  VAL  21          HG1       VAL  21  -3.743  -3.660   2.146
  175   1HG2  VAL  21          HG2       VAL  21  -3.153  -7.110  -0.038
  176   2HG2  VAL  21          HG2       VAL  21  -2.615  -7.432   1.610
  177   3HG2  VAL  21          HG2       VAL  21  -1.865  -6.136   0.677
  178    H    VAL  22           HN       VAL  22  -4.094  -3.841   4.148
  179    HA   VAL  22           HA       VAL  22  -7.068  -3.529   4.196
  180    HB   VAL  22           HB       VAL  22  -6.598  -2.450   6.446
  181   1HG1  VAL  22          HG1       VAL  22  -5.644  -5.277   6.509
  182   2HG1  VAL  22          HG1       VAL  22  -7.261  -4.931   5.895
  183   3HG1  VAL  22          HG1       VAL  22  -6.826  -4.473   7.544
  184   1HG2  VAL  22          HG2       VAL  22  -3.904  -3.781   6.049
  185   2HG2  VAL  22          HG2       VAL  22  -4.473  -3.049   7.546
  186   3HG2  VAL  22          HG2       VAL  22  -4.188  -2.043   6.130
  187    H    SER  23           HN       SER  23  -3.917  -1.892   4.240
  188    HA   SER  23           HA       SER  23  -4.899   0.314   2.623
  189   1HB   SER  23          HB2       SER  23  -5.967   0.722   4.827
  190   2HB   SER  23          HB1       SER  23  -4.376   0.719   5.583
  191    HG   SER  23           HG       SER  23  -4.761   2.823   5.163
  192    H    TYR  24           HN       TYR  24  -3.114   1.586   1.893
  193    HA   TYR  24           HA       TYR  24  -0.469   0.512   2.685
  194   1HB   TYR  24          HB2       TYR  24   0.195   1.281   0.486
  195   2HB   TYR  24          HB1       TYR  24  -1.329   0.417   0.334
  196    HD1  TYR  24           HD1      TYR  24  -3.383   1.572  -0.237
  197    HD2  TYR  24           HD2      TYR  24   0.269   3.752   0.343
  198    HE1  TYR  24           HE1      TYR  24  -4.434   3.588  -1.224
  199    HE2  TYR  24           HE2      TYR  24  -0.779   5.772  -0.647
  200    HH   TYR  24           HH       TYR  24  -2.560   6.494  -1.891
  201    H    GLN  25           HN       GLN  25   1.207   2.400   1.912
  202    HA   GLN  25           HA       GLN  25   0.543   4.998   3.193
  203   1HB   GLN  25          HB2       GLN  25   2.441   2.863   4.105
  204   2HB   GLN  25          HB1       GLN  25   2.946   4.538   4.307
  205   1HG   GLN  25          HG2       GLN  25   0.943   5.035   5.597
  206   2HG   GLN  25          HG1       GLN  25   0.309   3.419   5.294
  207   1HE2  GLN  25          HE2       GLN  25   0.620   4.138   7.962
  208   2HE2  GLN  25          HE2       GLN  25   1.944   3.321   8.641
  209    H    LEU  26           HN       LEU  26   0.854   6.059   1.188
  210    HA   LEU  26           HA       LEU  26   2.935   5.353  -0.660
  211   1HB   LEU  26          HB2       LEU  26   0.757   7.282  -0.364
  212   2HB   LEU  26          HB1       LEU  26   2.130   7.929  -1.263
  213    HG   LEU  26           HG       LEU  26   0.698   5.321  -1.856
  214   1HD1  LEU  26          HD1       LEU  26   0.523   8.106  -2.932
  215   2HD1  LEU  26          HD1       LEU  26  -0.750   6.902  -2.724
  216   3HD1  LEU  26          HD1       LEU  26   0.377   6.770  -4.074
  217   1HD2  LEU  26          HD2       LEU  26   2.147   5.489  -3.963
  218   2HD2  LEU  26          HD2       LEU  26   2.996   5.066  -2.481
  219   3HD2  LEU  26          HD2       LEU  26   3.082   6.710  -3.102
  220    H    SER  27           HN       SER  27   5.048   5.793  -0.496
  221    HA   SER  27           HA       SER  27   5.932   8.113   1.159
  222   1HB   SER  27          HB2       SER  27   6.832   6.070   1.970
  223   2HB   SER  27          HB1       SER  27   7.121   5.462   0.342
  224    HG   SER  27           HG       SER  27   8.395   7.735   1.471
  225    H    SER  28           HN       SER  28   7.046   9.771   0.120
  226    HA   SER  28           HA       SER  28   7.343   9.604  -2.820
  227   1HB   SER  28          HB2       SER  28   8.142  12.061  -2.242
  228   2HB   SER  28          HB1       SER  28   6.434  11.643  -2.146
  229    HG   SER  28           HG       SER  28   7.008  12.640  -0.239
  230    H    ARG  29           HN       ARG  29   9.494  10.653  -3.663
  231    HA   ARG  29           HA       ARG  29  11.730   9.168  -2.403
  232   1HB   ARG  29          HB2       ARG  29  10.930   9.431  -4.950
  233   2HB   ARG  29          HB1       ARG  29  12.017  10.818  -4.874
  234   1HG   ARG  29          HG2       ARG  29  13.284   8.588  -3.588
  235   2HG   ARG  29          HG1       ARG  29  12.714   8.076  -5.176
  236   1HD   ARG  29          HD2       ARG  29  13.819  10.644  -5.573
  237   2HD   ARG  29          HD1       ARG  29  14.971   9.770  -4.541
  238    HE   ARG  29           HE       ARG  29  15.162   8.071  -6.248
  239   1HH1  ARG  29          HH2       ARG  29  12.329   8.108  -7.226
  240   2HH1  ARG  29          HH2       ARG  29  12.499   8.810  -8.801
  241   1HH2  ARG  29          HH1       ARG  29  15.669  10.070  -8.189
  242   2HH2  ARG  29          HH1       ARG  29  14.389   9.920  -9.346
  243    H    SER  30           HN       SER  30  12.200  10.511  -0.570
  244    HA   SER  30           HA       SER  30  13.031  13.323  -1.156
  245   1HB   SER  30          HB2       SER  30  12.767  12.075   1.569
  246   2HB   SER  30          HB1       SER  30  12.496  13.748   1.089
  247    HG   SER  30           HG       SER  30  10.523  13.255   0.519
  248    H    THR  31           HN       THR  31  14.116  10.348   0.507
  249    HA   THR  31           HA       THR  31  16.942  11.250   0.087
  250    HB   THR  31           HB       THR  31  17.422  10.498   2.386
  251    HG1  THR  31           HG1      THR  31  15.700   9.839   3.687
  252   1HG2  THR  31          HG2       THR  31  15.060  12.173   2.928
  253   2HG2  THR  31          HG2       THR  31  16.118  12.799   1.662
  254   3HG2  THR  31          HG2       THR  31  16.762  12.479   3.273
  255    H    CYS  32           HN       CYS  32  15.119   9.244  -1.264
  256    HA   CYS  32           HA       CYS  32  16.766   6.788  -0.743
  257   1HB   CYS  32          HB2       CYS  32  13.849   7.155  -1.495
  258   2HB   CYS  32          HB1       CYS  32  14.661   5.591  -1.497
  259    H    LEU  33           HN       LEU  33  16.536   5.291  -2.837
  260    HA   LEU  33           HA       LEU  33  17.359   6.973  -5.132
  261   1HB   LEU  33          HB2       LEU  33  18.608   4.946  -4.090
  262   2HB   LEU  33          HB1       LEU  33  17.417   3.965  -4.945
  263    HG   LEU  33           HG       LEU  33  18.361   5.936  -6.770
  264   1HD1  LEU  33          HD1       LEU  33  20.322   5.473  -4.850
  265   2HD1  LEU  33          HD1       LEU  33  20.594   6.110  -6.471
  266   3HD1  LEU  33          HD1       LEU  33  20.757   4.381  -6.162
  267   1HD2  LEU  33          HD2       LEU  33  19.180   3.904  -7.971
  268   2HD2  LEU  33          HD2       LEU  33  17.528   3.720  -7.385
  269   3HD2  LEU  33          HD2       LEU  33  18.860   2.952  -6.524
  270    H    LYS  34           HN       LYS  34  14.656   5.089  -4.068
  271    HA   LYS  34           HA       LYS  34  13.341   5.523  -6.707
  272   1HB   LYS  34          HB2       LYS  34  14.499   3.112  -5.969
  273   2HB   LYS  34          HB1       LYS  34  12.807   2.888  -5.523
  274   1HG   LYS  34          HG2       LYS  34  12.052   3.159  -7.713
  275   2HG   LYS  34          HG1       LYS  34  13.480   4.078  -8.197
  276   1HD   LYS  34          HD2       LYS  34  13.839   1.984  -9.205
  277   2HD   LYS  34          HD1       LYS  34  14.777   1.866  -7.713
  278   1HE   LYS  34          HE2       LYS  34  13.099   0.545  -6.641
  279   2HE   LYS  34          HE1       LYS  34  11.899   0.927  -7.890
  280   1HZ   LYS  34          HZ1       LYS  34  13.490  -0.091  -9.517
  281   2HZ   LYS  34          HZ2       LYS  34  12.780  -1.189  -8.431
  282   3HZ   LYS  34          HZ3       LYS  34  14.380  -0.672  -8.194
  283    H    ALA  35           HN       ALA  35  11.003   5.525  -6.529
  284    HA   ALA  35           HA       ALA  35  10.031   5.875  -3.714
  285   1HB   ALA  35          HB1       ALA  35   8.196   6.937  -5.576
  286   2HB   ALA  35          HB2       ALA  35   9.794   7.344  -6.205
  287   3HB   ALA  35          HB3       ALA  35   9.331   7.845  -4.579
  288    H    GLY  36           HN       GLY  36   8.325   4.595  -3.019
  289   1HA   GLY  36          HA2       GLY  36   6.700   3.131  -5.002
  290   2HA   GLY  36          HA1       GLY  36   7.649   2.139  -3.892
  291    H    VAL  37           HN       VAL  37   5.209   1.512  -3.390
  292    HA   VAL  37           HA       VAL  37   4.118   3.456  -1.383
  293    HB   VAL  37           HB       VAL  37   2.820   1.088  -2.764
  294   1HG1  VAL  37          HG1       VAL  37   0.732   2.378  -2.039
  295   2HG1  VAL  37          HG1       VAL  37   1.801   3.338  -1.017
  296   3HG1  VAL  37          HG1       VAL  37   1.648   1.604  -0.746
  297   1HG2  VAL  37          HG2       VAL  37   3.484   3.700  -3.761
  298   2HG2  VAL  37          HG2       VAL  37   1.731   3.576  -3.611
  299   3HG2  VAL  37          HG2       VAL  37   2.619   2.403  -4.582
  300    H    ILE  38           HN       ILE  38   3.021   2.283   0.509
  301    HA   ILE  38           HA       ILE  38   4.589  -0.154   1.298
  302    HB   ILE  38           HB       ILE  38   3.815   2.324   2.861
  303   1HG1  ILE  38          HG1       ILE  38   6.461   1.977   3.254
  304   2HG1  ILE  38          HG1       ILE  38   6.309   1.218   1.670
  305   1HG2  ILE  38          HG2       ILE  38   4.945   1.206   4.786
  306   2HG2  ILE  38          HG2       ILE  38   5.059  -0.270   3.826
  307   3HG2  ILE  38          HG2       ILE  38   3.478   0.364   4.283
  308   1HD1  ILE  38          HD1       ILE  38   6.784   3.572   1.330
  309   2HD1  ILE  38          HD1       ILE  38   5.478   4.037   2.423
  310   3HD1  ILE  38          HD1       ILE  38   5.106   3.284   0.874
  311    H    PHE  39           HN       PHE  39   3.126  -1.846   1.501
  312    HA   PHE  39           HA       PHE  39   0.335  -1.133   2.268
  313   1HB   PHE  39          HB2       PHE  39   1.619  -3.325   0.673
  314   2HB   PHE  39          HB1       PHE  39  -0.003  -3.547   1.332
  315    HD1  PHE  39           HD1      PHE  39   2.065  -1.155  -0.652
  316    HD2  PHE  39           HD2      PHE  39  -1.869  -2.630   0.228
  317    HE1  PHE  39           HE1      PHE  39   1.130   0.249  -2.460
  318    HE2  PHE  39           HE2      PHE  39  -2.799  -1.220  -1.586
  319    HZ   PHE  39           HZ       PHE  39  -1.302   0.221  -2.934
  320    H    THR  40           HN       THR  40  -0.672  -2.107   3.988
  321    HA   THR  40           HA       THR  40   1.033  -3.819   5.739
  322    HB   THR  40           HB       THR  40  -1.070  -1.712   6.293
  323    HG1  THR  40           HG1      THR  40   0.594  -0.564   6.906
  324   1HG2  THR  40          HG2       THR  40   0.105  -2.603   8.712
  325   2HG2  THR  40          HG2       THR  40  -0.420  -4.049   7.849
  326   3HG2  THR  40          HG2       THR  40  -1.579  -2.769   8.211
  327    H    THR  41           HN       THR  41   0.065  -5.664   6.614
  328    HA   THR  41           HA       THR  41  -2.357  -6.626   5.261
  329    HB   THR  41           HB       THR  41  -0.958  -8.128   7.430
  330    HG1  THR  41           HG1      THR  41   0.162  -7.745   4.858
  331   1HG2  THR  41          HG2       THR  41  -1.132  -9.908   5.600
  332   2HG2  THR  41          HG2       THR  41  -2.099  -8.738   4.705
  333   3HG2  THR  41          HG2       THR  41  -2.654  -9.323   6.272
  334    H    LYS  42           HN       LYS  42  -4.150  -7.573   6.587
  335    HA   LYS  42           HA       LYS  42  -5.061  -5.740   8.623
  336   1HB   LYS  42          HB2       LYS  42  -6.937  -7.365   8.750
  337   2HB   LYS  42          HB1       LYS  42  -6.526  -6.979   7.080
  338   1HG   LYS  42          HG2       LYS  42  -5.506  -9.051   6.713
  339   2HG   LYS  42          HG1       LYS  42  -5.227  -9.329   8.432
  340   1HD   LYS  42          HD2       LYS  42  -7.989  -9.093   8.263
  341   2HD   LYS  42          HD1       LYS  42  -7.565  -9.989   6.803
  342   1HE   LYS  42          HE2       LYS  42  -7.503 -11.825   8.156
  343   2HE   LYS  42          HE1       LYS  42  -5.973 -11.166   8.770
  344   1HZ   LYS  42          HZ1       LYS  42  -7.395 -11.409  10.634
  345   2HZ   LYS  42          HZ2       LYS  42  -8.704 -10.684   9.828
  346   3HZ   LYS  42          HZ3       LYS  42  -7.358  -9.752  10.279
  347    H    LYS  43           HN       LYS  43  -3.133  -8.634   8.714
  348    HA   LYS  43           HA       LYS  43  -3.713  -9.376  11.464
  349   1HB   LYS  43          HB2       LYS  43  -2.551 -10.550   9.310
  350   2HB   LYS  43          HB1       LYS  43  -1.114 -10.060  10.207
  351   1HG   LYS  43          HG2       LYS  43  -3.415 -11.587  11.449
  352   2HG   LYS  43          HG1       LYS  43  -1.970 -12.362  10.799
  353   1HD   LYS  43          HD2       LYS  43  -0.555 -11.196  12.376
  354   2HD   LYS  43          HD1       LYS  43  -1.908 -10.210  12.932
  355   1HE   LYS  43          HE2       LYS  43  -2.883 -11.975  14.115
  356   2HE   LYS  43          HE1       LYS  43  -2.106 -13.210  13.104
  357   1HZ   LYS  43          HZ1       LYS  43   0.054 -12.446  13.976
  358   2HZ   LYS  43          HZ2       LYS  43  -0.949 -13.077  15.194
  359   3HZ   LYS  43          HZ3       LYS  43  -0.756 -11.396  15.034
  360    H    GLY  44           HN       GLY  44  -0.696  -8.107  10.036
  361   1HA   GLY  44          HA2       GLY  44  -0.301  -5.872  11.656
  362   2HA   GLY  44          HA1       GLY  44   0.312  -7.228  12.603
  363    H    GLN  45           HN       GLN  45   0.433  -6.809   9.075
  364    HA   GLN  45           HA       GLN  45   3.428  -6.905   9.270
  365   1HB   GLN  45          HB2       GLN  45   1.420  -8.422   7.828
  366   2HB   GLN  45          HB1       GLN  45   2.546  -7.666   6.698
  367   1HG   GLN  45          HG2       GLN  45   4.284  -8.570   8.583
  368   2HG   GLN  45          HG1       GLN  45   3.024  -9.799   8.696
  369   1HE2  GLN  45          HE2       GLN  45   3.806 -11.542   7.475
  370   2HE2  GLN  45          HE2       GLN  45   4.395 -11.418   5.888
  371    H    GLN  46           HN       GLN  46   4.515  -5.774   7.375
  372    HA   GLN  46           HA       GLN  46   2.934  -3.740   5.954
  373   1HB   GLN  46          HB2       GLN  46   3.427  -2.997   8.383
  374   2HB   GLN  46          HB1       GLN  46   5.099  -2.824   7.844
  375   1HG   GLN  46          HG2       GLN  46   3.282  -1.617   5.935
  376   2HG   GLN  46          HG1       GLN  46   3.036  -0.938   7.546
  377   1HE2  GLN  46          HE2       GLN  46   4.597   0.537   8.302
  378   2HE2  GLN  46          HE2       GLN  46   6.057   0.871   7.504
  379    H    SER  47           HN       SER  47   3.846  -4.467   4.004
  380    HA   SER  47           HA       SER  47   6.832  -4.371   3.782
  381   1HB   SER  47          HB2       SER  47   4.797  -5.671   1.952
  382   2HB   SER  47          HB1       SER  47   6.536  -5.947   1.975
  383    HG   SER  47           HG       SER  47   4.702  -7.245   3.311
  384    H    CYS  48           HN       CYS  48   7.521  -3.685   1.462
  385    HA   CYS  48           HA       CYS  48   6.146  -1.136   0.836
  386   1HB   CYS  48          HB2       CYS  48   8.669  -1.519   1.191
  387   2HB   CYS  48          HB1       CYS  48   8.654  -2.280  -0.401
  388    H    GLY  49           HN       GLY  49   4.614  -1.132  -0.770
  389   1HA   GLY  49          HA2       GLY  49   4.588  -3.342  -2.733
  390   2HA   GLY  49          HA1       GLY  49   3.308  -2.153  -2.512
  391    H    ASP  50           HN       ASP  50   4.958  -3.020  -4.904
  392    HA   ASP  50           HA       ASP  50   6.377  -0.533  -5.621
  393   1HB   ASP  50          HB2       ASP  50   7.377  -2.657  -6.195
  394   2HB   ASP  50          HB1       ASP  50   5.889  -3.203  -6.970
  395    HA   PRO  51           HA       PRO  51   2.592   1.058  -7.385
  396   1HB   PRO  51          HB2       PRO  51   3.707   3.238  -8.629
  397   2HB   PRO  51          HB1       PRO  51   3.360   3.182  -6.888
  398   1HG   PRO  51          HG2       PRO  51   5.941   2.725  -8.318
  399   2HG   PRO  51          HG1       PRO  51   5.623   3.632  -6.827
  400   1HD   PRO  51          HD2       PRO  51   6.642   1.139  -6.787
  401   2HD   PRO  51          HD1       PRO  51   5.533   1.722  -5.526
  402    H    LYS  52           HN       LYS  52   5.483   0.148  -9.094
  403    HA   LYS  52           HA       LYS  52   4.565   0.535 -11.788
  404   1HB   LYS  52          HB2       LYS  52   6.757  -0.684 -10.312
  405   2HB   LYS  52          HB1       LYS  52   6.304  -1.667 -11.705
  406   1HG   LYS  52          HG2       LYS  52   6.494   1.275 -12.131
  407   2HG   LYS  52          HG1       LYS  52   8.009   0.397 -11.913
  408   1HD   LYS  52          HD2       LYS  52   6.318  -1.113 -13.671
  409   2HD   LYS  52          HD1       LYS  52   6.410   0.548 -14.261
  410   1HE   LYS  52          HE2       LYS  52   9.017   0.170 -13.661
  411   2HE   LYS  52          HE1       LYS  52   8.561  -1.500 -14.052
  412   1HZ   LYS  52          HZ1       LYS  52   7.358  -0.481 -16.028
  413   2HZ   LYS  52          HZ2       LYS  52   9.054  -0.536 -16.112
  414   3HZ   LYS  52          HZ3       LYS  52   8.265   0.920 -15.729
  415    H    GLN  53           HN       GLN  53   4.122  -2.032  -9.407
  416    HA   GLN  53           HA       GLN  53   2.970  -3.946 -11.268
  417   1HB   GLN  53          HB2       GLN  53   3.733  -3.719  -8.484
  418   2HB   GLN  53          HB1       GLN  53   2.146  -4.479  -8.625
  419   1HG   GLN  53          HG2       GLN  53   2.990  -6.344  -9.604
  420   2HG   GLN  53          HG1       GLN  53   4.113  -5.421 -10.601
  421   1HE2  GLN  53          HE2       GLN  53   4.812  -7.846  -9.110
  422   2HE2  GLN  53          HE2       GLN  53   5.987  -7.402  -7.968
  423    H    GLU  54           HN       GLU  54   0.652  -4.686 -11.002
  424    HA   GLU  54           HA       GLU  54  -1.133  -2.327 -11.001
  425   1HB   GLU  54          HB2       GLU  54  -0.874  -4.586 -12.526
  426   2HB   GLU  54          HB1       GLU  54  -2.199  -5.046 -11.457
  427   1HG   GLU  54          HG2       GLU  54  -3.637  -3.558 -12.399
  428   2HG   GLU  54          HG1       GLU  54  -2.400  -2.307 -12.530
  429    H    TRP  55           HN       TRP  55  -0.248  -4.778  -8.711
  430    HA   TRP  55           HA       TRP  55  -2.881  -4.880  -7.419
  431   1HB   TRP  55          HB2       TRP  55  -1.767  -6.337  -5.870
  432   2HB   TRP  55          HB1       TRP  55  -1.165  -6.723  -7.472
  433    HD1  TRP  55           HD1      TRP  55   1.358  -6.420  -7.931
  434    HE1  TRP  55           HE1      TRP  55   3.374  -5.802  -6.442
  435    HE3  TRP  55           HE3      TRP  55  -1.074  -4.721  -3.772
  436    HZ2  TRP  55           HZ2      TRP  55   3.883  -4.761  -3.873
  437    HZ3  TRP  55           HZ3      TRP  55   0.215  -3.918  -1.812
  438    HH2  TRP  55           HH2      TRP  55   2.698  -3.930  -1.858
  439    H    VAL  56           HN       VAL  56   0.114  -3.016  -7.011
  440    HA   VAL  56           HA       VAL  56  -0.683  -1.829  -4.476
  441    HB   VAL  56           HB       VAL  56   1.145  -0.860  -6.714
  442   1HG1  VAL  56          HG1       VAL  56   1.062   1.083  -5.536
  443   2HG1  VAL  56          HG1       VAL  56   2.012   0.228  -4.321
  444   3HG1  VAL  56          HG1       VAL  56   0.258   0.308  -4.173
  445   1HG2  VAL  56          HG2       VAL  56   2.027  -2.906  -5.826
  446   2HG2  VAL  56          HG2       VAL  56   1.610  -2.442  -4.178
  447   3HG2  VAL  56          HG2       VAL  56   2.914  -1.611  -5.023
  448    H    GLN  57           HN       GLN  57  -1.006  -1.024  -7.906
  449    HA   GLN  57           HA       GLN  57  -2.445   1.468  -7.528
  450   1HB   GLN  57          HB2       GLN  57  -1.209  -0.015  -9.580
  451   2HB   GLN  57          HB1       GLN  57  -2.912   0.053 -10.034
  452   1HG   GLN  57          HG2       GLN  57  -2.260   2.633  -9.084
  453   2HG   GLN  57          HG1       GLN  57  -0.928   2.151 -10.135
  454   1HE2  GLN  57          HE2       GLN  57  -2.675   4.221 -10.965
  455   2HE2  GLN  57          HE2       GLN  57  -3.616   3.665 -12.264
  456    H    ARG  58           HN       ARG  58  -3.415  -1.851  -8.451
  457    HA   ARG  58           HA       ARG  58  -6.198  -1.505  -8.686
  458   1HB   ARG  58          HB2       ARG  58  -5.074  -3.567  -9.258
  459   2HB   ARG  58          HB1       ARG  58  -4.471  -3.760  -7.615
  460   1HG   ARG  58          HG2       ARG  58  -6.898  -3.892  -6.865
  461   2HG   ARG  58          HG1       ARG  58  -7.332  -4.001  -8.571
  462   1HD   ARG  58          HD2       ARG  58  -5.255  -5.868  -8.244
  463   2HD   ARG  58          HD1       ARG  58  -6.300  -6.081  -6.827
  464    HE   ARG  58           HE       ARG  58  -8.223  -6.050  -8.585
  465   1HH1  ARG  58          HH2       ARG  58  -5.930  -8.337  -8.262
  466   2HH1  ARG  58          HH2       ARG  58  -5.975  -8.933  -9.887
  467   1HH2  ARG  58          HH1       ARG  58  -7.893  -6.303 -11.082
  468   2HH2  ARG  58          HH1       ARG  58  -7.085  -7.782 -11.484
  469    H    TYR  59           HN       TYR  59  -4.181  -1.866  -5.800
  470    HA   TYR  59           HA       TYR  59  -6.414  -2.005  -3.935
  471   1HB   TYR  59          HB2       TYR  59  -3.443  -1.444  -3.686
  472   2HB   TYR  59          HB1       TYR  59  -4.518  -1.605  -2.303
  473    HD1  TYR  59           HD1      TYR  59  -5.680  -3.778  -4.882
  474    HD2  TYR  59           HD2      TYR  59  -2.629  -3.413  -1.873
  475    HE1  TYR  59           HE1      TYR  59  -5.362  -6.236  -4.885
  476    HE2  TYR  59           HE2      TYR  59  -2.319  -5.870  -1.883
  477    HH   TYR  59           HH       TYR  59  -4.506  -7.971  -3.624
  478    H    MET  60           HN       MET  60  -4.069   0.514  -4.881
  479    HA   MET  60           HA       MET  60  -4.945   2.629  -3.251
  480   1HB   MET  60          HB2       MET  60  -3.329   2.206  -5.560
  481   2HB   MET  60          HB1       MET  60  -4.355   3.607  -5.852
  482   1HG   MET  60          HG2       MET  60  -3.503   4.785  -4.009
  483   2HG   MET  60          HG1       MET  60  -2.928   3.312  -3.226
  484   1HE   MET  60          HE1       MET  60   0.031   2.345  -4.104
  485   2HE   MET  60          HE2       MET  60  -0.773   1.847  -5.590
  486   3HE   MET  60          HE3       MET  60  -1.660   1.830  -4.069
  487    H    LYS  61           HN       LYS  61  -6.282   1.408  -6.295
  488    HA   LYS  61           HA       LYS  61  -8.170   3.498  -6.798
  489   1HB   LYS  61          HB2       LYS  61  -7.595   0.722  -7.630
  490   2HB   LYS  61          HB1       LYS  61  -9.283   1.201  -7.816
  491   1HG   LYS  61          HG2       LYS  61  -8.716   3.034  -9.227
  492   2HG   LYS  61          HG1       LYS  61  -7.006   2.923  -8.807
  493   1HD   LYS  61          HD2       LYS  61  -7.321   0.450  -9.774
  494   2HD   LYS  61          HD1       LYS  61  -8.610   1.244 -10.681
  495   1HE   LYS  61          HE2       LYS  61  -5.726   2.203 -10.584
  496   2HE   LYS  61          HE1       LYS  61  -6.459   1.313 -11.931
  497   1HZ   LYS  61          HZ1       LYS  61  -7.239   3.969 -10.870
  498   2HZ   LYS  61          HZ2       LYS  61  -8.252   3.060 -11.887
  499   3HZ   LYS  61          HZ3       LYS  61  -6.734   3.587 -12.442
  500    H    ASN  62           HN       ASN  62  -8.742   0.250  -5.361
  501    HA   ASN  62           HA       ASN  62 -11.414   0.798  -4.492
  502   1HB   ASN  62          HB2       ASN  62  -9.331  -1.232  -4.223
  503   2HB   ASN  62          HB1       ASN  62 -10.277  -1.072  -2.742
  504   1HD2  ASN  62          HD2       ASN  62 -10.431  -3.384  -4.506
  505   2HD2  ASN  62          HD2       ASN  62 -12.007  -3.434  -5.138
  506    H    LEU  63           HN       LEU  63  -8.278   1.022  -2.811
  507    HA   LEU  63           HA       LEU  63  -9.167   1.779  -0.243
  508   1HB   LEU  63          HB2       LEU  63  -6.752   2.084  -1.953
  509   2HB   LEU  63          HB1       LEU  63  -6.842   3.148  -0.544
  510    HG   LEU  63           HG       LEU  63  -7.567   0.307  -0.077
  511   1HD1  LEU  63          HD1       LEU  63  -5.697  -0.522  -1.033
  512   2HD1  LEU  63          HD1       LEU  63  -4.799   0.307   0.240
  513   3HD1  LEU  63          HD1       LEU  63  -5.044   1.091  -1.321
  514   1HD2  LEU  63          HD2       LEU  63  -6.714   0.750   2.055
  515   2HD2  LEU  63          HD2       LEU  63  -7.298   2.342   1.574
  516   3HD2  LEU  63          HD2       LEU  63  -5.580   1.961   1.459
  517    H    ASP  64           HN       ASP  64  -9.045   3.610  -3.231
  518    HA   ASP  64           HA       ASP  64  -9.344   6.233  -1.972
  519   1HB   ASP  64          HB2       ASP  64  -8.591   5.201  -4.432
  520   2HB   ASP  64          HB1       ASP  64 -10.178   5.894  -4.771
  521    H    ALA  65           HN       ALA  65 -11.473   3.680  -3.056
  522    HA   ALA  65           HA       ALA  65 -13.874   5.240  -3.383
  523   1HB   ALA  65          HB1       ALA  65 -13.387   2.923  -4.235
  524   2HB   ALA  65          HB2       ALA  65 -14.925   3.043  -3.383
  525   3HB   ALA  65          HB3       ALA  65 -13.523   2.337  -2.578
  526    H    LYS  66           HN       LYS  66 -12.122   4.224  -0.579
  527    HA   LYS  66           HA       LYS  66 -14.081   3.818   1.380
  528   1HB   LYS  66          HB2       LYS  66 -11.497   3.817   1.454
  529   2HB   LYS  66          HB1       LYS  66 -11.640   5.544   1.788
  530   1HG   LYS  66          HG2       LYS  66 -13.101   5.041   3.723
  531   2HG   LYS  66          HG1       LYS  66 -12.911   3.315   3.404
  532   1HD   LYS  66          HD2       LYS  66 -10.598   3.357   3.929
  533   2HD   LYS  66          HD1       LYS  66 -10.529   5.117   3.829
  534   1HE   LYS  66          HE2       LYS  66 -10.550   4.598   6.178
  535   2HE   LYS  66          HE1       LYS  66 -12.200   5.128   5.797
  536   1HZ   LYS  66          HZ1       LYS  66 -12.761   2.780   5.360
  537   2HZ   LYS  66          HZ2       LYS  66 -12.313   3.055   6.976
  538   3HZ   LYS  66          HZ3       LYS  66 -11.219   2.326   5.901
  539    H    GLN  67           HN       GLN  67 -13.022   6.859  -0.077
  540    HA   GLN  67           HA       GLN  67 -14.956   8.358   1.638
  541   1HB   GLN  67          HB2       GLN  67 -12.332   8.801   1.043
  542   2HB   GLN  67          HB1       GLN  67 -13.112   9.758  -0.215
  543   1HG   GLN  67          HG2       GLN  67 -14.023  11.243   1.281
  544   2HG   GLN  67          HG1       GLN  67 -14.210  10.019   2.539
  545   1HE2  GLN  67          HE2       GLN  67 -13.166  11.721   3.983
  546   2HE2  GLN  67          HE2       GLN  67 -11.473  11.842   3.990
  547    H    LYS  68           HN       LYS  68 -15.717   6.667  -0.713
  548    HA   LYS  68           HA       LYS  68 -17.154   6.815  -2.578
  549   1HB   LYS  68          HB2       LYS  68 -17.604   9.585  -1.417
  550   2HB   LYS  68          HB1       LYS  68 -18.711   8.698  -2.466
  551   1HG   LYS  68          HG2       LYS  68 -18.889   6.918  -0.743
  552   2HG   LYS  68          HG1       LYS  68 -17.833   7.857   0.313
  553   1HD   LYS  68          HD2       LYS  68 -20.230   9.232  -0.817
  554   2HD   LYS  68          HD1       LYS  68 -20.495   8.054   0.468
  555   1HE   LYS  68          HE2       LYS  68 -18.287   9.556   1.340
  556   2HE   LYS  68          HE1       LYS  68 -19.423  10.747   0.671
  557   1HZ   LYS  68          HZ1       LYS  68 -21.209   9.569   1.900
  558   2HZ   LYS  68          HZ2       LYS  68 -20.063  10.303   2.916
  559   3HZ   LYS  68          HZ3       LYS  68 -20.024   8.624   2.659
  560    H    LYS  69           HN       LYS  69 -15.923   6.858  -4.446
  561    HA   LYS  69           HA       LYS  69 -14.306   9.212  -5.160
  562   1HB   LYS  69          HB2       LYS  69 -13.924   6.625  -5.510
  563   2HB   LYS  69          HB1       LYS  69 -14.902   6.875  -6.956
  564   1HG   LYS  69          HG2       LYS  69 -13.124   7.741  -8.027
  565   2HG   LYS  69          HG1       LYS  69 -12.975   8.991  -6.792
  566   1HD   LYS  69          HD2       LYS  69 -11.024   8.020  -6.208
  567   2HD   LYS  69          HD1       LYS  69 -11.986   6.694  -5.553
  568   1HE   LYS  69          HE2       LYS  69 -10.884   5.386  -7.061
  569   2HE   LYS  69          HE1       LYS  69 -11.928   6.142  -8.282
  570   1HZ   LYS  69          HZ1       LYS  69  -9.736   6.589  -8.973
  571   2HZ   LYS  69          HZ2       LYS  69  -9.230   7.000  -7.403
  572   3HZ   LYS  69          HZ3       LYS  69 -10.274   8.032  -8.260
  573    H    ALA  70           HN       ALA  70 -16.387  10.598  -5.200
  574    HA   ALA  70           HA       ALA  70 -17.223  10.963  -7.973
  575   1HB   ALA  70          HB1       ALA  70 -18.560   9.016  -6.680
  576   2HB   ALA  70          HB2       ALA  70 -19.348  10.068  -7.858
  577   3HB   ALA  70          HB3       ALA  70 -19.505  10.402  -6.134
  578    H    SER  71           HN       SER  71 -16.092  12.977  -6.936
  579    HA   SER  71           HA       SER  71 -18.232  14.745  -5.807
  580   1HB   SER  71          HB2       SER  71 -16.742  15.492  -4.125
  581   2HB   SER  71          HB1       SER  71 -16.448  13.757  -4.192
  582    HG   SER  71           HG       SER  71 -14.467  14.668  -4.321
  583    HA   PRO  72           HA       PRO  72 -15.696  16.519  -9.388
  584   1HB   PRO  72          HB2       PRO  72 -17.639  16.530 -11.305
  585   2HB   PRO  72          HB1       PRO  72 -16.519  15.173 -11.068
  586   1HG   PRO  72          HG2       PRO  72 -19.337  15.479 -10.181
  587   2HG   PRO  72          HG1       PRO  72 -18.495  14.051 -10.798
  588   1HD   PRO  72          HD2       PRO  72 -19.010  14.471  -8.153
  589   2HD   PRO  72          HD1       PRO  72 -17.641  13.507  -8.749
  590    H    ARG  73           HN       ARG  73 -16.285  18.639 -10.538
  591    HA   ARG  73           HA       ARG  73 -17.571  20.454  -8.686
  592   1HB   ARG  73          HB2       ARG  73 -16.086  20.479 -11.222
  593   2HB   ARG  73          HB1       ARG  73 -17.296  21.758 -11.114
  594   1HG   ARG  73          HG2       ARG  73 -16.098  22.893  -9.573
  595   2HG   ARG  73          HG1       ARG  73 -15.807  21.438  -8.621
  596   1HD   ARG  73          HD2       ARG  73 -13.933  20.809 -10.021
  597   2HD   ARG  73          HD1       ARG  73 -14.294  22.114 -11.167
  598    HE   ARG  73           HE       ARG  73 -13.741  23.732  -9.371
  599   1HH1  ARG  73          HH1       ARG  73 -13.900  20.919  -7.681
  600   2HH1  ARG  73          HH1       ARG  73 -12.321  21.007  -6.978
  601   1HH2  ARG  73          HH2       ARG  73 -11.285  23.646  -8.975
  602   2HH2  ARG  73          HH2       ARG  73 -10.840  22.549  -7.709
  Start of MODEL   20
    1   1H    VAL   1          HT1       VAL   1  -4.340  10.909   4.311
    2   2H    VAL   1          HT2       VAL   1  -4.494  12.224   3.249
    3   3H    VAL   1          HT3       VAL   1  -5.019  12.362   4.858
    4    HA   VAL   1           HA       VAL   1  -2.870  13.495   4.490
    5    HB   VAL   1           HB       VAL   1  -1.821  12.362   6.456
    6   1HG1  VAL   1          HG1       VAL   1  -3.949  13.852   6.538
    7   2HG1  VAL   1          HG1       VAL   1  -3.557  12.884   7.959
    8   3HG1  VAL   1          HG1       VAL   1  -4.810  12.342   6.841
    9   1HG2  VAL   1          HG2       VAL   1  -2.639  10.049   5.444
   10   2HG2  VAL   1          HG2       VAL   1  -4.061  10.371   6.438
   11   3HG2  VAL   1          HG2       VAL   1  -2.469  10.253   7.188
   12    H    VAL   2           HN       VAL   2  -0.422  12.326   5.018
   13    HA   VAL   2           HA       VAL   2   0.088  10.205   3.015
   14    HB   VAL   2           HB       VAL   2   0.010  12.307   1.727
   15   1HG1  VAL   2          HG1       VAL   2   1.840  14.014   2.258
   16   2HG1  VAL   2          HG1       VAL   2   2.023  13.190   3.805
   17   3HG1  VAL   2          HG1       VAL   2   0.489  13.954   3.391
   18   1HG2  VAL   2          HG2       VAL   2   2.788  11.178   2.188
   19   2HG2  VAL   2          HG2       VAL   2   2.371  12.243   0.845
   20   3HG2  VAL   2          HG2       VAL   2   1.618  10.654   0.976
   21    H    ILE   3           HN       ILE   3   1.987   9.139   3.405
   22    HA   ILE   3           HA       ILE   3   3.578   9.987   5.796
   23    HB   ILE   3           HB       ILE   3   2.156   8.028   6.102
   24   1HG1  ILE   3          HG1       ILE   3   5.088   7.359   5.707
   25   2HG1  ILE   3          HG1       ILE   3   4.321   7.910   7.196
   26   1HG2  ILE   3          HG2       ILE   3   3.250   6.112   4.352
   27   2HG2  ILE   3          HG2       ILE   3   2.992   7.541   3.367
   28   3HG2  ILE   3          HG2       ILE   3   1.646   6.835   4.258
   29   1HD1  ILE   3          HD1       ILE   3   2.849   5.854   7.071
   30   2HD1  ILE   3          HD1       ILE   3   4.554   5.532   7.388
   31   3HD1  ILE   3          HD1       ILE   3   3.892   5.280   5.770
   32    HA   PRO   4           HA       PRO   4   6.516   9.663   2.250
   33   1HB   PRO   4          HB2       PRO   4   7.428  12.233   2.294
   34   2HB   PRO   4          HB1       PRO   4   5.958  11.751   1.426
   35   1HG   PRO   4          HG2       PRO   4   6.241  13.290   3.902
   36   2HG   PRO   4          HG1       PRO   4   4.883  13.202   2.775
   37   1HD   PRO   4          HD2       PRO   4   5.177  11.858   5.295
   38   2HD   PRO   4          HD1       PRO   4   3.814  11.784   4.162
   39    H    SER   5           HN       SER   5   6.759  10.479   5.577
   40    HA   SER   5           HA       SER   5   9.559  11.051   5.780
   41   1HB   SER   5          HB2       SER   5   8.448  11.662   7.679
   42   2HB   SER   5          HB1       SER   5   7.271  10.365   7.523
   43    HG   SER   5           HG       SER   5   8.445   9.632   9.150
   44    HA   PRO   6           HA       PRO   6  10.242   6.482   6.909
   45   1HB   PRO   6          HB2       PRO   6   8.167   4.727   6.708
   46   2HB   PRO   6          HB1       PRO   6   8.504   5.662   8.180
   47   1HG   PRO   6          HG2       PRO   6   6.487   6.132   6.058
   48   2HG   PRO   6          HG1       PRO   6   6.358   6.359   7.807
   49   1HD   PRO   6          HD2       PRO   6   6.750   8.410   6.036
   50   2HD   PRO   6          HD1       PRO   6   7.272   8.453   7.735
   51    H    CYS   7           HN       CYS   7  11.453   5.943   5.105
   52    HA   CYS   7           HA       CYS   7  10.190   5.669   2.457
   53   1HB   CYS   7          HB2       CYS   7  12.582   6.568   3.335
   54   2HB   CYS   7          HB1       CYS   7  13.016   4.896   2.977
   55    H    CYS   8           HN       CYS   8  12.076   3.566   1.620
   56    HA   CYS   8           HA       CYS   8  10.893   1.193   3.023
   57   1HB   CYS   8          HB2       CYS   8  10.831   2.101   0.194
   58   2HB   CYS   8          HB1       CYS   8  11.081   0.373   0.450
   59    H    MET   9           HN       MET   9  12.205  -0.750   2.860
   60    HA   MET   9           HA       MET   9  15.101  -0.175   2.352
   61   1HB   MET   9          HB2       MET   9  14.211  -0.825   4.656
   62   2HB   MET   9          HB1       MET   9  13.839  -2.406   3.970
   63   1HG   MET   9          HG2       MET   9  15.982  -3.050   4.202
   64   2HG   MET   9          HG1       MET   9  16.522  -1.678   3.235
   65   1HE   MET   9          HE1       MET   9  17.212  -2.539   7.470
   66   2HE   MET   9          HE2       MET   9  16.685  -3.527   6.112
   67   3HE   MET   9          HE3       MET   9  15.491  -2.678   7.089
   68    H    PHE  10           HN       PHE  10  12.616  -2.733   2.023
   69    HA   PHE  10           HA       PHE  10  14.043  -3.677  -0.435
   70   1HB   PHE  10          HB2       PHE  10  13.783  -5.967   0.338
   71   2HB   PHE  10          HB1       PHE  10  14.544  -5.044   1.632
   72    HD1  PHE  10           HD1      PHE  10  11.545  -6.853   0.565
   73    HD2  PHE  10           HD2      PHE  10  13.224  -4.345   3.622
   74    HE1  PHE  10           HE1      PHE  10   9.697  -7.478   2.095
   75    HE2  PHE  10           HE2      PHE  10  11.375  -4.969   5.152
   76    HZ   PHE  10           HZ       PHE  10   9.612  -6.536   4.388
   77    H    PHE  11           HN       PHE  11  12.601  -4.620  -2.024
   78    HA   PHE  11           HA       PHE  11   9.818  -3.658  -1.790
   79   1HB   PHE  11          HB2       PHE  11  11.758  -4.266  -3.861
   80   2HB   PHE  11          HB1       PHE  11  10.226  -5.070  -4.201
   81    HD1  PHE  11           HD1      PHE  11   9.416  -3.739  -5.998
   82    HD2  PHE  11           HD2      PHE  11  10.669  -1.869  -2.340
   83    HE1  PHE  11           HE1      PHE  11   8.440  -1.594  -6.758
   84    HE2  PHE  11           HE2      PHE  11   9.689   0.274  -3.101
   85    HZ   PHE  11           HZ       PHE  11   8.577   0.417  -5.312
   86    H    VAL  12           HN       VAL  12   8.015  -5.024  -1.787
   87    HA   VAL  12           HA       VAL  12   8.015  -7.432  -0.405
   88    HB   VAL  12           HB       VAL  12   5.817  -7.787  -1.666
   89   1HG1  VAL  12          HG1       VAL  12   5.158  -5.228  -0.944
   90   2HG1  VAL  12          HG1       VAL  12   6.654  -5.474  -0.044
   91   3HG1  VAL  12          HG1       VAL  12   5.296  -6.576   0.183
   92   1HG2  VAL  12          HG2       VAL  12   5.148  -6.256  -3.333
   93   2HG2  VAL  12          HG2       VAL  12   6.833  -6.574  -3.741
   94   3HG2  VAL  12          HG2       VAL  12   6.396  -5.090  -2.893
   95    H    SER  13           HN       SER  13   7.749  -9.671  -1.139
   96    HA   SER  13           HA       SER  13   9.624 -10.461  -3.191
   97   1HB   SER  13          HB2       SER  13   7.440 -12.215  -2.098
   98   2HB   SER  13          HB1       SER  13   9.124 -12.617  -2.419
   99    HG   SER  13           HG       SER  13   8.089 -11.936  -0.134
  100    H    LYS  14           HN       LYS  14   6.160  -9.885  -3.116
  101    HA   LYS  14           HA       LYS  14   5.989  -9.859  -6.014
  102   1HB   LYS  14          HB2       LYS  14   4.518 -11.866  -6.167
  103   2HB   LYS  14          HB1       LYS  14   6.135 -12.278  -5.596
  104   1HG   LYS  14          HG2       LYS  14   4.730 -11.647  -3.265
  105   2HG   LYS  14          HG1       LYS  14   3.571 -12.558  -4.233
  106   1HD   LYS  14          HD2       LYS  14   6.126 -13.838  -4.448
  107   2HD   LYS  14          HD1       LYS  14   5.779 -13.568  -2.740
  108   1HE   LYS  14          HE2       LYS  14   4.757 -15.665  -3.212
  109   2HE   LYS  14          HE1       LYS  14   3.410 -14.513  -3.307
  110   1HZ   LYS  14          HZ1       LYS  14   3.550 -15.974  -5.274
  111   2HZ   LYS  14          HZ2       LYS  14   5.088 -15.337  -5.617
  112   3HZ   LYS  14          HZ3       LYS  14   3.717 -14.334  -5.666
  113    H    ARG  15           HN       ARG  15   3.228 -10.410  -6.248
  114    HA   ARG  15           HA       ARG  15   2.084  -7.976  -5.102
  115   1HB   ARG  15          HB2       ARG  15   1.499  -8.695  -7.335
  116   2HB   ARG  15          HB1       ARG  15   1.073 -10.309  -6.770
  117   1HG   ARG  15          HG2       ARG  15  -0.423  -8.125  -5.464
  118   2HG   ARG  15          HG1       ARG  15  -0.733  -8.298  -7.189
  119   1HD   ARG  15          HD2       ARG  15  -0.756 -10.704  -5.355
  120   2HD   ARG  15          HD1       ARG  15  -2.209  -9.715  -5.614
  121    HE   ARG  15           HE       ARG  15  -0.916 -10.373  -8.122
  122   1HH1  ARG  15          HH1       ARG  15  -1.505 -12.857  -6.247
  123   2HH1  ARG  15          HH1       ARG  15  -2.974 -13.408  -6.981
  124   1HH2  ARG  15          HH2       ARG  15  -3.461 -10.504  -8.810
  125   2HH2  ARG  15          HH2       ARG  15  -4.082 -12.074  -8.431
  126    H    ILE  16           HN       ILE  16   0.182  -7.982  -3.681
  127    HA   ILE  16           HA       ILE  16   0.163 -10.298  -1.786
  128    HB   ILE  16           HB       ILE  16  -1.264  -7.820  -1.039
  129   1HG1  ILE  16          HG1       ILE  16   1.725  -7.739  -1.566
  130   2HG1  ILE  16          HG1       ILE  16   0.495  -6.722  -2.302
  131   1HG2  ILE  16          HG2       ILE  16   0.203  -9.984   0.153
  132   2HG2  ILE  16          HG2       ILE  16  -0.854  -8.806   0.929
  133   3HG2  ILE  16          HG2       ILE  16   0.860  -8.452   0.724
  134   1HD1  ILE  16          HD1       ILE  16   0.008  -5.661  -0.177
  135   2HD1  ILE  16          HD1       ILE  16   1.748  -5.581  -0.453
  136   3HD1  ILE  16          HD1       ILE  16   1.088  -6.771   0.668
  137    HA   PRO  17           HA       PRO  17  -4.100 -10.908  -2.827
  138   1HB   PRO  17          HB2       PRO  17  -4.905 -12.294  -0.621
  139   2HB   PRO  17          HB1       PRO  17  -3.825 -12.980  -1.849
  140   1HG   PRO  17          HG2       PRO  17  -3.235 -12.162   0.876
  141   2HG   PRO  17          HG1       PRO  17  -2.294 -13.172  -0.226
  142   1HD   PRO  17          HD2       PRO  17  -1.926 -10.381   0.430
  143   2HD   PRO  17          HD1       PRO  17  -0.891 -11.438  -0.558
  144    H    GLU  18           HN       GLU  18  -5.554  -9.196  -2.767
  145    HA   GLU  18           HA       GLU  18  -5.812  -7.172  -0.888
  146   1HB   GLU  18          HB2       GLU  18  -8.112  -6.932  -1.829
  147   2HB   GLU  18          HB1       GLU  18  -6.897  -7.218  -3.075
  148   1HG   GLU  18          HG2       GLU  18  -8.137  -8.966  -3.767
  149   2HG   GLU  18          HG1       GLU  18  -7.713  -9.775  -2.260
  150    H    ASN  19           HN       ASN  19  -7.003 -10.463  -0.588
  151    HA   ASN  19           HA       ASN  19  -8.973 -10.033   1.452
  152   1HB   ASN  19          HB2       ASN  19  -8.330 -12.081  -0.062
  153   2HB   ASN  19          HB1       ASN  19  -7.229 -12.479   1.257
  154   1HD2  ASN  19          HD2       ASN  19  -8.161 -13.859   2.759
  155   2HD2  ASN  19          HD2       ASN  19  -9.812 -13.908   3.153
  156    H    ARG  20           HN       ARG  20  -5.492 -10.013   1.530
  157    HA   ARG  20           HA       ARG  20  -5.494 -10.215   4.512
  158   1HB   ARG  20          HB2       ARG  20  -3.428 -10.547   2.325
  159   2HB   ARG  20          HB1       ARG  20  -3.000 -10.521   4.032
  160   1HG   ARG  20          HG2       ARG  20  -5.148 -12.288   3.914
  161   2HG   ARG  20          HG1       ARG  20  -4.208 -12.663   2.471
  162   1HD   ARG  20          HD2       ARG  20  -2.228 -13.098   3.758
  163   2HD   ARG  20          HD1       ARG  20  -2.957 -12.411   5.224
  164    HE   ARG  20           HE       ARG  20  -4.099 -14.456   5.530
  165   1HH1  ARG  20          HH1       ARG  20  -1.954 -15.615   3.640
  166   2HH1  ARG  20          HH1       ARG  20  -2.952 -16.503   2.537
  167   1HH2  ARG  20          HH2       ARG  20  -5.886 -14.935   3.513
  168   2HH2  ARG  20          HH2       ARG  20  -5.176 -16.117   2.465
  169    H    VAL  21           HN       VAL  21  -4.554  -8.156   1.799
  170    HA   VAL  21           HA       VAL  21  -3.135  -6.173   3.351
  171    HB   VAL  21           HB       VAL  21  -4.593  -5.925   0.701
  172   1HG1  VAL  21          HG1       VAL  21  -2.792  -4.244   0.264
  173   2HG1  VAL  21          HG1       VAL  21  -2.263  -4.430   1.936
  174   3HG1  VAL  21          HG1       VAL  21  -3.864  -3.780   1.585
  175   1HG2  VAL  21          HG2       VAL  21  -3.148  -7.510  -0.021
  176   2HG2  VAL  21          HG2       VAL  21  -2.263  -7.489   1.503
  177   3HG2  VAL  21          HG2       VAL  21  -1.868  -6.326   0.238
  178    H    VAL  22           HN       VAL  22  -3.916  -4.072   4.020
  179    HA   VAL  22           HA       VAL  22  -6.890  -3.823   4.146
  180    HB   VAL  22           HB       VAL  22  -6.408  -2.751   6.387
  181   1HG1  VAL  22          HG1       VAL  22  -5.655  -5.094   7.372
  182   2HG1  VAL  22          HG1       VAL  22  -5.969  -5.615   5.717
  183   3HG1  VAL  22          HG1       VAL  22  -7.254  -4.869   6.666
  184   1HG2  VAL  22          HG2       VAL  22  -4.029  -2.249   6.023
  185   2HG2  VAL  22          HG2       VAL  22  -3.680  -3.973   5.923
  186   3HG2  VAL  22          HG2       VAL  22  -4.239  -3.276   7.439
  187    H    SER  23           HN       SER  23  -3.771  -2.123   4.130
  188    HA   SER  23           HA       SER  23  -4.825   0.066   2.538
  189   1HB   SER  23          HB2       SER  23  -5.883   0.487   4.717
  190   2HB   SER  23          HB1       SER  23  -4.309   0.426   5.505
  191    HG   SER  23           HG       SER  23  -3.990   2.415   4.914
  192    H    TYR  24           HN       TYR  24  -3.075   1.511   1.892
  193    HA   TYR  24           HA       TYR  24  -0.400   0.408   2.536
  194   1HB   TYR  24          HB2       TYR  24   0.200   1.203   0.377
  195   2HB   TYR  24          HB1       TYR  24  -1.409   0.523   0.201
  196    HD1  TYR  24           HD1      TYR  24  -3.373   1.981  -0.067
  197    HD2  TYR  24           HD2      TYR  24   0.588   3.615   0.238
  198    HE1  TYR  24           HE1      TYR  24  -4.212   4.162  -0.895
  199    HE2  TYR  24           HE2      TYR  24  -0.253   5.794  -0.592
  200    HH   TYR  24           HH       TYR  24  -3.512   6.168  -1.817
  201    H    GLN  25           HN       GLN  25   1.212   2.381   1.803
  202    HA   GLN  25           HA       GLN  25   0.594   4.917   3.183
  203   1HB   GLN  25          HB2       GLN  25   2.171   2.659   4.264
  204   2HB   GLN  25          HB1       GLN  25   3.005   4.210   4.335
  205   1HG   GLN  25          HG2       GLN  25   1.836   4.396   6.299
  206   2HG   GLN  25          HG1       GLN  25   0.578   4.989   5.213
  207   1HE2  GLN  25          HE2       GLN  25  -1.127   4.141   6.636
  208   2HE2  GLN  25          HE2       GLN  25  -1.439   2.476   6.725
  209    H    LEU  26           HN       LEU  26   1.022   5.880   1.112
  210    HA   LEU  26           HA       LEU  26   3.237   5.168  -0.551
  211   1HB   LEU  26          HB2       LEU  26   1.097   7.164  -0.398
  212   2HB   LEU  26          HB1       LEU  26   2.549   7.761  -1.204
  213    HG   LEU  26           HG       LEU  26   1.072   5.202  -1.895
  214   1HD1  LEU  26          HD1       LEU  26   1.101   7.984  -3.015
  215   2HD1  LEU  26          HD1       LEU  26  -0.251   6.869  -2.827
  216   3HD1  LEU  26          HD1       LEU  26   0.917   6.625  -4.124
  217   1HD2  LEU  26          HD2       LEU  26   2.674   5.368  -3.914
  218   2HD2  LEU  26          HD2       LEU  26   3.366   4.826  -2.388
  219   3HD2  LEU  26          HD2       LEU  26   3.608   6.487  -2.924
  220    H    SER  27           HN       SER  27   5.305   5.901  -0.651
  221    HA   SER  27           HA       SER  27   6.105   8.126   1.173
  222   1HB   SER  27          HB2       SER  27   6.629   5.601   1.742
  223   2HB   SER  27          HB1       SER  27   7.902   5.808   0.542
  224    HG   SER  27           HG       SER  27   8.781   7.421   1.764
  225    H    SER  28           HN       SER  28   5.655   9.105  -1.185
  226    HA   SER  28           HA       SER  28   8.013   8.726  -2.964
  227   1HB   SER  28          HB2       SER  28   6.496  10.225  -4.434
  228   2HB   SER  28          HB1       SER  28   5.933   8.591  -4.094
  229    HG   SER  28           HG       SER  28   5.260  10.846  -2.513
  230    H    ARG  29           HN       ARG  29   9.529  10.349  -3.238
  231    HA   ARG  29           HA       ARG  29   9.035  13.137  -2.614
  232   1HB   ARG  29          HB2       ARG  29  10.481  13.187  -0.585
  233   2HB   ARG  29          HB1       ARG  29   9.051  12.185  -0.348
  234   1HG   ARG  29          HG2       ARG  29  11.209  10.623  -1.490
  235   2HG   ARG  29          HG1       ARG  29  11.727  11.401   0.007
  236   1HD   ARG  29          HD2       ARG  29   9.637  10.524   1.112
  237   2HD   ARG  29          HD1       ARG  29   9.312   9.600  -0.368
  238    HE   ARG  29           HE       ARG  29  11.276   8.272   0.061
  239   1HH1  ARG  29          HH2       ARG  29  13.084  10.378   1.142
  240   2HH1  ARG  29          HH2       ARG  29  13.197   9.951   2.815
  241   1HH2  ARG  29          HH1       ARG  29  10.412   7.885   2.752
  242   2HH2  ARG  29          HH1       ARG  29  11.685   8.541   3.726
  243    H    SER  30           HN       SER  30  11.624  13.964  -2.030
  244    HA   SER  30           HA       SER  30  13.190  12.906  -4.362
  245   1HB   SER  30          HB2       SER  30  14.075  15.285  -4.407
  246   2HB   SER  30          HB1       SER  30  12.359  15.132  -4.777
  247    HG   SER  30           HG       SER  30  12.539  16.729  -3.264
  248    H    THR  31           HN       THR  31  13.250  12.108  -1.433
  249    HA   THR  31           HA       THR  31  16.150  12.712  -0.952
  250    HB   THR  31           HB       THR  31  15.312  12.471   1.536
  251    HG1  THR  31           HG1      THR  31  13.128  13.293   1.637
  252   1HG2  THR  31          HG2       THR  31  14.313  14.999   1.042
  253   2HG2  THR  31          HG2       THR  31  15.356  14.717  -0.353
  254   3HG2  THR  31          HG2       THR  31  16.016  14.606   1.279
  255    H    CYS  32           HN       CYS  32  14.760  10.379  -2.243
  256    HA   CYS  32           HA       CYS  32  16.005   8.264  -0.574
  257   1HB   CYS  32          HB2       CYS  32  13.248   8.887  -0.543
  258   2HB   CYS  32          HB1       CYS  32  13.397   7.413  -1.501
  259    H    LEU  33           HN       LEU  33  17.073   6.871  -1.930
  260    HA   LEU  33           HA       LEU  33  16.972   7.181  -4.802
  261   1HB   LEU  33          HB2       LEU  33  18.603   6.018  -2.823
  262   2HB   LEU  33          HB1       LEU  33  18.108   4.682  -3.863
  263    HG   LEU  33           HG       LEU  33  18.859   5.918  -5.845
  264   1HD1  LEU  33          HD1       LEU  33  19.100   8.155  -5.776
  265   2HD1  LEU  33          HD1       LEU  33  20.395   7.989  -4.590
  266   3HD1  LEU  33          HD1       LEU  33  18.722   8.134  -4.054
  267   1HD2  LEU  33          HD2       LEU  33  21.268   6.300  -4.228
  268   2HD2  LEU  33          HD2       LEU  33  20.968   5.157  -5.537
  269   3HD2  LEU  33          HD2       LEU  33  20.470   4.764  -3.891
  270    H    LYS  34           HN       LYS  34  15.331   5.068  -2.523
  271    HA   LYS  34           HA       LYS  34  14.204   3.473  -4.792
  272   1HB   LYS  34          HB2       LYS  34  15.401   2.417  -2.802
  273   2HB   LYS  34          HB1       LYS  34  14.047   2.959  -1.809
  274   1HG   LYS  34          HG2       LYS  34  12.519   1.546  -2.895
  275   2HG   LYS  34          HG1       LYS  34  13.550   1.369  -4.316
  276   1HD   LYS  34          HD2       LYS  34  15.234   0.243  -2.691
  277   2HD   LYS  34          HD1       LYS  34  13.853   0.086  -1.604
  278   1HE   LYS  34          HE2       LYS  34  13.728  -1.930  -2.795
  279   2HE   LYS  34          HE1       LYS  34  12.668  -0.896  -3.773
  280   1HZ   LYS  34          HZ1       LYS  34  15.512  -1.574  -4.244
  281   2HZ   LYS  34          HZ2       LYS  34  14.786  -0.219  -4.971
  282   3HZ   LYS  34          HZ3       LYS  34  14.194  -1.779  -5.295
  283    H    ALA  35           HN       ALA  35  12.136   3.989  -5.405
  284    HA   ALA  35           HA       ALA  35  10.393   5.408  -3.416
  285   1HB   ALA  35          HB1       ALA  35   9.638   5.716  -6.198
  286   2HB   ALA  35          HB2       ALA  35  11.335   6.140  -5.968
  287   3HB   ALA  35          HB3       ALA  35  10.085   6.959  -5.030
  288    H    GLY  36           HN       GLY  36   8.912   3.926  -2.676
  289   1HA   GLY  36          HA2       GLY  36   7.265   2.497  -4.673
  290   2HA   GLY  36          HA1       GLY  36   8.110   1.490  -3.493
  291    H    VAL  37           HN       VAL  37   5.502   1.177  -3.228
  292    HA   VAL  37           HA       VAL  37   4.518   3.202  -1.262
  293    HB   VAL  37           HB       VAL  37   3.112   0.888  -2.630
  294   1HG1  VAL  37          HG1       VAL  37   1.095   2.337  -2.056
  295   2HG1  VAL  37          HG1       VAL  37   2.178   3.291  -1.041
  296   3HG1  VAL  37          HG1       VAL  37   1.903   1.587  -0.678
  297   1HG2  VAL  37          HG2       VAL  37   3.179   2.144  -4.499
  298   2HG2  VAL  37          HG2       VAL  37   4.009   3.443  -3.642
  299   3HG2  VAL  37          HG2       VAL  37   2.247   3.377  -3.647
  300    H    ILE  38           HN       ILE  38   3.337   2.211   0.669
  301    HA   ILE  38           HA       ILE  38   4.736  -0.289   1.560
  302    HB   ILE  38           HB       ILE  38   3.892   2.197   3.076
  303   1HG1  ILE  38          HG1       ILE  38   6.525   1.869   3.569
  304   2HG1  ILE  38          HG1       ILE  38   6.442   1.108   1.980
  305   1HG2  ILE  38          HG2       ILE  38   5.525   0.488   4.650
  306   2HG2  ILE  38          HG2       ILE  38   4.249  -0.523   3.970
  307   3HG2  ILE  38          HG2       ILE  38   3.830   0.903   4.922
  308   1HD1  ILE  38          HD1       ILE  38   6.938   3.505   1.749
  309   2HD1  ILE  38          HD1       ILE  38   5.480   3.905   2.659
  310   3HD1  ILE  38          HD1       ILE  38   5.349   3.143   1.075
  311    H    PHE  39           HN       PHE  39   3.260  -1.937   1.659
  312    HA   PHE  39           HA       PHE  39   0.439  -1.239   2.335
  313   1HB   PHE  39          HB2       PHE  39   1.792  -3.399   0.748
  314   2HB   PHE  39          HB1       PHE  39   0.154  -3.641   1.352
  315    HD1  PHE  39           HD1      PHE  39   2.275  -1.300  -0.635
  316    HD2  PHE  39           HD2      PHE  39  -1.692  -2.657   0.276
  317    HE1  PHE  39           HE1      PHE  39   1.378   0.069  -2.495
  318    HE2  PHE  39           HE2      PHE  39  -2.588  -1.289  -1.582
  319    HZ   PHE  39           HZ       PHE  39  -1.056   0.075  -2.966
  320    H    THR  40           HN       THR  40  -0.584  -2.262   4.037
  321    HA   THR  40           HA       THR  40   1.133  -3.979   5.770
  322    HB   THR  40           HB       THR  40  -1.045  -1.947   6.319
  323    HG1  THR  40           HG1      THR  40   1.642  -2.167   7.194
  324   1HG2  THR  40          HG2       THR  40  -1.570  -3.073   8.193
  325   2HG2  THR  40          HG2       THR  40   0.082  -2.815   8.754
  326   3HG2  THR  40          HG2       THR  40  -0.330  -4.281   7.865
  327    H    THR  41           HN       THR  41   0.124  -5.837   6.695
  328    HA   THR  41           HA       THR  41  -2.252  -6.808   5.216
  329    HB   THR  41           HB       THR  41  -0.611  -8.325   7.237
  330    HG1  THR  41           HG1      THR  41   0.654  -8.859   5.254
  331   1HG2  THR  41          HG2       THR  41  -2.364  -8.923   4.895
  332   2HG2  THR  41          HG2       THR  41  -2.288  -9.716   6.467
  333   3HG2  THR  41          HG2       THR  41  -1.046 -10.039   5.257
  334    H    LYS  42           HN       LYS  42  -3.891  -8.061   6.594
  335    HA   LYS  42           HA       LYS  42  -4.944  -6.376   8.688
  336   1HB   LYS  42          HB2       LYS  42  -5.804  -8.408   6.999
  337   2HB   LYS  42          HB1       LYS  42  -5.872  -9.157   8.595
  338   1HG   LYS  42          HG2       LYS  42  -6.889  -6.501   8.840
  339   2HG   LYS  42          HG1       LYS  42  -7.684  -7.257   7.459
  340   1HD   LYS  42          HD2       LYS  42  -7.428  -9.057   9.762
  341   2HD   LYS  42          HD1       LYS  42  -8.398  -7.623  10.107
  342   1HE   LYS  42          HE2       LYS  42  -9.578  -8.149   7.840
  343   2HE   LYS  42          HE1       LYS  42  -8.882  -9.769   8.043
  344   1HZ   LYS  42          HZ1       LYS  42  -9.772  -9.743  10.344
  345   2HZ   LYS  42          HZ2       LYS  42 -10.982  -9.734   9.152
  346   3HZ   LYS  42          HZ3       LYS  42 -10.591  -8.302   9.979
  347    H    LYS  43           HN       LYS  43  -2.785  -9.129   8.656
  348    HA   LYS  43           HA       LYS  43  -3.138  -9.915  11.423
  349   1HB   LYS  43          HB2       LYS  43  -2.121 -11.131   9.342
  350   2HB   LYS  43          HB1       LYS  43  -0.635 -10.288   9.785
  351   1HG   LYS  43          HG2       LYS  43  -1.277 -11.231  12.205
  352   2HG   LYS  43          HG1       LYS  43  -2.085 -12.459  11.230
  353   1HD   LYS  43          HD2       LYS  43   0.198 -12.475   9.906
  354   2HD   LYS  43          HD1       LYS  43   0.837 -11.805  11.407
  355   1HE   LYS  43          HE2       LYS  43  -0.692 -13.847  12.387
  356   2HE   LYS  43          HE1       LYS  43  -0.145 -14.540  10.847
  357   1HZ   LYS  43          HZ1       LYS  43   1.658 -13.137  12.742
  358   2HZ   LYS  43          HZ2       LYS  43   2.100 -14.036  11.368
  359   3HZ   LYS  43          HZ3       LYS  43   1.455 -14.821  12.731
  360    H    GLY  44           HN       GLY  44  -1.304  -7.415   9.809
  361   1HA   GLY  44          HA2       GLY  44  -0.658  -5.532  11.372
  362   2HA   GLY  44          HA1       GLY  44   0.035  -6.785  12.395
  363    H    GLN  45           HN       GLN  45   0.589  -7.729   9.248
  364    HA   GLN  45           HA       GLN  45   3.429  -7.192   9.419
  365   1HB   GLN  45          HB2       GLN  45   1.616  -8.138   7.175
  366   2HB   GLN  45          HB1       GLN  45   3.377  -8.229   7.143
  367   1HG   GLN  45          HG2       GLN  45   3.292  -9.610   9.229
  368   2HG   GLN  45          HG1       GLN  45   1.532  -9.609   9.114
  369   1HE2  GLN  45          HE2       GLN  45   4.228 -10.132   6.759
  370   2HE2  GLN  45          HE2       GLN  45   3.571 -11.555   6.106
  371    H    GLN  46           HN       GLN  46   4.562  -6.065   7.500
  372    HA   GLN  46           HA       GLN  46   3.040  -3.929   6.166
  373   1HB   GLN  46          HB2       GLN  46   3.359  -3.005   8.401
  374   2HB   GLN  46          HB1       GLN  46   5.079  -3.394   8.352
  375   1HG   GLN  46          HG2       GLN  46   5.579  -1.577   7.086
  376   2HG   GLN  46          HG1       GLN  46   4.152  -1.781   6.070
  377   1HE2  GLN  46          HE2       GLN  46   5.287   0.658   7.601
  378   2HE2  GLN  46          HE2       GLN  46   3.954   1.239   8.476
  379    H    SER  47           HN       SER  47   3.916  -4.547   4.173
  380    HA   SER  47           HA       SER  47   6.908  -4.551   3.953
  381   1HB   SER  47          HB2       SER  47   4.693  -5.993   2.476
  382   2HB   SER  47          HB1       SER  47   6.355  -5.964   1.892
  383    HG   SER  47           HG       SER  47   6.993  -7.102   3.631
  384    H    CYS  48           HN       CYS  48   7.603  -3.887   1.637
  385    HA   CYS  48           HA       CYS  48   6.210  -1.354   0.958
  386   1HB   CYS  48          HB2       CYS  48   8.881  -2.620   0.306
  387   2HB   CYS  48          HB1       CYS  48   8.346  -1.117  -0.448
  388    H    GLY  49           HN       GLY  49   4.706  -1.438  -0.677
  389   1HA   GLY  49          HA2       GLY  49   4.745  -3.693  -2.576
  390   2HA   GLY  49          HA1       GLY  49   3.466  -2.490  -2.426
  391    H    ASP  50           HN       ASP  50   4.930  -3.425  -4.825
  392    HA   ASP  50           HA       ASP  50   6.542  -1.104  -5.672
  393   1HB   ASP  50          HB2       ASP  50   7.253  -3.299  -6.371
  394   2HB   ASP  50          HB1       ASP  50   5.632  -3.717  -6.918
  395    HA   PRO  51           HA       PRO  51   2.811   0.900  -7.104
  396   1HB   PRO  51          HB2       PRO  51   4.016   2.955  -8.465
  397   2HB   PRO  51          HB1       PRO  51   3.849   2.927  -6.698
  398   1HG   PRO  51          HG2       PRO  51   6.210   2.236  -8.384
  399   2HG   PRO  51          HG1       PRO  51   6.137   3.131  -6.857
  400   1HD   PRO  51          HD2       PRO  51   6.891   0.533  -6.988
  401   2HD   PRO  51          HD1       PRO  51   6.045   1.217  -5.582
  402    H    LYS  52           HN       LYS  52   5.470  -0.163  -9.116
  403    HA   LYS  52           HA       LYS  52   4.241   0.239 -11.691
  404   1HB   LYS  52          HB2       LYS  52   6.622  -0.846 -10.531
  405   2HB   LYS  52          HB1       LYS  52   5.958  -2.055 -11.631
  406   1HG   LYS  52          HG2       LYS  52   6.003   0.768 -12.588
  407   2HG   LYS  52          HG1       LYS  52   7.549  -0.076 -12.497
  408   1HD   LYS  52          HD2       LYS  52   6.193  -2.017 -13.684
  409   2HD   LYS  52          HD1       LYS  52   5.159  -0.682 -14.197
  410   1HE   LYS  52          HE2       LYS  52   7.782   0.246 -14.613
  411   2HE   LYS  52          HE1       LYS  52   7.778  -1.429 -15.201
  412   1HZ   LYS  52          HZ1       LYS  52   5.603  -0.879 -16.289
  413   2HZ   LYS  52          HZ2       LYS  52   6.954  -0.102 -16.963
  414   3HZ   LYS  52          HZ3       LYS  52   5.904   0.752 -15.936
  415    H    GLN  53           HN       GLN  53   3.812  -2.116  -9.153
  416    HA   GLN  53           HA       GLN  53   2.616  -4.194 -10.803
  417   1HB   GLN  53          HB2       GLN  53   2.620  -3.574  -7.832
  418   2HB   GLN  53          HB1       GLN  53   1.982  -5.064  -8.527
  419   1HG   GLN  53          HG2       GLN  53   4.784  -4.165  -9.165
  420   2HG   GLN  53          HG1       GLN  53   4.444  -5.056  -7.680
  421   1HE2  GLN  53          HE2       GLN  53   4.300  -7.313  -7.861
  422   2HE2  GLN  53          HE2       GLN  53   4.195  -8.154  -9.333
  423    H    GLU  54           HN       GLU  54   0.294  -4.802 -10.605
  424    HA   GLU  54           HA       GLU  54  -1.425  -2.393 -10.714
  425   1HB   GLU  54          HB2       GLU  54  -1.239  -4.956 -11.957
  426   2HB   GLU  54          HB1       GLU  54  -2.805  -4.870 -11.148
  427   1HG   GLU  54          HG2       GLU  54  -2.028  -2.417 -12.598
  428   2HG   GLU  54          HG1       GLU  54  -2.312  -3.824 -13.623
  429    H    TRP  55           HN       TRP  55  -0.629  -4.748  -8.297
  430    HA   TRP  55           HA       TRP  55  -3.311  -4.711  -7.096
  431   1HB   TRP  55          HB2       TRP  55  -2.251  -6.075  -5.372
  432   2HB   TRP  55          HB1       TRP  55  -1.844  -6.677  -6.969
  433    HD1  TRP  55           HD1      TRP  55   0.653  -6.552  -7.735
  434    HE1  TRP  55           HE1      TRP  55   2.844  -6.131  -6.436
  435    HE3  TRP  55           HE3      TRP  55  -1.226  -4.606  -3.409
  436    HZ2  TRP  55           HZ2      TRP  55   3.672  -5.147  -3.928
  437    HZ3  TRP  55           HZ3      TRP  55   0.294  -3.935  -1.574
  438    HH2  TRP  55           HH2      TRP  55   2.749  -4.190  -1.827
  439    H    VAL  56           HN       VAL  56  -0.320  -2.887  -6.825
  440    HA   VAL  56           HA       VAL  56  -1.033  -1.571  -4.321
  441    HB   VAL  56           HB       VAL  56   0.771  -0.850  -6.668
  442   1HG1  VAL  56          HG1       VAL  56   0.858   1.249  -5.845
  443   2HG1  VAL  56          HG1       VAL  56   1.522   0.592  -4.350
  444   3HG1  VAL  56          HG1       VAL  56  -0.219   0.813  -4.519
  445   1HG2  VAL  56          HG2       VAL  56   2.554  -1.335  -4.959
  446   2HG2  VAL  56          HG2       VAL  56   1.582  -2.742  -5.389
  447   3HG2  VAL  56          HG2       VAL  56   1.287  -1.897  -3.871
  448    H    GLN  57           HN       GLN  57  -1.165  -0.694  -7.769
  449    HA   GLN  57           HA       GLN  57  -2.721   1.681  -7.537
  450   1HB   GLN  57          HB2       GLN  57  -1.553   0.050  -9.514
  451   2HB   GLN  57          HB1       GLN  57  -3.272   0.053  -9.904
  452   1HG   GLN  57          HG2       GLN  57  -3.248   2.557  -9.733
  453   2HG   GLN  57          HG1       GLN  57  -1.498   2.482  -9.516
  454   1HE2  GLN  57          HE2       GLN  57  -4.035   1.329 -11.814
  455   2HE2  GLN  57          HE2       GLN  57  -3.063   1.493 -13.196
  456    H    ARG  58           HN       ARG  58  -3.698  -1.737  -8.010
  457    HA   ARG  58           HA       ARG  58  -6.508  -1.341  -8.195
  458   1HB   ARG  58          HB2       ARG  58  -5.336  -3.457  -8.652
  459   2HB   ARG  58          HB1       ARG  58  -4.869  -3.581  -6.957
  460   1HG   ARG  58          HG2       ARG  58  -7.300  -3.608  -6.349
  461   2HG   ARG  58          HG1       ARG  58  -7.684  -3.652  -8.070
  462   1HD   ARG  58          HD2       ARG  58  -5.699  -5.676  -7.409
  463   2HD   ARG  58          HD1       ARG  58  -7.178  -5.881  -6.447
  464    HE   ARG  58           HE       ARG  58  -7.653  -5.288  -9.284
  465   1HH1  ARG  58          HH2       ARG  58  -9.042  -7.015  -6.980
  466   2HH1  ARG  58          HH2       ARG  58  -9.045  -8.550  -7.779
  467   1HH2  ARG  58          HH1       ARG  58  -6.855  -7.553 -10.273
  468   2HH2  ARG  58          HH1       ARG  58  -7.806  -8.856  -9.645
  469    H    TYR  59           HN       TYR  59  -4.589  -2.226  -5.294
  470    HA   TYR  59           HA       TYR  59  -6.656  -1.881  -3.372
  471   1HB   TYR  59          HB2       TYR  59  -3.653  -1.425  -3.221
  472   2HB   TYR  59          HB1       TYR  59  -4.701  -1.608  -1.821
  473    HD1  TYR  59           HD1      TYR  59  -2.681  -3.413  -1.629
  474    HD2  TYR  59           HD2      TYR  59  -6.064  -3.745  -4.264
  475    HE1  TYR  59           HE1      TYR  59  -2.379  -5.871  -1.698
  476    HE2  TYR  59           HE2      TYR  59  -5.752  -6.204  -4.328
  477    HH   TYR  59           HH       TYR  59  -3.485  -7.830  -2.231
  478    H    MET  60           HN       MET  60  -4.094   0.355  -4.381
  479    HA   MET  60           HA       MET  60  -4.815   2.673  -2.940
  480   1HB   MET  60          HB2       MET  60  -3.504   2.089  -5.595
  481   2HB   MET  60          HB1       MET  60  -3.670   3.744  -5.020
  482   1HG   MET  60          HG2       MET  60  -2.608   2.937  -2.834
  483   2HG   MET  60          HG1       MET  60  -2.181   1.467  -3.701
  484   1HE   MET  60          HE1       MET  60  -0.946   5.746  -4.577
  485   2HE   MET  60          HE2       MET  60  -1.110   5.135  -2.931
  486   3HE   MET  60          HE3       MET  60  -2.500   5.117  -4.014
  487    H    LYS  61           HN       LYS  61  -6.111   1.367  -5.974
  488    HA   LYS  61           HA       LYS  61  -7.682   3.682  -6.702
  489   1HB   LYS  61          HB2       LYS  61  -7.550   0.757  -7.389
  490   2HB   LYS  61          HB1       LYS  61  -8.905   1.716  -7.984
  491   1HG   LYS  61          HG2       LYS  61  -6.186   2.883  -8.314
  492   2HG   LYS  61          HG1       LYS  61  -6.591   1.508  -9.339
  493   1HD   LYS  61          HD2       LYS  61  -8.869   3.142  -9.397
  494   2HD   LYS  61          HD1       LYS  61  -7.507   4.254  -9.525
  495   1HE   LYS  61          HE2       LYS  61  -6.897   2.025 -11.189
  496   2HE   LYS  61          HE1       LYS  61  -8.564   2.518 -11.556
  497   1HZ   LYS  61          HZ1       LYS  61  -7.080   3.889 -12.820
  498   2HZ   LYS  61          HZ2       LYS  61  -6.171   4.276 -11.437
  499   3HZ   LYS  61          HZ3       LYS  61  -7.765   4.843 -11.597
  500    H    ASN  62           HN       ASN  62  -8.503   0.597  -5.078
  501    HA   ASN  62           HA       ASN  62 -11.249   1.341  -4.521
  502   1HB   ASN  62          HB2       ASN  62  -9.321  -0.715  -3.393
  503   2HB   ASN  62          HB1       ASN  62 -11.038  -0.667  -2.992
  504   1HD2  ASN  62          HD2       ASN  62  -9.726  -2.866  -4.419
  505   2HD2  ASN  62          HD2       ASN  62 -10.426  -2.944  -5.964
  506    H    LEU  63           HN       LEU  63  -8.173   1.908  -2.980
  507    HA   LEU  63           HA       LEU  63  -9.225   2.579  -0.348
  508   1HB   LEU  63          HB2       LEU  63  -6.636   2.669  -1.856
  509   2HB   LEU  63          HB1       LEU  63  -6.761   3.597  -0.360
  510    HG   LEU  63           HG       LEU  63  -7.758   0.786  -0.319
  511   1HD1  LEU  63          HD1       LEU  63  -5.796  -0.131  -0.929
  512   2HD1  LEU  63          HD1       LEU  63  -5.013   0.713   0.407
  513   3HD1  LEU  63          HD1       LEU  63  -5.100   1.469  -1.183
  514   1HD2  LEU  63          HD2       LEU  63  -5.945   1.758   1.774
  515   2HD2  LEU  63          HD2       LEU  63  -7.573   1.097   1.921
  516   3HD2  LEU  63          HD2       LEU  63  -7.344   2.805   1.541
  517    H    ASP  64           HN       ASP  64  -8.483   4.314  -3.323
  518    HA   ASP  64           HA       ASP  64  -8.701   6.974  -2.120
  519   1HB   ASP  64          HB2       ASP  64  -7.846   5.731  -4.552
  520   2HB   ASP  64          HB1       ASP  64  -9.045   6.959  -4.962
  521    H    ALA  65           HN       ALA  65 -10.868   4.668  -3.631
  522    HA   ALA  65           HA       ALA  65 -12.993   6.556  -4.245
  523   1HB   ALA  65          HB1       ALA  65 -13.064   3.556  -3.792
  524   2HB   ALA  65          HB2       ALA  65 -12.593   4.318  -5.311
  525   3HB   ALA  65          HB3       ALA  65 -14.237   4.506  -4.703
  526    H    LYS  66           HN       LYS  66 -12.293   4.355  -1.525
  527    HA   LYS  66           HA       LYS  66 -14.763   5.075  -0.117
  528   1HB   LYS  66          HB2       LYS  66 -13.073   2.935  -0.157
  529   2HB   LYS  66          HB1       LYS  66 -12.521   3.762   1.301
  530   1HG   LYS  66          HG2       LYS  66 -14.257   2.794   2.370
  531   2HG   LYS  66          HG1       LYS  66 -15.306   3.884   1.462
  532   1HD   LYS  66          HD2       LYS  66 -15.556   2.249  -0.315
  533   2HD   LYS  66          HD1       LYS  66 -14.384   1.179   0.453
  534   1HE   LYS  66          HE2       LYS  66 -16.399   1.834   2.389
  535   2HE   LYS  66          HE1       LYS  66 -17.193   1.261   0.909
  536   1HZ   LYS  66          HZ1       LYS  66 -14.930  -0.069   2.306
  537   2HZ   LYS  66          HZ2       LYS  66 -15.623  -0.593   0.845
  538   3HZ   LYS  66          HZ3       LYS  66 -16.536  -0.613   2.277
  539    H    GLN  67           HN       GLN  67 -11.352   5.286   0.920
  540    HA   GLN  67           HA       GLN  67 -11.689   7.133   3.011
  541   1HB   GLN  67          HB2       GLN  67  -9.634   5.801   1.724
  542   2HB   GLN  67          HB1       GLN  67  -9.259   7.493   1.396
  543   1HG   GLN  67          HG2       GLN  67  -8.199   7.171   3.453
  544   2HG   GLN  67          HG1       GLN  67  -9.763   7.814   3.954
  545   1HE2  GLN  67          HE2       GLN  67  -7.639   5.112   4.242
  546   2HE2  GLN  67          HE2       GLN  67  -8.709   4.078   5.058
  547    H    LYS  68           HN       LYS  68 -10.770   7.886  -0.378
  548    HA   LYS  68           HA       LYS  68 -11.364  10.754   0.123
  549   1HB   LYS  68          HB2       LYS  68  -9.744   9.108  -1.715
  550   2HB   LYS  68          HB1       LYS  68 -10.509  10.503  -2.476
  551   1HG   LYS  68          HG2       LYS  68  -9.291  11.063   0.153
  552   2HG   LYS  68          HG1       LYS  68  -8.141  10.606  -1.102
  553   1HD   LYS  68          HD2       LYS  68  -9.942  12.382  -2.343
  554   2HD   LYS  68          HD1       LYS  68  -9.577  13.098  -0.772
  555   1HE   LYS  68          HE2       LYS  68  -7.129  12.782  -1.250
  556   2HE   LYS  68          HE1       LYS  68  -7.567  12.242  -2.884
  557   1HZ   LYS  68          HZ1       LYS  68  -8.543  14.785  -1.714
  558   2HZ   LYS  68          HZ2       LYS  68  -8.627  14.285  -3.334
  559   3HZ   LYS  68          HZ3       LYS  68  -7.131  14.695  -2.646
  560    H    LYS  69           HN       LYS  69 -12.546  11.868  -1.783
  561    HA   LYS  69           HA       LYS  69 -15.024  10.324  -2.357
  562   1HB   LYS  69          HB2       LYS  69 -14.382  12.944  -1.553
  563   2HB   LYS  69          HB1       LYS  69 -14.958  13.099  -3.212
  564   1HG   LYS  69          HG2       LYS  69 -16.985  11.815  -2.629
  565   2HG   LYS  69          HG1       LYS  69 -16.413  11.669  -0.967
  566   1HD   LYS  69          HD2       LYS  69 -17.150  13.738  -0.452
  567   2HD   LYS  69          HD1       LYS  69 -16.350  14.436  -1.861
  568   1HE   LYS  69          HE2       LYS  69 -18.333  14.598  -2.942
  569   2HE   LYS  69          HE1       LYS  69 -18.636  12.866  -2.702
  570   1HZ   LYS  69          HZ1       LYS  69 -19.559  13.235  -0.610
  571   2HZ   LYS  69          HZ2       LYS  69 -20.203  14.499  -1.545
  572   3HZ   LYS  69          HZ3       LYS  69 -18.911  14.798  -0.483
  573    H    ALA  70           HN       ALA  70 -15.783  11.909  -4.632
  574    HA   ALA  70           HA       ALA  70 -13.783  11.833  -6.717
  575   1HB   ALA  70          HB1       ALA  70 -14.480   9.364  -5.945
  576   2HB   ALA  70          HB2       ALA  70 -14.138   9.739  -7.633
  577   3HB   ALA  70          HB3       ALA  70 -15.807   9.662  -7.068
  578    H    SER  71           HN       SER  71 -15.605  11.102  -8.843
  579    HA   SER  71           HA       SER  71 -17.964  12.867  -8.536
  580   1HB   SER  71          HB2       SER  71 -15.817  13.375 -10.614
  581   2HB   SER  71          HB1       SER  71 -17.232  14.371 -10.289
  582    HG   SER  71           HG       SER  71 -16.343  15.050  -8.435
  583    HA   PRO  72           HA       PRO  72 -18.437   9.241 -11.400
  584   1HB   PRO  72          HB2       PRO  72 -20.741   8.291 -10.284
  585   2HB   PRO  72          HB1       PRO  72 -19.125   7.818  -9.725
  586   1HG   PRO  72          HG2       PRO  72 -21.022   9.798  -8.579
  587   2HG   PRO  72          HG1       PRO  72 -19.957   8.647  -7.758
  588   1HD   PRO  72          HD2       PRO  72 -19.393  11.301  -8.003
  589   2HD   PRO  72          HD1       PRO  72 -18.146  10.041  -7.871
  590    H    ARG  73           HN       ARG  73 -20.353  11.946 -10.409
  591    HA   ARG  73           HA       ARG  73 -22.071  11.644 -12.853
  592   1HB   ARG  73          HB2       ARG  73 -22.720  11.919 -10.140
  593   2HB   ARG  73          HB1       ARG  73 -23.001  13.520 -10.826
  594   1HG   ARG  73          HG2       ARG  73 -24.052  11.801 -12.741
  595   2HG   ARG  73          HG1       ARG  73 -24.513  11.048 -11.214
  596   1HD   ARG  73          HD2       ARG  73 -25.462  13.215 -10.443
  597   2HD   ARG  73          HD1       ARG  73 -25.051  13.932 -12.014
  598    HE   ARG  73           HE       ARG  73 -26.562  11.453 -12.273
  599   1HH1  ARG  73          HH1       ARG  73 -28.172  13.343 -10.505
  600   2HH1  ARG  73          HH1       ARG  73 -29.128  14.175 -11.686
  601   1HH2  ARG  73          HH2       ARG  73 -27.165  13.180 -14.363
  602   2HH2  ARG  73          HH2       ARG  73 -28.557  14.082 -13.869