*HEADER    RNA                                     09-JAN-01   1HWQ              
*TITLE     SOLUTION STRUCTURE OF THE VS RIBOZYME SUBSTRATE STEM-LOOP             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VS RIBOZYME SUBSTRATE RNA;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: RNA SAMPLES WERE TRANSCRIBED FROM SYNTHETIC           
*SOURCE   4 DNA TEMPLATES USING T7 RNA POLYMERASE.                               
*KEYWDS    VS RIBOZYME, STEM-LOOP, TANDEM GA, PROTONATED ADENINE, A+C            
*KEYWDS   2 BASE PAIR                                                            
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.C.FLINDERS, T.DIECKMANN                                             
*REVDAT   1   16-MAY-01 1HWQ    0                                                
assi (resi   1 and name   H8) (resi   2 and name   H8)  4.40  4.40  0.80
assi (resi   1 and name  H1') (resi   1 and name   H8)  3.98  3.98  0.80
assi (resi   1 and name  H1') (resi   2 and name   H8)  4.30  4.30  0.80
assi (resi   1 and name  H2') (resi   1 and name   H8)  3.60  3.60  0.80
assi (resi   1 and name  H2') (resi   2 and name   H8)  2.80  2.80  0.80
assi (resi   1 and name  H2') (resi   2 and name  H1')  4.35  4.35  0.80
assi (resi   1 and name  H3') (resi   1 and name   H8)  3.30  3.30  0.80
assi (resi   1 and name  H3') (resi   1 and name  H2')  3.50  3.50  0.80
assi (resi   1 and name  H3') (resi   2 and name   H8)  3.50  3.50  0.80
assi (resi   1 and name  H4') (resi   1 and name   H8)  4.50  4.50  1.00
assi (resi   2 and name   H1) (resi   3 and name   H3)  4.00  4.00  1.00
assi (resi   2 and name   H1) (resi  28 and name   H1)  4.00  4.00  1.00
assi (resi   2 and name   H8) (resi   3 and name   H5)  4.20  4.20  0.80
assi (resi   2 and name   H8) (resi   3 and name   H6)  4.60  4.60  0.80
assi (resi   2 and name  H1') (resi   2 and name   H8)  3.79  3.79  0.80
assi (resi   2 and name  H1') (resi   3 and name   H5)  5.50  5.50  0.80
assi (resi   2 and name  H1') (resi   3 and name   H6)  4.41  4.41  0.80
assi (resi   2 and name  H1') (resi   3 and name  H1')  4.79  4.79  0.80
assi (resi   2 and name  H2') (resi   2 and name   H8)  3.52  3.52  0.80
assi (resi   2 and name  H2') (resi   3 and name   H6)  3.14  3.14  0.80
assi (resi   3 and name   H3) (resi   4 and name   H1)  5.00  5.00  1.00
assi (resi   3 and name   H6) (resi   4 and name   H8)  4.76  4.76  0.80
assi (resi   3 and name  H1') (resi   3 and name   H5)  4.70  4.70  1.00
assi (resi   3 and name  H1') (resi   3 and name   H6)  3.58  3.58  0.80
assi (resi   3 and name  H1') (resi   4 and name   H8)  4.20  4.20  0.80
assi (resi   3 and name  H1') (resi   4 and name  H1')  4.50  4.50  0.80
assi (resi   4 and name   H1) (resi  28 and name   H1)  5.00  5.00  1.00
assi (resi   4 and name   H8) (resi   5 and name   H5)  4.52  4.52  0.80
assi (resi   4 and name   H8) (resi   5 and name   H6)  4.29  4.29  0.80
assi (resi   4 and name  H1') (resi   4 and name   H8)  3.52  3.52  0.80
assi (resi   4 and name  H1') (resi   5 and name   H5)  4.57  4.57  0.80
assi (resi   4 and name  H1') (resi   5 and name   H6)  3.99  3.99  0.80
assi (resi   4 and name  H1') (resi   5 and name  H1')  4.48  4.48  0.80
assi (resi   4 and name  H2') (resi   4 and name   H8)  3.68  3.68  0.80
assi (resi   4 and name  H2') (resi   5 and name   H6)  2.60  2.60  0.80
assi (resi   5 and name   H5) (resi   6 and name   H8)  4.94  4.94  0.80
assi (resi   5 and name   H6) (resi   6 and name   H8)  4.23  4.23  0.80
assi (resi   5 and name  H1') (resi   5 and name   H5)  4.54  4.54  0.80
assi (resi   5 and name  H1') (resi   5 and name   H6)  3.67  3.67  0.80
assi (resi   5 and name  H1') (resi   6 and name   H8)  4.50  4.50  0.80
assi (resi   5 and name  H1') (resi   6 and name  H1')  5.00  5.00  0.80
assi (resi   5 and name  H2') (resi   5 and name   H6)  2.68  2.68  0.80
assi (resi   5 and name  H2') (resi   6 and name   H8)  2.80  2.80  1.00
assi (resi   5 and name  H3') (resi   5 and name   H6)  3.33  3.33  0.80
assi (resi   5 and name  H3') (resi   6 and name   H8)  3.11  3.11  0.80
assi (resi   6 and name   H8) (resi   7 and name   H8)  4.20  4.20  0.80
assi (resi   6 and name  H1') (resi   6 and name   H8)  3.58  3.58  0.80
assi (resi   6 and name  H1') (resi   7 and name   H8)  3.88  3.88  0.80
assi (resi   6 and name  H2') (resi   6 and name   H8)  3.83  3.83  0.80
assi (resi   6 and name  H2') (resi   7 and name   H8)  4.66  4.66  0.80
assi (resi   6 and name  H3') (resi   6 and name   H8)  3.11  3.11  0.80
assi (resi   7 and name   H2) (resi   8 and name   H8)  5.00  5.00  1.00
assi (resi   7 and name   H2) (resi   8 and name  H1')  2.93  2.93  0.80
assi (resi   7 and name   H2) (resi  25 and name   H8)  4.00  4.00  1.00
assi (resi   7 and name   H2) (resi  25 and name  H1')  3.08  3.08  0.80
assi (resi   7 and name   H8) (resi   8 and name   H8)  4.50  4.50  1.00
assi (resi   7 and name  H1') (resi   7 and name   H8)  3.33  3.33  0.80
assi (resi   7 and name  H1') (resi   7 and name  H2')  2.80  2.80  1.00
assi (resi   7 and name  H1') (resi   8 and name   H8)  4.30  4.30  1.00
assi (resi   7 and name  H1') (resi  25 and name   H2)  2.63  2.63  0.80
assi (resi   7 and name  H1') (resi  25 and name  H1')  5.50  5.50  0.80
assi (resi   7 and name  H2') (resi   7 and name   H8)  2.96  2.96  0.80
assi (resi   7 and name  H2') (resi   7 and name  H1')  3.60  3.60  1.00
assi (resi   7 and name  H2') (resi   8 and name   H8)  3.14  3.14  0.80
assi (resi   7 and name  H2') (resi   8 and name  H1')  4.80  4.80  1.00
assi (resi   8 and name   H2) (resi   9 and name   H8)  4.63  4.63  0.80
assi (resi   8 and name   H2) (resi   9 and name  H1')  3.14  3.14  0.80
assi (resi   8 and name   H2) (resi   9 and name  H2')  4.17  4.17  0.80
assi (resi   8 and name   H2) (resi  10 and name   H8)  5.22  5.22  0.80
assi (resi   8 and name   H2) (resi  23 and name  H1')  4.88  4.88  0.80
assi (resi   8 and name   H2) (resi  24 and name  H1')  4.04  4.04  0.80
assi (resi   8 and name   H8) (resi   9 and name   H8)  4.01  4.01  0.80
assi (resi   8 and name  H1') (resi   8 and name   H2)  4.66  4.66  0.80
assi (resi   8 and name  H1') (resi   8 and name   H8)  3.05  3.05  0.80
assi (resi   8 and name  H1') (resi   9 and name   H8)  3.67  3.67  0.80
assi (resi   8 and name  H1') (resi  25 and name  H1')  4.80  4.80  0.80
assi (resi   8 and name  H2') (resi   8 and name   H2)  4.50  4.50  1.00
assi (resi   8 and name  H2') (resi   8 and name   H8)  3.64  3.64  0.80
assi (resi   8 and name  H2') (resi   8 and name  H1')  4.00  4.00  0.80
assi (resi   8 and name  H2') (resi   9 and name   H8)  2.96  2.96  0.80
assi (resi   8 and name  H2') (resi   9 and name  H1')  4.50  4.50  1.00
assi (resi   8 and name  H3') (resi   9 and name   H8)  4.20  4.20  1.00
assi (resi   9 and name   H8) (resi  10 and name   H8)  4.17  4.17  0.80
assi (resi   9 and name  H1') (resi   9 and name   H8)  3.73  3.73  0.80
assi (resi   9 and name  H1') (resi   9 and name  H2')  2.80  2.80  1.00
assi (resi   9 and name  H1') (resi   9 and name  H3')  3.50  3.50  1.00
assi (resi   9 and name  H1') (resi   9 and name  H5')  5.00  5.00  1.00
assi (resi   9 and name  H1') (resi  10 and name   H8)  3.55  3.55  0.80
assi (resi   9 and name  H1') (resi  10 and name  H1')  5.00  5.00  1.00
assi (resi   9 and name  H2') (resi   9 and name   H8)  3.95  3.95  0.80
assi (resi   9 and name  H2') (resi  10 and name   H8)  2.74  2.74  0.80
assi (resi   9 and name  H3') (resi   9 and name   H8)  3.27  3.27  0.80
assi (resi   9 and name  H3') (resi  10 and name   H8)  3.27  3.27  0.80
assi (resi   9 and name  H4') (resi   9 and name   H8)  3.61  3.61  0.80
assi (resi   9 and name  H4') (resi  10 and name   H8)  4.42  4.42  0.80
assi (resi   9 and name  H5') (resi   8 and name  H2')  3.50  3.50  1.00
assi (resi   9 and name  H5') (resi   9 and name   H8)  2.80  2.80  1.00
assi (resi   9 and name  H5') (resi   9 and name  H3')  3.50  3.50  1.00
assi (resi  10 and name   H1) (resi   9 and name   H1)  4.50  5.00  1.00
assi (resi  10 and name   H1) (resi  11 and name   H1)  4.50  5.00  1.00
assi (resi  10 and name   H8) (resi  11 and name   H8)  4.20  4.20  0.80
assi (resi  10 and name  H1') (resi  10 and name   H8)  3.58  3.58  0.80
assi (resi  10 and name  H1') (resi  10 and name  H2')  3.00  3.00  1.00
assi (resi  10 and name  H1') (resi  10 and name  H3')  5.00  5.00  1.00
assi (resi  10 and name  H1') (resi  11 and name   H8)  3.67  3.67  0.80
assi (resi  10 and name  H2') (resi  10 and name   H8)  3.92  3.92  0.80
assi (resi  10 and name  H2') (resi  11 and name   H8)  2.83  2.83  0.80
assi (resi  10 and name  H3') (resi  10 and name   H8)  3.50  3.50  1.00
assi (resi  10 and name  H5') (resi  10 and name   H8)  4.00  4.00  1.00
assi (resi  11 and name   H8) (resi  12 and name   H5)  4.23  4.23  0.80
assi (resi  11 and name   H8) (resi  12 and name   H6)  4.51  4.51  0.80
assi (resi  11 and name  H1') (resi  11 and name   H8)  3.27  3.27  0.80
assi (resi  11 and name  H1') (resi  11 and name  H2')  3.50  3.50  1.00
assi (resi  11 and name  H1') (resi  11 and name  H2')  4.50  4.50  1.00
assi (resi  11 and name  H1') (resi  11 and name  H3')  3.00  3.00  1.00
assi (resi  11 and name  H1') (resi  12 and name   H5)  4.23  4.23  0.80
assi (resi  11 and name  H1') (resi  12 and name   H6)  3.45  3.45  0.80
assi (resi  11 and name  H2') (resi  11 and name   H8)  3.45  3.45  0.80
assi (resi  11 and name  H2') (resi  12 and name   H5)  3.50  3.50  1.00
assi (resi  11 and name  H2') (resi  12 and name   H6)  3.50  3.50  1.00
assi (resi  11 and name  H2') (resi  12 and name  H1')  3.50  3.50  1.00
assi (resi  11 and name  H3') (resi  12 and name   H5)  3.50  3.50  1.00
assi (resi  11 and name  H3') (resi  12 and name   H5)  4.50  4.50  1.00
assi (resi  11 and name  H3') (resi  12 and name   H6)  3.50  3.50  1.00
assi (resi  11 and name  H5') (resi  11 and name   H8)  3.50  3.50  1.00
assi (resi  12 and name   H5) (resi  13 and name   H8)  4.25  4.25  1.00 
assi (resi  12 and name  H1') (resi  12 and name   H5)  4.85  4.85  0.80
assi (resi  12 and name  H1') (resi  13 and name   H8)  4.50  4.50  1.00
assi (resi  12 and name  H2') (resi  13 and name   H8)  3.30  3.30  1.00
assi (resi  12 and name  H41) (resi  11 and name   H1)  5.00  5.00  1.00
assi (resi  12 and name  H41) (resi  19 and name   H1)  3.50  3.50  1.00
assi (resi  13 and name   H1) (resi  19 and name   H1)  3.50  3.50  1.00
assi (resi  13 and name   H8) (resi  14 and name   H5)  3.40  3.40  0.80 
assi (resi  13 and name   H8) (resi  14 and name   H6)  3.50  4.72  0.80
assi (resi  13 and name  H1') (resi  13 and name   H8)  3.33  3.33  0.80
assi (resi  13 and name  H1') (resi  14 and name   H6)  3.79  3.79  0.80
assi (resi  13 and name  H2') (resi  13 and name   H8)  3.14  3.14  0.80
assi (resi  13 and name  H2') (resi  14 and name   H5)  4.30  4.30  1.00
assi (resi  13 and name  H2') (resi  14 and name   H6)  3.39  3.39  0.80
assi (resi  13 and name  H3') (resi  13 and name   H8)  4.30  4.30  1.00
assi (resi  14 and name   H5) (resi  18 and name   H5)  5.00  5.00  1.00
assi (resi  14 and name   H6) (resi  18 and name   H5)  5.50  5.50  0.80
assi (resi  14 and name  H1') (resi  14 and name   H6)  3.58  3.58  0.80
assi (resi  14 and name  H1') (resi  18 and name   H5)  4.85  4.85  0.80
assi (resi  14 and name  H1') (resi  18 and name   H6)  5.50  5.50  0.80
assi (resi  14 and name  H2') (resi  14 and name   H6)  2.77  2.77  0.80
assi (resi  14 and name  H2') (resi  14 and name  H1')  3.40  3.40  0.80
assi (resi  15 and name   H5) (resi  17 and name   H5)  4.40  4.40  1.00
assi (resi  15 and name   H5) (resi  17 and name   H6)  5.50  5.50  0.80
assi (resi  15 and name   H5) (resi  19 and name   H8)  5.00  5.00  1.00
assi (resi  15 and name   H5) (resi  19 and name  H1')  4.42  4.42  1.00
assi (resi  15 and name   H6) (resi  16 and name   H8)  4.60  4.60  1.00
assi (resi  15 and name   H6) (resi  17 and name  H1')  3.95  3.95  0.80
assi (resi  15 and name   H6) (resi  17 and name  H3')  3.52  3.52  0.80
assi (resi  15 and name   H6) (resi  19 and name  H1')  4.72  4.72  0.80
assi (resi  15 and name  H1') (resi  15 and name   H5)  4.38  4.38  0.80
assi (resi  15 and name  H1') (resi  15 and name   H6)  3.48  3.48  0.80
assi (resi  15 and name  H1') (resi  15 and name  H2')  3.50  3.50  1.00
assi (resi  15 and name  H1') (resi  16 and name   H8)  4.40  4.40  1.00
assi (resi  15 and name  H1') (resi  16 and name  H2')  4.80  4.80  1.00
assi (resi  15 and name  H1') (resi  17 and name   H5)  5.50  5.50  1.00
assi (resi  15 and name  H1') (resi  17 and name   H6)  5.22  5.22  0.80
assi (resi  15 and name  H1') (resi  17 and name  H1')  4.20  4.20  0.80
assi (resi  15 and name  H1') (resi  17 and name  H3')  4.70  4.70  1.00
assi (resi  15 and name  H1') (resi  19 and name  H1')  4.70  4.70  1.00
assi (resi  15 and name  H2') (resi  15 and name   H5)  4.00  4.00  1.00
assi (resi  15 and name  H2') (resi  15 and name   H6)  2.65  2.65  0.80
assi (resi  15 and name  H2') (resi  16 and name   H8)  2.87  2.87  0.80
assi (resi  15 and name  H2') (resi  16 and name  H2')  4.40  4.40  1.00
assi (resi  15 and name  H3') (resi  15 and name   H5)  4.40  4.40  1.00
assi (resi  15 and name  H3') (resi  15 and name  H1')  4.60  4.60  1.00
assi (resi  15 and name  H3') (resi  16 and name   H8)  3.50  3.50  1.00
assi (resi  16 and name  H1') (resi  16 and name   H8)  3.52  3.52  0.80
assi (resi  16 and name  H2') (resi  16 and name   H8)  2.96  2.96  0.80
assi (resi  17 and name   H5) (resi  19 and name   H8)  4.80  4.80  1.00
assi (resi  17 and name   H5) (resi  19 and name  H1')  4.40  4.40  1.00
assi (resi  17 and name   H6) (resi  19 and name  H1')  4.48  4.48  0.80
assi (resi  17 and name  H1') (resi  17 and name   H5)  4.40  4.40  1.00
assi (resi  17 and name  H1') (resi  17 and name   H6)  3.14  3.14  0.80
assi (resi  17 and name  H1') (resi  17 and name  H2')  3.50  3.50  1.00
assi (resi  17 and name  H1') (resi  17 and name  H3')  4.40  4.40  1.00
assi (resi  17 and name  H1') (resi  17 and name  H4')  4.50  4.50  1.00
assi (resi  17 and name  H1') (resi  19 and name   H8)  5.50  5.50  0.80
assi (resi  17 and name  H1') (resi  19 and name  H1')  5.00  5.00  1.00
assi (resi  17 and name  H1') (resi  19 and name  H1')  5.50  5.50  0.80
assi (resi  17 and name  H2') (resi  17 and name   H5)  3.50  3.50  1.00
assi (resi  17 and name  H2') (resi  17 and name   H6)  2.52  2.52  0.80
assi (resi  17 and name  H3') (resi  15 and name   H5)  4.70  4.70  1.00
assi (resi  17 and name  H3') (resi  17 and name   H6)  3.08  3.08  0.80
assi (resi  17 and name  H3') (resi  17 and name  H2')  3.60  3.60  1.00
assi (resi  17 and name  H4') (resi  15 and name   H6)  3.50  3.50  1.00
assi (resi  17 and name  H4') (resi  17 and name   H6)  4.11  4.11  0.80
assi (resi  17 and name  H5#) (resi  14 and name   H6)  3.50  3.50  2.00
assi (resi  17 and name  H5#) (resi  15 and name   H5)  5.00  5.00  2.00
assi (resi  17 and name  H5#) (resi  15 and name   H6)  3.50  3.50  2.00
assi (resi  17 and name  H5#) (resi  17 and name   H6)  3.70  3.70  2.00
assi (resi  17 and name  H5#) (resi  17 and name  H1')  4.70  4.70  2.00
assi (resi  17 and name  H5#) (resi  19 and name  H1')  4.80  4.80  2.00
assi (resi  18 and name  H1') (resi  18 and name  H3')  3.50  3.50  1.00
assi (resi  18 and name  H2') (resi  18 and name   H5)  3.39  3.39  0.80
assi (resi  18 and name  H2') (resi  18 and name   H6)  2.59  2.59  0.80
assi (resi  18 and name  H2') (resi  18 and name  H1')  2.90  2.90  0.80
assi (resi  18 and name  H3') (resi  17 and name  H3')  4.00  4.00  1.00
assi (resi  18 and name  H3') (resi  18 and name   H6)  4.60  4.60  1.00
assi (resi  18 and name  H3') (resi  19 and name   H8)  3.50  3.50  1.00
assi (resi  18 and name  H4') (resi  18 and name   H5)  6.00  6.00  1.00
assi (resi  18 and name  H4') (resi  18 and name   H6)  4.20  4.20  1.00
assi (resi  18 and name  H4') (resi  18 and name  H1')  4.30  4.30  1.00
assi (resi  18 and name  H4') (resi  18 and name  H2')  4.20  4.20  1.00
assi (resi  18 and name  H4') (resi  18 and name  H3')  4.00  4.00  1.00
assi (resi  18 and name  H4') (resi  18 and name  H5')  3.20  3.20  1.00
assi (resi  18 and name  H4') (resi  19 and name   H8)  4.20  4.20  1.00
assi (resi  19 and name   H1) (resi  11 and name   H1)  4.50  4.50  1.00
assi (resi  19 and name  H1') (resi  19 and name   H8)  3.17  3.17  0.80
assi (resi  19 and name  H2') (resi  17 and name   H6)  4.40  4.40  1.00
assi (resi  19 and name  H2') (resi  19 and name   H8)  3.14  3.14  0.80
assi (resi  19 and name  H2') (resi  19 and name  H1')  2.99  2.99  0.80
assi (resi  19 and name  H4') (resi  18 and name   H6)  4.00  4.00  1.00
assi (resi  19 and name  H4') (resi  18 and name  H1')  4.30  4.30  1.00
assi (resi  19 and name  H4') (resi  18 and name  H2')  4.20  4.20  1.00
assi (resi  19 and name  H4') (resi  18 and name  H3')  4.00  4.00  1.00
assi (resi  19 and name  H4') (resi  19 and name   H8)  4.40  4.40  1.00
assi (resi  20 and name   H5) (resi  21 and name   H5)  4.00  4.00  1.00
assi (resi  20 and name   H5) (resi  21 and name   H6)  4.00  4.00  1.00
assi (resi  20 and name   H6) (resi  21 and name   H5)  4.00  4.00  1.00
assi (resi  20 and name  H1') (resi  20 and name  H2')  2.80  2.80  1.00
assi (resi  20 and name  H1') (resi  21 and name   H5)  4.76  4.76  0.80
assi (resi  20 and name  H1') (resi  21 and name   H6)  4.30  4.30  0.80
assi (resi  20 and name  H2') (resi  20 and name   H5)  4.60  4.60  1.00
assi (resi  20 and name  H2') (resi  20 and name   H6)  3.27  3.27  0.80
assi (resi  20 and name  H2') (resi  20 and name  H3')  3.50  3.50  1.00
assi (resi  20 and name  H3') (resi  20 and name   H5)  3.80  3.80  1.00 
assi (resi  20 and name  H3') (resi  20 and name   H6)  3.80  3.80  1.00
assi (resi  20 and name  H3') (resi  20 and name  H2')  3.80  3.80  1.00
assi (resi  20 and name  H41) (resi  11 and name   H1)  2.80  2.80  1.00
assi (resi  20 and name  H41) (resi  12 and name  H41)  4.00  4.00  1.00
assi (resi  20 and name  H41) (resi  20 and name  H42)  2.80  2.80  1.00
assi (resi  20 and name  H42) (resi  10 and name   H1)  4.00  4.00  1.00
assi (resi  20 and name  H42) (resi  11 and name   H1)  3.50  3.50  1.00
assi (resi  20 and name  H42) (resi  19 and name   H1)  4.00  4.00  1.00
assi (resi  21 and name   H6) (resi  22 and name   H5)  4.54  4.54  0.80
assi (resi  22 and name   H5) (resi  23 and name   H5)  4.00  4.00  1.00
assi (resi  22 and name   H6) (resi  23 and name   H5)  3.76  3.76  0.80
assi (resi  22 and name  H1') (resi  22 and name  H2')  3.00  3.00  1.00
assi (resi  22 and name  H1') (resi  23 and name   H5)  5.00  5.00  1.00
assi (resi  22 and name  H1') (resi  23 and name   H6)  3.73  3.73  0.80
assi (resi  22 and name  H2') (resi  22 and name   H5)  3.70  3.70  1.00
assi (resi  22 and name  H2') (resi  22 and name   H6) 3.50  3.50  1.00
assi (resi  22 and name  H2') (resi  23 and name   H5)  4.00  4.00  1.00
assi (resi  22 and name  H2') (resi  23 and name   H6)  3.90  3.90  1.00
assi (resi  23 and name   H5) (resi  24 and name   H8)  5.31  5.31  0.80
assi (resi  23 and name   H6) (resi  24 and name   H8)  4.20  4.20  0.80
assi (resi  23 and name  H1') (resi  23 and name  H2')  2.80  2.80  1.00
assi (resi  23 and name  H1') (resi  24 and name   H8)  4.17  4.17  0.80
assi (resi  23 and name  H2') (resi  23 and name   H6)  3.50  3.50  1.00
assi (resi  23 and name  H2') (resi  23 and name  H3')  3.50  3.50  1.00
assi (resi  23 and name  H2') (resi  24 and name   H8)  2.80  2.80  1.00
assi (resi  23 and name  H2') (resi  24 and name  H2')  3.50  3.50  1.00
assi (resi  23 and name  H3') (resi  23 and name   H6)  3.80  3.80  1.00
assi (resi  24 and name   H1) (resi   6 and name   H1)  5.00  5.00  1.00
assi (resi  24 and name   H1) (resi   7 and name   H8)  5.00  5.00  1.00
assi (resi  24 and name   H1) (resi  24 and name  H21)  5.00  5.00  1.00
assi (resi  24 and name   H1) (resi  24 and name  H22)  5.00  5.00  1.00
assi (resi  24 and name  H1') (resi  24 and name   H8)  3.58  3.58  0.80
assi (resi  24 and name  H1') (resi  24 and name  H2')  3.30  3.30  1.00
assi (resi  24 and name  H1') (resi  24 and name  H3')  4.20  4.20  1.00
assi (resi  24 and name  H1') (resi  25 and name   H8)  3.90  3.90  1.00
assi (resi  24 and name  H2') (resi  23 and name  H2')  5.00  5.00  1.00
assi (resi  24 and name  H2') (resi  24 and name   H8)  2.80  2.80  0.80
assi (resi  24 and name  H2') (resi  24 and name  H3')  3.50  3.50  1.00
assi (resi  24 and name  H2') (resi  25 and name   H8)  3.95  3.95  0.80
assi (resi  24 and name  H3') (resi  23 and name  H2')  5.00  5.00  1.00
assi (resi  24 and name  H3') (resi  24 and name   H8)  3.50  3.50  1.00
assi (resi  24 and name  H3') (resi  24 and name   H8)  3.60  3.60  1.00
assi (resi  24 and name  H3') (resi  24 and name  H1')  5.00  5.00  1.00
assi (resi  25 and name   H2) (resi  26 and name   H8)  5.07  5.07  0.80
assi (resi  25 and name   H2) (resi  26 and name  H1')  3.17  3.17  0.80
assi (resi  25 and name   H2) (resi  26 and name  H2')  3.79  3.79  0.80
assi (resi  25 and name   H8) (resi  26 and name   H1)  5.00  2.96  1.00
assi (resi  25 and name   H8) (resi  26 and name   H8)  4.00  4.00  1.00
assi (resi  25 and name  H1') (resi  25 and name   H2)  4.97  4.97  0.80
assi (resi  25 and name  H1') (resi  26 and name   H8)  4.50  4.50  1.00
assi (resi  25 and name  H2') (resi  25 and name   H8)  4.80  4.80  1.00
assi (resi  25 and name  H2') (resi  25 and name  H1')  3.60  3.60  1.00
assi (resi  25 and name  H2') (resi  26 and name   H8)  3.70  3.70  1.00
assi (resi  25 and name  H2') (resi  26 and name  H1')  4.50  4.50  1.00
assi (resi  25 and name  H2') (resi  26 and name  H2')  4.50  4.50  1.00
assi (resi  25 and name  H2') (resi  26 and name  H3')  4.20  4.20  1.00
assi (resi  25 and name  H3') (resi  26 and name   H8)  4.50  4.50  1.00
assi (resi  26 and name   H1) (resi   6 and name   H1)  5.00  5.00  1.00
assi (resi  26 and name   H1) (resi   6 and name  H22)  5.00  2.96  1.00
assi (resi  26 and name  H1') (resi  26 and name   H8)  4.40  4.40  1.00
assi (resi  26 and name  H1') (resi  27 and name   H6)  3.79  3.79  0.80
assi (resi  26 and name  H2') (resi  26 and name   H8)  4.00  4.00  1.00
assi (resi  26 and name  H2') (resi  27 and name   H5)  3.45  3.45  0.80
assi (resi  26 and name  H2') (resi  27 and name   H6)  2.99  2.99  0.80
assi (resi  26 and name  H3') (resi  26 and name   H8)  4.00  4.00  1.00
assi (resi  26 and name  H3') (resi  27 and name   H5)  4.00  4.00  1.00
assi (resi  26 and name  H3') (resi  27 and name   H6)  4.30  4.30  1.00
assi (resi  27 and name   H5) (resi  27 and name  H1')  4.80  4.80  1.00
assi (resi  27 and name   H5) (resi  28 and name   H8)  5.00  5.00  1.00
assi (resi  27 and name   H6) (resi  28 and name   H8)  4.69  4.69  0.80
assi (resi  27 and name  H1') (resi  26 and name  H2')  4.50  4.50  1.00
assi (resi  27 and name  H1') (resi  28 and name   H8)  4.18  4.18  0.80
assi (resi  27 and name  H2') (resi  27 and name   H5)  4.00  4.00  1.00
assi (resi  27 and name  H2') (resi  27 and name   H6)  3.50  3.50  1.00
assi (resi  27 and name  H2') (resi  27 and name  H1')  4.20  4.20  1.00
assi (resi  27 and name  H2') (resi  28 and name   H8)  3.30  3.30  1.00
assi (resi  28 and name   H1) (resi   3 and name   H3)  2.00  2.00  1.00
assi (resi  28 and name   H8) (resi  28 and name  H1')  3.45  3.45  0.80
assi (resi  28 and name   H8) (resi  29 and name   H5)  4.11  4.11  0.80
assi (resi  28 and name   H8) (resi  29 and name   H6)  4.30  4.30  1.00
assi (resi  28 and name  H1') (resi  28 and name  H2')  3.50  3.50  1.00
assi (resi  28 and name  H1') (resi  28 and name  H3')  4.00  4.00  1.00
assi (resi  28 and name  H1') (resi  29 and name   H5)  3.50  3.50  1.00
assi (resi  28 and name  H1') (resi  29 and name   H5)  4.40  4.40  1.00
assi (resi  28 and name  H1') (resi  29 and name   H6)  4.40  4.40  1.00
assi (resi  28 and name  H2') (resi  28 and name   H8)  3.30  3.30  1.00
assi (resi  28 and name  H2') (resi  28 and name  H3')  3.50  3.50  1.00
assi (resi  28 and name  H2') (resi  29 and name   H6)  3.70  3.70  1.00
assi (resi  28 and name  H3') (resi  28 and name   H8)  4.30  4.30  1.00
assi (resi  28 and name  H3') (resi  29 and name   H6)  4.30  4.30  1.00
assi (resi  29 and name  H1') (resi  29 and name   H6)  4.30  4.30  1.00
assi (resi  29 and name  H1') (resi  30 and name   H6)  4.50  4.50  1.00
assi (resi  29 and name  H41) (resi   2 and name   H1)  2.80  2.80  1.00
assi (resi  29 and name  H41) (resi   3 and name   H3)  3.50  3.50  1.00
assi (resi  29 and name  H41) (resi  28 and name   H1)  5.00  5.00  1.00
assi (resi  29 and name  H41) (resi  29 and name  H42)  2.80  2.80  1.00
assi (resi  29 and name  H42) (resi   2 and name   H1)  2.80  2.80  1.00
assi (resi  29 and name  H42) (resi   3 and name   H3)  3.50  3.50  1.00
assi (resi  29 and name  H42) (resi  28 and name   H1)  5.00  5.00  1.00
assi (resi  30 and name  H1') (resi  30 and name   H5)  4.85  4.85  0.80
assi (resi  30 and name  H1') (resi  30 and name   H6)  3.81  3.81  0.80
assi (resi  30 and name  H2') (resi  30 and name   H5)  3.50  3.50  1.00
assi (resi  30 and name  H2') (resi  30 and name   H6)  2.68  2.68  0.80

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  -5.145 -19.018   1.273
    2   2H5*    G   1          2H5*        G   1  -5.885 -17.582   2.003
    3    H4*    G   1           H4*        G   1  -5.852 -19.152   3.708
    4    H3*    G   1           H3*        G   1  -3.613 -17.187   4.043
    5    H2*    G   1           H2*        G   1  -2.870 -18.381   6.002
    6   2HO*    G   1          2HO*        G   1  -5.451 -19.134   6.042
    7    H1*    G   1           H1*        G   1  -3.048 -20.909   4.865
    8    H8     G   1           H8         G   1  -2.032 -17.948   2.626
    9    H1     G   1           H1         G   1   2.726 -21.467   5.071
   10   1H2     G   1          1H2         G   1   2.128 -22.806   6.294
   11   2H2     G   1          2H2         G   1   0.601 -23.221   6.870
   12    H5T    G   1           H5T        G   1  -3.209 -18.059   1.284
   13   1H5*    G   2          1H5*        G   2  -5.047 -17.967   7.579
   14   2H5*    G   2          2H5*        G   2  -5.578 -16.555   8.514
   15    H4*    G   2           H4*        G   2  -4.219 -17.761   9.968
   16    H3*    G   2           H3*        G   2  -2.721 -15.430   8.806
   17    H2*    G   2           H2*        G   2  -0.784 -16.083  10.071
   18   2HO*    G   2          2HO*        G   2  -1.037 -17.102  11.912
   19    H1*    G   2           H1*        G   2  -1.013 -18.820   9.516
   20    H8     G   2           H8         G   2  -1.873 -16.374   6.695
   21    H1     G   2           H1         G   2   4.198 -18.402   6.948
   22   1H2     G   2          1H2         G   2   4.586 -19.428   8.499
   23   2H2     G   2          2H2         G   2   3.649 -19.923   9.808
   24   1H5*    U   3          1H5*        U   3  -1.800 -15.615  12.580
   25   2H5*    U   3          2H5*        U   3  -2.078 -14.124  13.502
   26    H4*    U   3           H4*        U   3   0.102 -14.738  14.013
   27    H3*    U   3           H3*        U   3   0.020 -12.521  12.011
   28    H2*    U   3           H2*        U   3   2.405 -12.551  11.808
   29   2HO*    U   3          2HO*        U   3   3.433 -12.968  13.611
   30    H1*    U   3           H1*        U   3   2.674 -15.323  11.704
   31    H3     U   3           H3         U   3   3.349 -14.410   7.347
   32    H5     U   3           H5         U   3  -0.724 -13.623   7.901
   33    H6     U   3           H6         U   3  -0.409 -13.976  10.259
   34   1H5*    G   4          1H5*        G   4   2.942 -11.757  14.725
   35   2H5*    G   4          2H5*        G   4   2.895 -10.096  15.348
   36    H4*    G   4           H4*        G   4   5.099 -10.508  14.608
   37    H3*    G   4           H3*        G   4   3.572  -8.672  12.793
   38    H2*    G   4           H2*        G   4   5.425  -8.600  11.280
   39   2HO*    G   4          2HO*        G   4   7.095  -8.315  12.744
   40    H1*    G   4           H1*        G   4   6.182 -11.307  11.576
   41    H8     G   4           H8         G   4   2.447 -10.712  11.106
   42    H1     G   4           H1         G   4   5.909 -11.762   5.820
   43   1H2     G   4          1H2         G   4   7.788 -11.671   6.120
   44   2H2     G   4          2H2         G   4   8.704 -11.383   7.505
   45   1H5*    C   5          1H5*        C   5   4.893  -5.069  11.361
   46   2H5*    C   5          2H5*        C   5   4.856  -6.835  11.229
   47    H4*    C   5           H4*        C   5   7.550  -5.697  11.399
   48    H3*    C   5           H3*        C   5   5.714  -4.606   9.351
   49    H2*    C   5           H2*        C   5   7.061  -5.230   7.517
   50   2HO*    C   5          2HO*        C   5   9.272  -5.856   7.832
   51    H1*    C   5           H1*        C   5   8.030  -7.674   8.443
   52   1H4     C   5          1H4         C   5   3.159  -9.332   4.831
   53   2H4     C   5          2H4         C   5   2.002  -9.271   6.013
   54    H5     C   5           H5         C   5   2.813  -8.344   8.367
   55    H6     C   5           H6         C   5   4.691  -7.324   9.531
   56   1H5*    G   6          1H5*        G   6   8.954  -3.864   7.336
   57   2H5*    G   6          2H5*        G   6   8.838  -2.207   6.710
   58    H4*    G   6           H4*        G   6   8.745  -3.958   4.964
   59    H3*    G   6           H3*        G   6   6.510  -1.986   5.283
   60    H2*    G   6           H2*        G   6   5.283  -3.032   3.518
   61   2HO*    G   6          2HO*        G   6   7.353  -3.454   2.297
   62    H1*    G   6           H1*        G   6   5.725  -5.644   4.356
   63    H8     G   6           H8         G   6   5.434  -3.313   7.279
   64    H1     G   6           H1         G   6  -0.198  -5.361   5.022
   65   1H2     G   6          1H2         G   6   0.075  -6.320   3.057
   66   2H2     G   6          2H2         G   6   1.655  -6.483   2.337
   67   1H5*    A   7          1H5*        A   7   9.385   0.560   1.441
   68   2H5*    A   7          2H5*        A   7   8.077  -0.196   2.372
   69    H4*    A   7           H4*        A   7   9.377  -1.450  -0.041
   70    H3*    A   7           H3*        A   7   6.984   0.373   0.064
   71    H2*    A   7           H2*        A   7   5.893  -1.015  -1.532
   72   2HO*    A   7          2HO*        A   7   7.757  -1.174  -2.918
   73    H1*    A   7           H1*        A   7   6.987  -3.479  -0.573
   74    H8     A   7           H8         A   7   5.483  -1.641   2.303
   75   1H6     A   7          1H6         A   7   0.024  -3.950   0.493
   76   2H6     A   7          2H6         A   7   0.866  -3.102   1.771
   77    H2     A   7           H2         A   7   2.995  -4.713  -2.757
   78   1H5*    A   8          1H5*        A   8   5.708   1.897  -4.468
   79   2H5*    A   8          2H5*        A   8   5.111   1.489  -2.847
   80    H4*    A   8           H4*        A   8   5.580  -0.571  -4.987
   81    H3*    A   8           H3*        A   8   3.163   1.160  -4.641
   82    H2*    A   8           H2*        A   8   1.720  -0.749  -4.884
   83   2HO*    A   8          2HO*        A   8   3.953  -2.429  -5.335
   84    H1*    A   8           H1*        A   8   3.201  -2.472  -3.276
   85    H8     A   8           H8         A   8   3.715   0.321  -1.178
   86   1H6     A   8          1H6         A   8  -2.232   0.084   0.534
   87   2H6     A   8          2H6         A   8  -0.756   0.792   1.081
   88    H2     A   8           H2         A   8  -1.843  -2.241  -3.117
   89   1H5*    G   9          1H5*        G   9   1.870  -1.403  -7.083
   90   2H5*    G   9          2H5*        G   9   1.374  -0.686  -8.629
   91    H4*    G   9           H4*        G   9  -0.435  -1.982  -7.857
   92    H3*    G   9           H3*        G   9  -0.856   0.967  -7.666
   93    H2*    G   9           H2*        G   9  -2.964   0.662  -6.553
   94   2HO*    G   9          2HO*        G   9  -2.982  -1.557  -7.973
   95    H1*    G   9           H1*        G   9  -2.141  -1.352  -4.825
   96    H8     G   9           H8         G   9   0.832   0.822  -5.079
   97    H1     G   9           H1         G   9  -3.684   3.132  -1.181
   98   1H2     G   9          1H2         G   9  -5.384   2.279  -1.385
   99   2H2     G   9          2H2         G   9  -5.928   1.042  -2.382
  100   1H5*    G  10          1H5*        G  10  -4.384  -0.102  -9.782
  101   2H5*    G  10          2H5*        G  10  -4.986   1.341 -10.621
  102    H4*    G  10           H4*        G  10  -6.350   0.567  -8.675
  103    H3*    G  10           H3*        G  10  -5.307   3.400  -8.671
  104    H2*    G  10           H2*        G  10  -6.684   3.707  -6.690
  105   2HO*    G  10          2HO*        G  10  -8.180   1.906  -7.743
  106    H1*    G  10           H1*        G  10  -5.775   1.347  -5.498
  107    H8     G  10           H8         G  10  -2.692   2.368  -7.037
  108    H1     G  10           H1         G  10  -4.356   6.348  -2.305
  109   1H2     G  10          1H2         G  10  -6.176   6.176  -1.772
  110   2H2     G  10          2H2         G  10  -7.427   5.173  -2.280
  111   1H5*    G  11          1H5*        G  11  -9.500   3.626  -8.422
  112   2H5*    G  11          2H5*        G  11 -10.134   4.840  -9.549
  113    H4*    G  11           H4*        G  11 -11.086   5.233  -7.406
  114    H3*    G  11           H3*        G  11  -9.082   7.323  -8.194
  115    H2*    G  11           H2*        G  11  -9.374   8.397  -6.069
  116   2HO*    G  11          2HO*        G  11 -11.170   8.146  -4.935
  117    H1*    G  11           H1*        G  11  -9.267   6.079  -4.560
  118    H8     G  11           H8         G  11  -6.797   5.346  -7.185
  119    H1     G  11           H1         G  11  -4.846   9.746  -2.979
  120   1H2     G  11          1H2         G  11  -6.311  10.497  -1.947
  121   2H2     G  11          2H2         G  11  -7.963  10.158  -1.944
  122   1H5*    C  12          1H5*        C  12 -12.129   9.078  -6.329
  123   2H5*    C  12          2H5*        C  12 -12.886  10.402  -7.232
  124    H4*    C  12           H4*        C  12 -12.563  11.142  -5.015
  125    H3*    C  12           H3*        C  12 -10.616  12.446  -6.902
  126    H2*    C  12           H2*        C  12  -9.722  13.666  -5.023
  127   2HO*    C  12          2HO*        C  12 -12.216  13.055  -4.013
  128    H1*    C  12           H1*        C  12  -9.750  11.487  -3.248
  129   1H4     C  12          1H4         C  12  -3.871  11.582  -5.450
  130   2H4     C  12          2H4         C  12  -4.081  10.458  -6.679
  131    H5     C  12           H5         C  12  -6.610   9.701  -7.057
  132    H6     C  12           H6         C  12  -8.897  10.010  -6.292
  133   1H5*    G  13          1H5*        G  13  -9.707  14.828  -6.534
  134   2H5*    G  13          2H5*        G  13 -10.008  15.682  -5.009
  135    H4*    G  13           H4*        G  13 -10.179  17.799  -6.375
  136    H3*    G  13           H3*        G  13  -9.687  15.976  -8.590
  137    H2*    G  13           H2*        G  13  -7.597  16.755  -9.302
  138   2HO*    G  13          2HO*        G  13  -8.287  19.139  -7.914
  139    H1*    G  13           H1*        G  13  -6.392  17.431  -6.968
  140    H8     G  13           H8         G  13  -7.792  14.739  -5.468
  141    H1     G  13           H1         G  13  -4.435  12.518 -10.374
  142   1H2     G  13          1H2         G  13  -4.035  14.185 -11.858
  143   2H2     G  13          2H2         G  13  -4.595  15.819 -11.568
  144   1H5*    U  14          1H5*        U  14  -9.593  20.119  -5.191
  145   2H5*    U  14          2H5*        U  14 -10.445  21.201  -6.309
  146    H4*    U  14           H4*        U  14  -8.717  22.552  -6.260
  147    H3*    U  14           H3*        U  14  -7.924  20.902  -8.234
  148    H2*    U  14           H2*        U  14  -6.601  19.367  -6.985
  149   2HO*    U  14          2HO*        U  14  -5.126  20.704  -8.324
  150    H1*    U  14           H1*        U  14  -5.552  21.582  -5.162
  151    H3     U  14           H3         U  14  -5.927  18.719  -1.399
  152    H5     U  14           H5         U  14  -4.525  16.625  -4.753
  153    H6     U  14           H6         U  14  -5.274  18.423  -6.110
  154   1H5*    C  15          1H5*        C  15  -4.784  21.657 -11.428
  155   2H5*    C  15          2H5*        C  15  -4.865  19.923 -11.064
  156    H4*    C  15           H4*        C  15  -3.050  22.018  -9.921
  157    H3*    C  15           H3*        C  15  -2.527  19.366 -11.276
  158    H2*    C  15           H2*        C  15  -0.467  19.274 -10.032
  159   2HO*    C  15          2HO*        C  15  -0.780  21.928 -10.011
  160    H1*    C  15           H1*        C  15  -1.685  19.951  -7.617
  161   1H4     C  15          1H4         C  15  -3.592  13.776  -8.630
  162   2H4     C  15          2H4         C  15  -1.965  13.587  -8.011
  163    H5     C  15           H5         C  15  -0.505  15.475  -7.627
  164    H6     C  15           H6         C  15  -0.284  17.876  -7.764
  165   1H5*    G  16          1H5*        G  16   1.723  22.011 -14.508
  166   2H5*    G  16          2H5*        G  16   1.242  20.309 -14.649
  167    H4*    G  16           H4*        G  16   3.459  20.197 -14.017
  168    H3*    G  16           H3*        G  16   1.672  19.741 -11.668
  169    H2*    G  16           H2*        G  16   3.528  19.733 -10.161
  170   2HO*    G  16          2HO*        G  16   4.752  18.647 -12.184
  171    H1*    G  16           H1*        G  16   4.979  21.814 -11.366
  172    H8     G  16           H8         G  16   1.151  22.009 -10.937
  173    H1     G  16           H1         G  16   4.651  25.086  -6.529
  174   1H2     G  16          1H2         G  16   6.798  24.683  -6.839
  175   2H2     G  16          2H2         G  16   7.363  23.651  -8.133
  176   1H5*    U  17          1H5*        U  17   2.120  15.837  -9.303
  177   2H5*    U  17          2H5*        U  17   0.671  16.841  -9.137
  178    H4*    U  17           H4*        U  17   3.356  17.493  -7.970
  179    H3*    U  17           H3*        U  17   1.686  15.538  -6.928
  180    H2*    U  17           H2*        U  17   0.010  16.927  -6.066
  181   2HO*    U  17          2HO*        U  17   0.458  17.159  -3.966
  182    H1*    U  17           H1*        U  17   2.035  19.203  -5.692
  183    H3     U  17           H3         U  17  -1.097  22.520  -6.721
  184    H5     U  17           H5         U  17  -3.066  19.281  -4.894
  185    H6     U  17           H6         U  17  -1.065  17.982  -5.246
  186   1H5*    C  18          1H5*        C  18   3.503  18.485  -6.265
  187   2H5*    C  18          2H5*        C  18   4.915  19.531  -6.443
  188    H4*    C  18           H4*        C  18   5.490  18.715  -4.074
  189    H3*    C  18           H3*        C  18   3.203  17.231  -4.109
  190    H2*    C  18           H2*        C  18   1.624  18.973  -3.938
  191   2HO*    C  18          2HO*        C  18   2.497  19.602  -1.367
  192    H1*    C  18           H1*        C  18   3.564  20.733  -2.363
  193   1H4     C  18          1H4         C  18  -0.128  25.187  -5.160
  194   2H4     C  18          2H4         C  18  -1.471  24.123  -4.795
  195    H5     C  18           H5         C  18  -1.143  21.845  -3.971
  196    H6     C  18           H6         C  18   0.476  20.223  -3.286
  197   1H5*    G  19          1H5*        G  19   2.686  17.944  -1.125
  198   2H5*    G  19          2H5*        G  19   2.509  17.289   0.511
  199    H4*    G  19           H4*        G  19   0.371  17.900  -0.370
  200    H3*    G  19           H3*        G  19   0.794  15.010   0.122
  201    H2*    G  19           H2*        G  19  -0.976  14.347  -1.205
  202   2HO*    G  19          2HO*        G  19  -2.113  16.358   0.281
  203    H1*    G  19           H1*        G  19  -1.445  17.085  -2.407
  204    H8     G  19           H8         G  19   1.218  15.350  -4.152
  205    H1     G  19           H1         G  19  -4.551  12.933  -5.602
  206   1H2     G  19          1H2         G  19  -5.938  13.542  -4.309
  207   2H2     G  19          2H2         G  19  -5.883  14.611  -2.992
  208   1H5*    C  20          1H5*        C  20  -2.952  16.534   1.910
  209   2H5*    C  20          2H5*        C  20  -3.073  15.897   3.559
  210    H4*    C  20           H4*        C  20  -5.190  15.612   2.691
  211    H3*    C  20           H3*        C  20  -3.762  12.968   2.413
  212    H2*    C  20           H2*        C  20  -5.852  12.096   1.568
  213   2HO*    C  20          2HO*        C  20  -6.864  14.020   3.083
  214    H1*    C  20           H1*        C  20  -6.335  14.319  -0.091
  215   1H4     C  20          1H4         C  20  -3.666   9.972  -3.755
  216   2H4     C  20          2H4         C  20  -2.093  10.478  -3.585
  217    H5     C  20           H5         C  20  -1.708  12.400  -1.779
  218    H6     C  20           H6         C  20  -2.841  13.879  -0.201
  219   1H5*    C  21          1H5*        C  21  -7.300  12.195   3.615
  220   2H5*    C  21          2H5*        C  21  -7.429  11.155   5.045
  221    H4*    C  21           H4*        C  21  -8.859  10.281   3.362
  222    H3*    C  21           H3*        C  21  -6.399   8.567   3.701
  223    H2*    C  21           H2*        C  21  -7.328   7.083   2.059
  224   2HO*    C  21          2HO*        C  21  -9.603   7.932   3.089
  225    H1*    C  21           H1*        C  21  -8.359   9.174   0.421
  226   1H4     C  21          1H4         C  21  -3.135   7.055  -2.415
  227   2H4     C  21          2H4         C  21  -2.097   8.175  -1.780
  228    H5     C  21           H5         C  21  -3.130   9.767   0.086
  229    H6     C  21           H6         C  21  -5.165  10.295   1.321
  230   1H5*    C  22          1H5*        C  22  -9.918   6.207   4.028
  231   2H5*    C  22          2H5*        C  22  -9.768   5.017   5.335
  232    H4*    C  22           H4*        C  22 -10.510   3.901   3.362
  233    H3*    C  22           H3*        C  22  -7.649   3.283   4.062
  234    H2*    C  22           H2*        C  22  -7.561   1.781   2.219
  235   2HO*    C  22          2HO*        C  22  -9.602   0.782   2.274
  236    H1*    C  22           H1*        C  22  -8.938   3.473   0.460
  237   1H4     C  22          1H4         C  22  -2.770   4.050  -0.602
  238   2H4     C  22          2H4         C  22  -2.427   5.159   0.579
  239    H5     C  22           H5         C  22  -4.456   5.727   2.214
  240    H6     C  22           H6         C  22  -6.805   5.322   2.650
  241   1H5*    C  23          1H5*        C  23  -8.830  -1.424   4.418
  242   2H5*    C  23          2H5*        C  23  -8.000   0.127   4.194
  243    H4*    C  23           H4*        C  23  -8.840  -1.574   1.867
  244    H3*    C  23           H3*        C  23  -6.487  -2.078   3.622
  245    H2*    C  23           H2*        C  23  -4.988  -2.201   1.762
  246   2HO*    C  23          2HO*        C  23  -5.697  -2.564  -0.292
  247    H1*    C  23           H1*        C  23  -6.049  -0.098   0.268
  248   1H4     C  23          1H4         C  23  -1.278   2.424   3.629
  249   2H4     C  23          2H4         C  23  -2.433   2.991   4.816
  250    H5     C  23           H5         C  23  -4.789   2.381   4.735
  251    H6     C  23           H6         C  23  -6.470   1.094   3.531
  252   1H5*    G  24          1H5*        G  24  -6.086  -4.477   0.369
  253   2H5*    G  24          2H5*        G  24  -5.471  -6.089   0.779
  254    H4*    G  24           H4*        G  24  -4.121  -4.524  -0.787
  255    H3*    G  24           H3*        G  24  -3.318  -6.739   0.455
  256    H2*    G  24           H2*        G  24  -2.681  -5.796   2.572
  257   2HO*    G  24          2HO*        G  24  -0.640  -6.023   0.746
  258    H1*    G  24           H1*        G  24  -1.418  -3.386   1.184
  259    H8     G  24           H8         G  24  -4.469  -3.512   3.467
  260    H1     G  24           H1         G  24   0.827  -1.024   6.098
  261   1H2     G  24          1H2         G  24   2.542  -1.291   4.768
  262   2H2     G  24          2H2         G  24   2.386  -2.069   3.210
  263   1H5*    A  25          1H5*        A  25  -1.875  -9.075  -3.219
  264   2H5*    A  25          2H5*        A  25  -1.008  -9.996  -1.976
  265    H4*    A  25           H4*        A  25   0.030  -8.980  -4.333
  266    H3*    A  25           H3*        A  25   1.302 -10.185  -1.901
  267    H2*    A  25           H2*        A  25   3.461  -9.443  -2.656
  268   2HO*    A  25          2HO*        A  25   2.443  -9.870  -4.997
  269    H1*    A  25           H1*        A  25   2.623  -6.922  -3.561
  270    H8     A  25           H8         A  25   0.764  -7.191  -0.430
  271   1H6     A  25          1H6         A  25   5.912  -5.490   2.539
  272   2H6     A  25          2H6         A  25   4.176  -5.695   2.678
  273    H2     A  25           H2         A  25   7.069  -6.795  -1.574
  274   1H5*    G  26          1H5*        G  26   3.988 -11.596  -4.667
  275   2H5*    G  26          2H5*        G  26   4.637 -13.120  -4.033
  276    H4*    G  26           H4*        G  26   6.259 -11.245  -4.078
  277    H3*    G  26           H3*        G  26   5.698 -12.805  -1.613
  278    H2*    G  26           H2*        G  26   6.938 -11.303  -0.219
  279   2HO*    G  26          2HO*        G  26   8.300 -10.964  -2.493
  280    H1*    G  26           H1*        G  26   6.115  -8.919  -1.372
  281    H8     G  26           H8         G  26   3.072 -10.951  -1.506
  282    H1     G  26           H1         G  26   4.274  -8.629   4.325
  283   1H2     G  26          1H2         G  26   6.078  -8.083   4.578
  284   2H2     G  26          2H2         G  26   7.412  -8.015   3.558
  285   1H5*    C  27          1H5*        C  27  10.158 -11.317  -1.234
  286   2H5*    C  27          2H5*        C  27  10.770 -12.944  -1.592
  287    H4*    C  27           H4*        C  27  12.034 -12.240   0.218
  288    H3*    C  27           H3*        C  27   9.863 -14.114   1.060
  289    H2*    C  27           H2*        C  27  10.446 -13.838   3.359
  290   2HO*    C  27          2HO*        C  27  12.450 -13.358   3.924
  291    H1*    C  27           H1*        C  27  10.801 -11.076   3.284
  292   1H4     C  27          1H4         C  27   4.776 -11.667   4.989
  293   2H4     C  27          2H4         C  27   4.142 -11.999   3.500
  294    H5     C  27           H5         C  27   5.897 -12.309   1.536
  295    H6     C  27           H6         C  27   8.265 -12.236   0.975
  296   1H5*    G  28          1H5*        G  28  12.981 -14.966   3.218
  297   2H5*    G  28          2H5*        G  28  13.542 -16.647   3.109
  298    H4*    G  28           H4*        G  28  13.404 -16.207   5.391
  299    H3*    G  28           H3*        G  28  11.029 -17.794   4.466
  300    H2*    G  28           H2*        G  28  10.143 -17.743   6.693
  301   2HO*    G  28          2HO*        G  28  12.721 -17.653   7.315
  302    H1*    G  28           H1*        G  28  10.851 -15.069   7.224
  303    H8     G  28           H8         G  28   9.477 -15.346   3.742
  304    H1     G  28           H1         G  28   5.028 -14.817   8.326
  305   1H2     G  28          1H2         G  28   5.905 -15.140  10.288
  306   2H2     G  28          2H2         G  28   7.610 -15.469  10.505
  307   1H5*    C  29          1H5*        C  29  12.320 -19.760   7.922
  308   2H5*    C  29          2H5*        C  29  12.766 -21.420   7.479
  309    H4*    C  29           H4*        C  29  11.456 -21.706   9.352
  310    H3*    C  29           H3*        C  29   9.868 -22.188   6.863
  311    H2*    C  29           H2*        C  29   7.877 -22.527   8.152
  312   2HO*    C  29          2HO*        C  29   9.631 -23.399   9.938
  313    H1*    C  29           H1*        C  29   8.330 -20.458   9.998
  314   1H4     C  29          1H4         C  29   4.583 -17.593   5.855
  315   2H4     C  29          2H4         C  29   5.729 -17.212   4.730
  316    H5     C  29           H5         C  29   8.167 -18.173   5.188
  317    H6     C  29           H6         C  29   9.487 -19.560   6.702
  318   1H5*    C  30          1H5*        C  30   8.736 -25.327   9.287
  319   2H5*    C  30          2H5*        C  30   9.281 -26.845   8.546
  320    H4*    C  30           H4*        C  30   7.071 -27.255   9.130
  321    H3*    C  30           H3*        C  30   7.327 -26.618   6.211
  322    H2*    C  30           H2*        C  30   4.973 -26.747   5.934
  323   2HO*    C  30          2HO*        C  30   3.645 -27.696   7.540
  324    H1*    C  30           H1*        C  30   4.277 -25.527   8.387
  325   1H4     C  30          1H4         C  30   3.629 -20.998   4.093
  326   2H4     C  30          2H4         C  30   5.206 -20.849   3.614
  327    H5     C  30           H5         C  30   6.899 -22.594   4.708
  328    H6     C  30           H6         C  30   7.103 -24.385   6.333
  329    H3T    C  30           H3T        C  30   6.373 -28.959   7.322
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  -2.843 -18.668   1.322
    2   2H5*    G   1          2H5*        G   1  -3.774 -17.400   2.137
    3    H4*    G   1           H4*        G   1  -3.066 -18.786   3.849
    4    H3*    G   1           H3*        G   1  -1.365 -16.328   3.704
    5    H2*    G   1           H2*        G   1   0.016 -17.151   5.489
    6   2HO*    G   1          2HO*        G   1  -0.808 -18.476   6.925
    7    H1*    G   1           H1*        G   1   0.270 -19.730   4.495
    8    H8     G   1           H8         G   1   0.041 -16.831   1.979
    9    H1     G   1           H1         G   1   5.922 -18.814   3.545
   10   1H2     G   1          1H2         G   1   5.935 -20.140   4.922
   11   2H2     G   1          2H2         G   1   4.705 -20.862   5.817
   12    H5T    G   1           H5T        G   1  -1.846 -16.105   2.063
   13   1H5*    G   2          1H5*        G   2  -1.900 -17.229   7.460
   14   2H5*    G   2          2H5*        G   2  -2.664 -15.954   8.430
   15    H4*    G   2           H4*        G   2  -0.846 -16.654   9.697
   16    H3*    G   2           H3*        G   2  -0.267 -14.078   8.283
   17    H2*    G   2           H2*        G   2   1.957 -14.069   9.183
   18   2HO*    G   2          2HO*        G   2   2.274 -14.943  11.085
   19    H1*    G   2           H1*        G   2   2.475 -16.776   8.731
   20    H8     G   2           H8         G   2   0.428 -14.872   6.104
   21    H1     G   2           H1         G   2   6.751 -15.192   5.125
   22   1H2     G   2          1H2         G   2   7.700 -15.985   6.566
   23   2H2     G   2          2H2         G   2   7.209 -16.625   8.043
   24   1H5*    U   3          1H5*        U   3   1.217 -13.646  11.931
   25   2H5*    U   3          2H5*        U   3   0.600 -12.213  12.777
   26    H4*    U   3           H4*        U   3   2.904 -12.038  12.963
   27    H3*    U   3           H3*        U   3   1.877 -10.275  10.767
   28    H2*    U   3           H2*        U   3   4.130  -9.573  10.296
   29   2HO*    U   3          2HO*        U   3   4.475 -10.208  12.859
   30    H1*    U   3           H1*        U   3   5.231 -12.119  10.357
   31    H3     U   3           H3         U   3   5.060 -11.736   5.894
   32    H5     U   3           H5         U   3   1.025 -11.880   6.995
   33    H6     U   3           H6         U   3   1.723 -11.826   9.297
   34   1H5*    G   4          1H5*        G   4   4.515  -8.097  13.205
   35   2H5*    G   4          2H5*        G   4   3.855  -6.497  13.596
   36    H4*    G   4           H4*        G   4   6.047  -6.152  12.816
   37    H3*    G   4           H3*        G   4   3.977  -5.369  10.796
   38    H2*    G   4           H2*        G   4   5.704  -4.825   9.219
   39   2HO*    G   4          2HO*        G   4   7.588  -4.173   9.930
   40    H1*    G   4           H1*        G   4   7.232  -7.110   9.672
   41    H8     G   4           H8         G   4   3.528  -7.817   9.980
   42    H1     G   4           H1         G   4   5.903  -8.165   4.056
   43   1H2     G   4          1H2         G   4   7.703  -7.499   3.924
   44   2H2     G   4          2H2         G   4   8.743  -6.785   5.042
   45   1H5*    C   5          1H5*        C   5   6.847  -2.814  10.862
   46   2H5*    C   5          2H5*        C   5   6.517  -1.076  11.004
   47    H4*    C   5           H4*        C   5   7.936  -1.228   9.182
   48    H3*    C   5           H3*        C   5   5.096  -0.985   8.234
   49    H2*    C   5           H2*        C   5   5.872  -1.113   5.964
   50   2HO*    C   5          2HO*        C   5   7.999  -0.855   5.433
   51    H1*    C   5           H1*        C   5   7.653  -3.220   6.395
   52   1H4     C   5          1H4         C   5   2.441  -6.256   4.659
   53   2H4     C   5          2H4         C   5   1.598  -6.124   6.078
   54    H5     C   5           H5         C   5   2.741  -4.666   7.970
   55    H6     C   5           H6         C   5   4.683  -3.284   8.494
   56   1H5*    G   6          1H5*        G   6   6.776   1.383   5.043
   57   2H5*    G   6          2H5*        G   6   5.266   2.182   4.565
   58    H4*    G   6           H4*        G   6   6.358   0.047   3.310
   59    H3*    G   6           H3*        G   6   3.643   1.229   3.284
   60    H2*    G   6           H2*        G   6   2.583  -0.756   2.483
   61   2HO*    G   6          2HO*        G   6   4.718  -1.022   1.100
   62    H1*    G   6           H1*        G   6   4.006  -2.644   3.929
   63    H8     G   6           H8         G   6   3.597   0.193   6.224
   64    H1     G   6           H1         G   6  -1.729  -3.320   5.673
   65   1H2     G   6          1H2         G   6  -1.634  -4.569   3.858
   66   2H2     G   6          2H2         G   6  -0.235  -4.560   2.813
   67   1H5*    A   7          1H5*        A   7   6.715  -0.043   0.765
   68   2H5*    A   7          2H5*        A   7   7.925   0.532  -0.398
   69    H4*    A   7           H4*        A   7   6.566   0.066  -2.061
   70    H3*    A   7           H3*        A   7   4.599   1.982  -0.793
   71    H2*    A   7           H2*        A   7   3.031   1.223  -2.445
   72   2HO*    A   7          2HO*        A   7   4.323   1.204  -4.266
   73    H1*    A   7           H1*        A   7   3.946  -1.493  -2.323
   74    H8     A   7           H8         A   7   3.001   0.411   0.943
   75   1H6     A   7          1H6         A   7  -2.425  -2.514   0.294
   76   2H6     A   7          2H6         A   7  -1.484  -1.455   1.313
   77    H2     A   7           H2         A   7   0.067  -3.412  -3.313
   78   1H5*    A   8          1H5*        A   8   2.293   4.185  -4.715
   79   2H5*    A   8          2H5*        A   8   2.251   3.555  -3.056
   80    H4*    A   8           H4*        A   8   2.516   1.652  -5.337
   81    H3*    A   8           H3*        A   8  -0.056   3.061  -4.649
   82    H2*    A   8           H2*        A   8  -1.197   0.958  -4.980
   83   2HO*    A   8          2HO*        A   8   0.552   0.510  -6.763
   84    H1*    A   8           H1*        A   8   0.715  -0.570  -3.606
   85    H8     A   8           H8         A   8   0.814   1.895  -1.167
   86   1H6     A   8          1H6         A   8  -5.037   0.669   0.451
   87   2H6     A   8          2H6         A   8  -3.658   1.469   1.106
   88    H2     A   8           H2         A   8  -4.393  -1.043  -3.501
   89   1H5*    G   9          1H5*        G   9  -1.276   0.766  -7.139
   90   2H5*    G   9          2H5*        G   9  -1.846   1.510  -8.646
   91    H4*    G   9           H4*        G   9  -3.579   0.111  -8.076
   92    H3*    G   9           H3*        G   9  -4.177   2.881  -7.110
   93    H2*    G   9           H2*        G   9  -6.262   2.102  -6.172
   94   2HO*    G   9          2HO*        G   9  -6.875   0.501  -7.676
   95    H1*    G   9           H1*        G   9  -5.165  -0.050  -4.902
   96    H8     G   9           H8         G   9  -2.353   2.322  -4.827
   97    H1     G   9           H1         G   9  -6.870   3.648  -0.500
   98   1H2     G   9          1H2         G   9  -8.515   2.743  -0.812
   99   2H2     G   9          2H2         G   9  -9.029   1.676  -2.005
  100   1H5*    G  10          1H5*        G  10  -8.916   0.287  -9.748
  101   2H5*    G  10          2H5*        G  10  -8.066   1.549 -10.659
  102    H4*    G  10           H4*        G  10 -10.173   2.097  -9.197
  103    H3*    G  10           H3*        G  10  -7.725   3.883  -9.238
  104    H2*    G  10           H2*        G  10  -9.153   5.422  -8.044
  105   2HO*    G  10          2HO*        G  10 -11.065   4.359  -9.437
  106    H1*    G  10           H1*        G  10 -10.261   3.287  -6.490
  107    H8     G  10           H8         G  10  -6.466   3.623  -6.906
  108    H1     G  10           H1         G  10  -9.046   6.220  -1.647
  109   1H2     G  10          1H2         G  10 -10.940   6.243  -1.665
  110   2H2     G  10          2H2         G  10 -12.081   5.721  -2.782
  111   1H5*    G  11          1H5*        G  11 -10.933   6.139 -10.856
  112   2H5*    G  11          2H5*        G  11 -10.368   7.034 -12.281
  113    H4*    G  11           H4*        G  11 -11.425   8.642 -11.016
  114    H3*    G  11           H3*        G  11  -8.468   8.788 -10.563
  115    H2*    G  11           H2*        G  11  -8.795  10.567  -8.993
  116   2HO*    G  11          2HO*        G  11 -10.433  11.871  -9.268
  117    H1*    G  11           H1*        G  11 -10.958   9.410  -7.696
  118    H8     G  11           H8         G  11  -8.303   6.878  -8.721
  119    H1     G  11           H1         G  11  -7.600   9.589  -2.972
  120   1H2     G  11          1H2         G  11  -8.898  10.987  -2.636
  121   2H2     G  11          2H2         G  11 -10.129  11.629  -3.596
  122   1H5*    C  12          1H5*        C  12  -9.922  12.561 -10.881
  123   2H5*    C  12          2H5*        C  12  -8.970  13.557 -11.998
  124    H4*    C  12           H4*        C  12  -9.120  14.849 -10.087
  125    H3*    C  12           H3*        C  12  -6.458  13.434 -10.043
  126    H2*    C  12           H2*        C  12  -5.968  14.691  -8.039
  127   2HO*    C  12          2HO*        C  12  -6.813  16.679  -8.350
  128    H1*    C  12           H1*        C  12  -8.484  14.211  -6.879
  129   1H4     C  12          1H4         C  12  -4.498   9.806  -4.741
  130   2H4     C  12          2H4         C  12  -4.482   8.804  -6.072
  131    H5     C  12           H5         C  12  -5.833   9.724  -8.172
  132    H6     C  12           H6         C  12  -7.281  11.505  -8.962
  133   1H5*    G  13          1H5*        G  13  -5.064  17.939 -10.588
  134   2H5*    G  13          2H5*        G  13  -3.321  17.676 -10.767
  135    H4*    G  13           H4*        G  13  -4.203  18.980  -8.731
  136    H3*    G  13           H3*        G  13  -2.181  16.755  -8.389
  137    H2*    G  13           H2*        G  13  -2.049  17.544  -6.099
  138   2HO*    G  13          2HO*        G  13  -2.628  19.835  -7.098
  139    H1*    G  13           H1*        G  13  -4.859  17.695  -5.868
  140    H8     G  13           H8         G  13  -3.488  14.718  -7.833
  141    H1     G  13           H1         G  13  -3.897  13.810  -1.522
  142   1H2     G  13          1H2         G  13  -4.544  15.633  -0.520
  143   2H2     G  13          2H2         G  13  -4.894  17.106  -1.399
  144   1H5*    U  14          1H5*        U  14   0.356  18.099  -7.728
  145   2H5*    U  14          2H5*        U  14   1.885  18.901  -8.133
  146    H4*    U  14           H4*        U  14   2.768  16.844  -9.066
  147    H3*    U  14           H3*        U  14   0.497  15.816  -9.755
  148    H2*    U  14           H2*        U  14  -0.595  16.153  -7.604
  149   2HO*    U  14          2HO*        U  14  -0.135  13.642  -8.394
  150    H1*    U  14           H1*        U  14   1.680  14.681  -6.175
  151    H3     U  14           H3         U  14   1.316  18.231  -2.869
  152    H5     U  14           H5         U  14  -2.373  16.498  -3.861
  153    H6     U  14           H6         U  14  -1.299  15.421  -5.695
  154   1H5*    C  15          1H5*        C  15   1.878  11.106  -8.927
  155   2H5*    C  15          2H5*        C  15   0.213  10.578  -8.627
  156    H4*    C  15           H4*        C  15   1.292  13.030  -7.300
  157    H3*    C  15           H3*        C  15   1.886  10.221  -6.369
  158    H2*    C  15           H2*        C  15   1.593  11.046  -4.106
  159   2HO*    C  15          2HO*        C  15   2.422  13.260  -5.004
  160    H1*    C  15           H1*        C  15  -0.809  12.300  -4.647
  161   1H4     C  15          1H4         C  15  -2.143   5.849  -4.973
  162   2H4     C  15          2H4         C  15  -2.180   6.183  -3.255
  163    H5     C  15           H5         C  15  -1.570   8.361  -2.334
  164    H6     C  15           H6         C  15  -0.797  10.580  -2.871
  165   1H5*    G  16          1H5*        G  16   7.274  10.311  -7.397
  166   2H5*    G  16          2H5*        G  16   5.747   9.452  -7.126
  167    H4*    G  16           H4*        G  16   7.219   9.435  -5.165
  168    H3*    G  16           H3*        G  16   4.450  10.447  -5.036
  169    H2*    G  16           H2*        G  16   4.704  11.563  -2.950
  170   2HO*    G  16          2HO*        G  16   6.188   9.541  -2.391
  171    H1*    G  16           H1*        G  16   7.281  12.560  -3.266
  172    H8     G  16           H8         G  16   3.835  13.138  -3.684
  173    H1     G  16           H1         G  16   7.156  17.070  -7.508
  174   1H2     G  16          1H2         G  16   9.223  16.350  -7.734
  175   2H2     G  16          2H2         G  16   9.785  14.894  -6.943
  176   1H5*    U  17          1H5*        U  17   1.483   7.571  -4.153
  177   2H5*    U  17          2H5*        U  17   1.070   9.239  -4.577
  178    H4*    U  17           H4*        U  17   3.389   8.786  -2.813
  179    H3*    U  17           H3*        U  17   1.066   7.559  -1.979
  180    H2*    U  17           H2*        U  17  -0.168   9.492  -1.474
  181   2HO*    U  17          2HO*        U  17   1.608   8.993   0.638
  182    H1*    U  17           H1*        U  17   2.426  10.993  -0.839
  183    H3     U  17           H3         U  17   0.862  15.095  -2.357
  184    H5     U  17           H5         U  17  -2.397  12.863  -0.950
  185    H6     U  17           H6         U  17  -0.954  10.934  -0.927
  186   1H5*    C  18          1H5*        C  18   3.095   9.570   0.578
  187   2H5*    C  18          2H5*        C  18   4.346   8.895   1.641
  188    H4*    C  18           H4*        C  18   3.022   9.557   3.573
  189    H3*    C  18           H3*        C  18   0.808   9.835   2.051
  190    H2*    C  18           H2*        C  18   1.370  11.887   0.973
  191   2HO*    C  18          2HO*        C  18  -0.362  12.469   2.342
  192    H1*    C  18           H1*        C  18   2.823  12.826   3.501
  193   1H4     C  18          1H4         C  18   6.149  16.532  -0.450
  194   2H4     C  18          2H4         C  18   4.819  16.472  -1.584
  195    H5     C  18           H5         C  18   2.899  15.011  -1.262
  196    H6     C  18           H6         C  18   1.858  13.400   0.199
  197   1H5*    G  19          1H5*        G  19  -0.269  12.089   4.010
  198   2H5*    G  19          2H5*        G  19  -1.428  12.490   5.291
  199    H4*    G  19           H4*        G  19  -2.181  13.497   3.293
  200    H3*    G  19           H3*        G  19  -3.782  11.186   4.241
  201    H2*    G  19           H2*        G  19  -4.857  10.873   2.229
  202   2HO*    G  19          2HO*        G  19  -5.887  12.985   2.615
  203    H1*    G  19           H1*        G  19  -3.090  12.850   0.764
  204    H8     G  19           H8         G  19  -1.754   9.402   1.067
  205    H1     G  19           H1         G  19  -5.594  10.403  -3.984
  206   1H2     G  19          1H2         G  19  -6.544  12.063  -3.892
  207   2H2     G  19          2H2         G  19  -6.597  13.272  -2.714
  208   1H5*    C  20          1H5*        C  20  -6.674  14.500   3.670
  209   2H5*    C  20          2H5*        C  20  -7.761  14.447   5.070
  210    H4*    C  20           H4*        C  20  -9.239  14.471   3.338
  211    H3*    C  20           H3*        C  20  -8.808  11.552   3.959
  212    H2*    C  20           H2*        C  20 -10.372  11.059   2.209
  213   2HO*    C  20          2HO*        C  20 -11.413  13.371   3.010
  214    H1*    C  20           H1*        C  20  -9.507  13.211   0.526
  215   1H4     C  20          1H4         C  20  -6.914   8.420  -2.485
  216   2H4     C  20          2H4         C  20  -5.799   7.936  -1.361
  217    H5     C  20           H5         C  20  -5.926   9.215   0.987
  218    H6     C  20           H6         C  20  -7.103  10.975   2.212
  219   1H5*    C  21          1H5*        C  21 -12.789  11.721   3.673
  220   2H5*    C  21          2H5*        C  21 -13.575  11.007   5.095
  221    H4*    C  21           H4*        C  21 -14.522   9.887   3.300
  222    H3*    C  21           H3*        C  21 -12.340   8.159   4.456
  223    H2*    C  21           H2*        C  21 -12.879   6.503   2.810
  224   2HO*    C  21          2HO*        C  21 -15.311   7.526   3.121
  225    H1*    C  21           H1*        C  21 -13.439   8.390   0.735
  226   1H4     C  21          1H4         C  21  -7.802   6.333  -1.009
  227   2H4     C  21          2H4         C  21  -6.888   6.948   0.226
  228    H5     C  21           H5         C  21  -8.256   8.151   2.169
  229    H6     C  21           H6         C  21 -10.498   8.789   2.901
  230   1H5*    C  22          1H5*        C  22 -12.235   4.489   6.089
  231   2H5*    C  22          2H5*        C  22 -11.889   5.726   4.864
  232    H4*    C  22           H4*        C  22 -13.771   3.610   4.050
  233    H3*    C  22           H3*        C  22 -10.943   2.894   4.781
  234    H2*    C  22           H2*        C  22 -10.761   1.613   2.775
  235   2HO*    C  22          2HO*        C  22 -13.467   1.466   3.099
  236    H1*    C  22           H1*        C  22 -12.107   3.430   1.118
  237   1H4     C  22          1H4         C  22  -5.914   4.247   0.358
  238   2H4     C  22          2H4         C  22  -5.635   5.201   1.684
  239    H5     C  22           H5         C  22  -7.715   5.518   3.314
  240    H6     C  22           H6         C  22 -10.072   5.036   3.616
  241   1H5*    C  23          1H5*        C  23 -12.637  -0.292   2.803
  242   2H5*    C  23          2H5*        C  23 -12.149  -1.806   3.589
  243    H4*    C  23           H4*        C  23 -11.517  -1.622   1.194
  244    H3*    C  23           H3*        C  23  -9.475  -2.194   3.303
  245    H2*    C  23           H2*        C  23  -7.715  -2.125   1.685
  246   2HO*    C  23          2HO*        C  23  -9.560  -3.124   0.134
  247    H1*    C  23           H1*        C  23  -8.735   0.016   0.155
  248   1H4     C  23          1H4         C  23  -4.319   2.642   3.874
  249   2H4     C  23          2H4         C  23  -5.505   2.853   5.144
  250    H5     C  23           H5         C  23  -7.756   1.980   4.993
  251    H6     C  23           H6         C  23  -9.323   0.735   3.598
  252   1H5*    G  24          1H5*        G  24  -6.799  -5.657   3.396
  253   2H5*    G  24          2H5*        G  24  -7.453  -4.011   3.458
  254    H4*    G  24           H4*        G  24  -7.233  -4.856   0.735
  255    H3*    G  24           H3*        G  24  -5.285  -6.240   1.860
  256    H2*    G  24           H2*        G  24  -4.209  -4.567   3.170
  257   2HO*    G  24          2HO*        G  24  -3.177  -4.727   0.602
  258    H1*    G  24           H1*        G  24  -4.485  -2.396   1.077
  259    H8     G  24           H8         G  24  -6.778  -2.460   4.017
  260    H1     G  24           H1         G  24  -1.402   0.884   5.043
  261   1H2     G  24          1H2         G  24   0.023   0.559   3.429
  262   2H2     G  24          2H2         G  24  -0.319  -0.490   2.077
  263   1H5*    A  25          1H5*        A  25  -3.906  -9.307  -1.281
  264   2H5*    A  25          2H5*        A  25  -2.511  -9.332  -0.186
  265    H4*    A  25           H4*        A  25  -2.639  -8.611  -2.945
  266    H3*    A  25           H3*        A  25  -0.431  -9.057  -0.972
  267    H2*    A  25           H2*        A  25   1.095  -7.843  -2.390
  268   2HO*    A  25          2HO*        A  25  -0.408  -8.807  -4.283
  269    H1*    A  25           H1*        A  25  -0.672  -5.784  -3.052
  270    H8     A  25           H8         A  25  -1.593  -6.043   0.414
  271   1H6     A  25          1H6         A  25   3.558  -2.960   1.890
  272   2H6     A  25          2H6         A  25   1.990  -3.487   2.474
  273    H2     A  25           H2         A  25   4.045  -4.545  -2.257
  274   1H5*    G  26          1H5*        G  26   1.721 -10.290  -4.232
  275   2H5*    G  26          2H5*        G  26   2.806 -11.591  -3.704
  276    H4*    G  26           H4*        G  26   4.030  -9.572  -4.316
  277    H3*    G  26           H3*        G  26   4.184 -10.559  -1.504
  278    H2*    G  26           H2*        G  26   5.511  -8.691  -0.834
  279   2HO*    G  26          2HO*        G  26   6.864  -8.342  -2.599
  280    H1*    G  26           H1*        G  26   3.990  -6.770  -2.099
  281    H8     G  26           H8         G  26   1.465  -9.235  -1.146
  282    H1     G  26           H1         G  26   3.456  -5.743   3.816
  283   1H2     G  26          1H2         G  26   5.153  -4.856   3.502
  284   2H2     G  26          2H2         G  26   6.174  -4.790   2.173
  285   1H5*    C  27          1H5*        C  27   8.307  -7.695  -3.708
  286   2H5*    C  27          2H5*        C  27   9.298  -9.092  -4.173
  287    H4*    C  27           H4*        C  27  10.597  -7.779  -2.708
  288    H3*    C  27           H3*        C  27   9.590 -10.310  -1.459
  289    H2*    C  27           H2*        C  27  10.616  -9.706   0.623
  290   2HO*    C  27          2HO*        C  27  12.338  -8.513  -0.960
  291    H1*    C  27           H1*        C  27   9.887  -7.002   0.558
  292   1H4     C  27          1H4         C  27   5.224  -9.448   3.956
  293   2H4     C  27          2H4         C  27   4.402 -10.233   2.740
  294    H5     C  27           H5         C  27   5.614 -10.267   0.389
  295    H6     C  27           H6         C  27   7.550  -9.451  -0.852
  296   1H5*    G  28          1H5*        G  28  13.321  -9.914  -0.202
  297   2H5*    G  28          2H5*        G  28  14.329 -11.342  -0.509
  298    H4*    G  28           H4*        G  28  14.614 -10.911   1.754
  299    H3*    G  28           H3*        G  28  12.628 -13.132   1.369
  300    H2*    G  28           H2*        G  28  12.376 -13.280   3.751
  301   2HO*    G  28          2HO*        G  28  14.880 -12.439   3.713
  302    H1*    G  28           H1*        G  28  12.359 -10.507   4.197
  303    H8     G  28           H8         G  28  10.381 -11.509   1.130
  304    H1     G  28           H1         G  28   7.090 -11.586   6.638
  305   1H2     G  28          1H2         G  28   8.447 -11.398   8.337
  306   2H2     G  28          2H2         G  28  10.179 -11.241   8.131
  307   1H5*    C  29          1H5*        C  29  15.019 -14.495   4.358
  308   2H5*    C  29          2H5*        C  29  15.785 -16.017   3.860
  309    H4*    C  29           H4*        C  29  14.943 -16.499   5.953
  310    H3*    C  29           H3*        C  29  13.113 -17.524   3.816
  311    H2*    C  29           H2*        C  29  11.549 -18.267   5.470
  312   2HO*    C  29          2HO*        C  29  13.789 -18.510   6.905
  313    H1*    C  29           H1*        C  29  11.811 -16.045   7.182
  314   1H4     C  29          1H4         C  29   6.674 -14.438   3.949
  315   2H4     C  29          2H4         C  29   7.411 -13.842   2.607
  316    H5     C  29           H5         C  29  10.071 -14.146   2.523
  317    H6     C  29           H6         C  29  11.982 -15.099   3.704
  318   1H5*    C  30          1H5*        C  30  13.392 -20.667   6.502
  319   2H5*    C  30          2H5*        C  30  14.170 -22.040   5.689
  320    H4*    C  30           H4*        C  30  12.336 -22.976   6.763
  321    H3*    C  30           H3*        C  30  11.792 -22.543   3.847
  322    H2*    C  30           H2*        C  30   9.559 -23.308   4.102
  323   2HO*    C  30          2HO*        C  30  10.618 -24.901   5.864
  324    H1*    C  30           H1*        C  30   9.064 -22.088   6.596
  325   1H4     C  30          1H4         C  30   6.449 -18.279   2.347
  326   2H4     C  30          2H4         C  30   7.811 -17.794   1.544
  327    H5     C  30           H5         C  30  10.077 -18.945   2.339
  328    H6     C  30           H6         C  30  11.049 -20.463   3.964
  329    H3T    C  30           H3T        C  30  13.155 -24.145   4.346
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  -3.312 -20.861   1.908
    2   2H5*    G   1          2H5*        G   1  -4.327 -19.408   1.965
    3    H4*    G   1           H4*        G   1  -4.409 -20.248   4.118
    4    H3*    G   1           H3*        G   1  -2.508 -17.945   3.946
    5    H2*    G   1           H2*        G   1  -1.932 -18.230   6.272
    6   2HO*    G   1          2HO*        G   1  -4.355 -19.411   6.325
    7    H1*    G   1           H1*        G   1  -1.526 -20.955   6.120
    8    H8     G   1           H8         G   1  -0.768 -19.058   2.888
    9    H1     G   1           H1         G   1   4.182 -19.929   6.856
   10   1H2     G   1          1H2         G   1   3.686 -20.686   8.536
   11   2H2     G   1          2H2         G   1   2.205 -21.142   9.191
   12    H5T    G   1           H5T        G   1  -2.469 -18.146   2.080
   13   1H5*    G   2          1H5*        G   2  -4.401 -17.689   7.343
   14   2H5*    G   2          2H5*        G   2  -5.235 -16.151   7.642
   15    H4*    G   2           H4*        G   2  -3.978 -16.560   9.567
   16    H3*    G   2           H3*        G   2  -2.684 -14.498   7.816
   17    H2*    G   2           H2*        G   2  -0.841 -14.348   9.351
   18   2HO*    G   2          2HO*        G   2  -1.212 -14.705  11.404
   19    H1*    G   2           H1*        G   2  -0.538 -17.093   9.709
   20    H8     G   2           H8         G   2  -1.588 -16.164   6.179
   21    H1     G   2           H1         G   2   4.715 -16.077   7.304
   22   1H2     G   2          1H2         G   2   5.159 -16.275   9.144
   23   2H2     G   2          2H2         G   2   4.225 -16.477  10.528
   24   1H5*    U   3          1H5*        U   3  -2.289 -13.246  11.571
   25   2H5*    U   3          2H5*        U   3  -2.830 -11.575  11.828
   26    H4*    U   3           H4*        U   3  -0.668 -11.690  12.718
   27    H3*    U   3           H3*        U   3  -0.710 -10.312  10.056
   28    H2*    U   3           H2*        U   3   1.683 -10.045  10.163
   29   2HO*    U   3          2HO*        U   3   1.206 -10.175  12.785
   30    H1*    U   3           H1*        U   3   2.213 -12.652  10.952
   31    H3     U   3           H3         U   3   3.269 -12.788   6.537
   32    H5     U   3           H5         U   3  -0.907 -12.862   6.604
   33    H6     U   3           H6         U   3  -0.816 -12.428   8.968
   34   1H5*    G   4          1H5*        G   4   1.695  -8.150  12.589
   35   2H5*    G   4          2H5*        G   4   1.363  -6.409  12.505
   36    H4*    G   4           H4*        G   4   3.690  -6.705  12.226
   37    H3*    G   4           H3*        G   4   2.336  -5.963   9.649
   38    H2*    G   4           H2*        G   4   4.461  -6.095   8.532
   39   2HO*    G   4          2HO*        G   4   6.275  -5.785   9.603
   40    H1*    G   4           H1*        G   4   5.280  -8.459   9.778
   41    H8     G   4           H8         G   4   1.598  -8.666   9.047
   42    H1     G   4           H1         G   4   5.445 -10.028   4.120
   43   1H2     G   4          1H2         G   4   7.250  -9.495   4.402
   44   2H2     G   4          2H2         G   4   8.031  -8.765   5.703
   45   1H5*    C   5          1H5*        C   5   5.647  -4.127  10.074
   46   2H5*    C   5          2H5*        C   5   5.801  -2.383   9.795
   47    H4*    C   5           H4*        C   5   7.490  -3.434   8.532
   48    H3*    C   5           H3*        C   5   5.237  -2.411   6.835
   49    H2*    C   5           H2*        C   5   6.279  -3.308   4.889
   50   2HO*    C   5          2HO*        C   5   8.503  -2.825   6.370
   51    H1*    C   5           H1*        C   5   7.347  -5.637   6.129
   52   1H4     C   5          1H4         C   5   2.446  -7.824   2.881
   53   2H4     C   5          2H4         C   5   1.280  -7.523   4.017
   54    H5     C   5           H5         C   5   2.070  -6.120   6.126
   55    H6     C   5           H6         C   5   3.978  -4.972   7.126
   56   1H5*    G   6          1H5*        G   6   8.322  -2.230   4.502
   57   2H5*    G   6          2H5*        G   6   8.545  -0.585   3.875
   58    H4*    G   6           H4*        G   6   8.393  -1.978   1.999
   59    H3*    G   6           H3*        G   6   5.962  -0.325   2.486
   60    H2*    G   6           H2*        G   6   4.766  -1.396   0.711
   61   2HO*    G   6          2HO*        G   6   6.393  -1.530  -0.854
   62    H1*    G   6           H1*        G   6   5.557  -4.006   1.272
   63    H8     G   6           H8         G   6   5.003  -1.575   4.149
   64    H1     G   6           H1         G   6  -0.056  -5.217   2.692
   65   1H2     G   6          1H2         G   6   0.309  -6.323   0.816
   66   2H2     G   6          2H2         G   6   1.832  -6.176  -0.024
   67   1H5*    A   7          1H5*        A   7   8.127  -0.946  -1.113
   68   2H5*    A   7          2H5*        A   7   8.464   0.492  -2.099
   69    H4*    A   7           H4*        A   7   8.226  -1.163  -3.680
   70    H3*    A   7           H3*        A   7   5.635   0.322  -3.399
   71    H2*    A   7           H2*        A   7   4.581  -1.167  -4.923
   72   2HO*    A   7          2HO*        A   7   6.078  -1.246  -6.558
   73    H1*    A   7           H1*        A   7   5.982  -3.512  -4.115
   74    H8     A   7           H8         A   7   4.624  -1.725  -1.102
   75   1H6     A   7          1H6         A   7  -0.672  -4.756  -2.163
   76   2H6     A   7          2H6         A   7   0.197  -3.753  -1.020
   77    H2     A   7           H2         A   7   1.984  -5.342  -5.707
   78   1H5*    A   8          1H5*        A   8   4.471   1.508  -8.524
   79   2H5*    A   8          2H5*        A   8   3.749   1.714  -6.916
   80    H4*    A   8           H4*        A   8   4.031  -0.829  -8.505
   81    H3*    A   8           H3*        A   8   1.657   0.861  -7.783
   82    H2*    A   8           H2*        A   8   0.353  -1.108  -7.444
   83   2HO*    A   8          2HO*        A   8   2.142  -2.080  -9.278
   84    H1*    A   8           H1*        A   8   2.487  -2.696  -6.387
   85    H8     A   8           H8         A   8   3.101  -0.384  -4.002
   86   1H6     A   8          1H6         A   8  -2.480  -1.181  -1.446
   87   2H6     A   8          2H6         A   8  -0.933  -0.551  -1.014
   88    H2     A   8           H2         A   8  -2.690  -2.697  -5.519
   89   1H5*    G   9          1H5*        G   9  -0.824   2.992  -9.103
   90   2H5*    G   9          2H5*        G   9   0.112   1.794  -8.199
   91    H4*    G   9           H4*        G   9  -2.186   0.748  -9.708
   92    H3*    G   9           H3*        G   9  -2.584   2.790  -7.577
   93    H2*    G   9           H2*        G   9  -4.167   1.439  -6.398
   94   2HO*    G   9          2HO*        G   9  -5.272  -0.108  -7.340
   95    H1*    G   9           H1*        G   9  -2.717  -0.880  -6.481
   96    H8     G   9           H8         G   9   0.201   0.999  -6.261
   97    H1     G   9           H1         G   9  -3.414   2.175  -1.119
   98   1H2     G   9          1H2         G   9  -5.249   1.724  -1.357
   99   2H2     G   9          2H2         G   9  -6.101   1.036  -2.631
  100   1H5*    G  10          1H5*        G  10  -5.998   0.247  -8.766
  101   2H5*    G  10          2H5*        G  10  -7.441   0.328  -9.794
  102    H4*    G  10           H4*        G  10  -8.460   1.333  -8.120
  103    H3*    G  10           H3*        G  10  -6.568   3.640  -8.641
  104    H2*    G  10           H2*        G  10  -7.659   4.678  -6.771
  105   2HO*    G  10          2HO*        G  10  -9.761   4.315  -6.698
  106    H1*    G  10           H1*        G  10  -7.828   2.217  -5.317
  107    H8     G  10           H8         G  10  -4.416   3.060  -6.775
  108    H1     G  10           H1         G  10  -5.682   5.559  -1.018
  109   1H2     G  10          1H2         G  10  -7.501   5.375  -0.493
  110   2H2     G  10          2H2         G  10  -8.838   4.681  -1.241
  111   1H5*    G  11          1H5*        G  11 -10.803   4.773  -8.482
  112   2H5*    G  11          2H5*        G  11 -11.127   6.054  -9.665
  113    H4*    G  11           H4*        G  11 -12.185   6.737  -7.697
  114    H3*    G  11           H3*        G  11  -9.593   8.230  -8.020
  115    H2*    G  11           H2*        G  11 -10.088   9.398  -5.969
  116   2HO*    G  11          2HO*        G  11 -12.077   9.494  -5.172
  117    H1*    G  11           H1*        G  11 -10.758   7.113  -4.559
  118    H8     G  11           H8         G  11  -8.106   6.321  -7.106
  119    H1     G  11           H1         G  11  -5.912   8.756  -1.617
  120   1H2     G  11          1H2         G  11  -7.303   9.556  -0.542
  121   2H2     G  11          2H2         G  11  -8.969   9.686  -0.760
  122   1H5*    C  12          1H5*        C  12 -12.389  10.809  -6.782
  123   2H5*    C  12          2H5*        C  12 -12.396  12.338  -7.680
  124    H4*    C  12           H4*        C  12 -12.353  12.853  -5.369
  125    H3*    C  12           H3*        C  12  -9.684  13.386  -6.660
  126    H2*    C  12           H2*        C  12  -8.891  14.158  -4.515
  127   2HO*    C  12          2HO*        C  12 -11.356  14.875  -4.176
  128    H1*    C  12           H1*        C  12 -10.040  12.056  -3.060
  129   1H4     C  12          1H4         C  12  -4.115  10.125  -4.145
  130   2H4     C  12          2H4         C  12  -4.441   9.377  -5.582
  131    H5     C  12           H5         C  12  -6.870   9.678  -6.570
  132    H6     C  12           H6         C  12  -9.043  10.707  -6.196
  133   1H5*    G  13          1H5*        G  13  -8.891  18.126  -4.677
  134   2H5*    G  13          2H5*        G  13  -9.653  18.460  -6.243
  135    H4*    G  13           H4*        G  13  -7.323  19.193  -6.184
  136    H3*    G  13           H3*        G  13  -8.164  17.102  -8.139
  137    H2*    G  13           H2*        G  13  -5.954  16.664  -8.822
  138   2HO*    G  13          2HO*        G  13  -5.630  19.147  -8.737
  139    H1*    G  13           H1*        G  13  -4.679  17.021  -6.343
  140    H8     G  13           H8         G  13  -7.772  14.952  -6.000
  141    H1     G  13           H1         G  13  -2.627  11.625  -7.792
  142   1H2     G  13          1H2         G  13  -0.964  13.020  -8.365
  143   2H2     G  13          2H2         G  13  -1.163  14.755  -8.282
  144   1H5*    U  14          1H5*        U  14  -6.777  22.446  -5.907
  145   2H5*    U  14          2H5*        U  14  -6.708  22.784  -7.648
  146    H4*    U  14           H4*        U  14  -4.544  23.176  -7.213
  147    H3*    U  14           H3*        U  14  -4.695  20.837  -8.433
  148    H2*    U  14           H2*        U  14  -4.964  19.435  -6.551
  149   2HO*    U  14          2HO*        U  14  -2.471  19.028  -5.924
  150    H1*    U  14           H1*        U  14  -2.802  20.918  -4.987
  151    H3     U  14           H3         U  14  -5.209  20.612  -0.965
  152    H5     U  14           H5         U  14  -5.824  17.161  -3.270
  153    H6     U  14           H6         U  14  -4.933  18.317  -5.131
  154   1H5*    C  15          1H5*        C  15  -0.039  20.091  -8.505
  155   2H5*    C  15          2H5*        C  15  -1.544  19.230  -8.135
  156    H4*    C  15           H4*        C  15   1.221  18.769  -7.140
  157    H3*    C  15           H3*        C  15  -0.994  16.994  -8.155
  158    H2*    C  15           H2*        C  15   0.000  15.193  -6.900
  159   2HO*    C  15          2HO*        C  15   2.180  16.986  -6.865
  160    H1*    C  15           H1*        C  15   0.540  16.765  -4.619
  161   1H4     C  15          1H4         C  15  -5.770  15.417  -3.673
  162   2H4     C  15          2H4         C  15  -5.203  13.785  -3.948
  163    H5     C  15           H5         C  15  -2.946  13.297  -4.686
  164    H6     C  15           H6         C  15  -0.795  14.267  -5.263
  165   1H5*    G  16          1H5*        G  16   2.170  14.706 -11.734
  166   2H5*    G  16          2H5*        G  16   1.308  13.236 -11.241
  167    H4*    G  16           H4*        G  16   3.364  12.467 -10.837
  168    H3*    G  16           H3*        G  16   2.590  13.876  -8.348
  169    H2*    G  16           H2*        G  16   4.812  14.029  -7.512
  170   2HO*    G  16          2HO*        G  16   5.037  11.712  -8.696
  171    H1*    G  16           H1*        G  16   6.149  14.555  -9.901
  172    H8     G  16           H8         G  16   2.852  15.961  -8.418
  173    H1     G  16           H1         G  16   7.642  20.139  -9.249
  174   1H2     G  16          1H2         G  16   9.384  19.136 -10.148
  175   2H2     G  16          2H2         G  16   9.364  17.432 -10.546
  176   1H5*    U  17          1H5*        U  17   0.560  11.250  -5.994
  177   2H5*    U  17          2H5*        U  17  -0.430  12.717  -5.950
  178    H4*    U  17           H4*        U  17   2.444  13.191  -6.235
  179    H3*    U  17           H3*        U  17   2.011  11.202  -4.430
  180    H2*    U  17           H2*        U  17   0.647  12.363  -2.907
  181   2HO*    U  17          2HO*        U  17   3.126  13.547  -2.191
  182    H1*    U  17           H1*        U  17   2.226  14.926  -3.427
  183    H3     U  17           H3         U  17  -0.665  17.868  -1.756
  184    H5     U  17           H5         U  17  -2.895  14.360  -1.831
  185    H6     U  17           H6         U  17  -1.041  13.286  -2.943
  186   1H5*    C  18          1H5*        C  18   3.266  16.423  -2.809
  187   2H5*    C  18          2H5*        C  18   4.978  16.139  -3.186
  188    H4*    C  18           H4*        C  18   5.375  15.310  -0.983
  189    H3*    C  18           H3*        C  18   2.933  14.447  -0.592
  190    H2*    C  18           H2*        C  18   1.706  16.481  -0.680
  191   2HO*    C  18          2HO*        C  18   2.718  16.908   1.931
  192    H1*    C  18           H1*        C  18   3.736  18.130   0.836
  193   1H4     C  18          1H4         C  18   1.781  22.373  -3.624
  194   2H4     C  18          2H4         C  18   0.190  21.672  -3.427
  195    H5     C  18           H5         C  18  -0.203  19.662  -2.111
  196    H6     C  18           H6         C  18   0.837  18.015  -0.662
  197   1H5*    G  19          1H5*        G  19   2.472  15.310   2.098
  198   2H5*    G  19          2H5*        G  19   2.099  14.810   3.754
  199    H4*    G  19           H4*        G  19   0.089  15.339   2.558
  200    H3*    G  19           H3*        G  19   0.409  12.503   3.380
  201    H2*    G  19           H2*        G  19  -1.215  11.733   1.934
  202   2HO*    G  19          2HO*        G  19  -2.974  13.581   1.540
  203    H1*    G  19           H1*        G  19  -1.462  14.377   0.462
  204    H8     G  19           H8         G  19   1.219  11.926  -0.521
  205    H1     G  19           H1         G  19  -4.432  11.291  -3.466
  206   1H2     G  19          1H2         G  19  -5.844  12.273  -2.559
  207   2H2     G  19          2H2         G  19  -5.814  13.281  -1.195
  208   1H5*    C  20          1H5*        C  20  -3.492  14.263   4.599
  209   2H5*    C  20          2H5*        C  20  -3.867  13.678   6.229
  210    H4*    C  20           H4*        C  20  -5.853  13.425   5.118
  211    H3*    C  20           H3*        C  20  -4.499  10.733   4.969
  212    H2*    C  20           H2*        C  20  -6.463   9.957   3.824
  213   2HO*    C  20          2HO*        C  20  -7.632  11.770   5.366
  214    H1*    C  20           H1*        C  20  -6.846  12.395   2.376
  215   1H4     C  20          1H4         C  20  -4.554   8.674  -2.060
  216   2H4     C  20          2H4         C  20  -2.962   8.642  -1.597
  217    H5     C  20           H5         C  20  -2.440   9.847   0.732
  218    H6     C  20           H6         C  20  -3.434  11.150   2.541
  219   1H5*    C  21          1H5*        C  21  -8.231  10.167   5.857
  220   2H5*    C  21          2H5*        C  21  -8.529   9.122   7.259
  221    H4*    C  21           H4*        C  21  -9.877   8.260   5.569
  222    H3*    C  21           H3*        C  21  -7.379   6.579   5.759
  223    H2*    C  21           H2*        C  21  -8.287   5.197   4.020
  224   2HO*    C  21          2HO*        C  21 -10.571   5.871   5.149
  225    H1*    C  21           H1*        C  21  -9.437   7.370   2.569
  226   1H4     C  21          1H4         C  21  -4.323   5.842  -0.770
  227   2H4     C  21          2H4         C  21  -3.202   6.627   0.157
  228    H5     C  21           H5         C  21  -4.100   7.698   2.411
  229    H6     C  21           H6         C  21  -6.092   8.043   3.777
  230   1H5*    C  22          1H5*        C  22  -7.054   2.551   5.993
  231   2H5*    C  22          2H5*        C  22  -7.152   4.123   5.179
  232    H4*    C  22           H4*        C  22  -9.410   2.447   4.508
  233    H3*    C  22           H3*        C  22  -6.723   1.156   4.240
  234    H2*    C  22           H2*        C  22  -7.172   0.534   1.996
  235   2HO*    C  22          2HO*        C  22  -9.706   0.490   2.913
  236    H1*    C  22           H1*        C  22  -8.470   2.877   1.202
  237   1H4     C  22          1H4         C  22  -2.436   3.092  -0.613
  238   2H4     C  22          2H4         C  22  -1.791   3.684   0.798
  239    H5     C  22           H5         C  22  -3.515   3.908   2.813
  240    H6     C  22           H6         C  22  -5.841   3.683   3.448
  241   1H5*    C  23          1H5*        C  23  -9.293  -1.258   2.313
  242   2H5*    C  23          2H5*        C  23  -9.141  -2.937   2.867
  243    H4*    C  23           H4*        C  23  -8.958  -2.871   0.484
  244    H3*    C  23           H3*        C  23  -6.468  -3.615   1.968
  245    H2*    C  23           H2*        C  23  -5.230  -3.719  -0.091
  246   2HO*    C  23          2HO*        C  23  -7.688  -4.233  -1.072
  247    H1*    C  23           H1*        C  23  -6.269  -1.388  -1.209
  248   1H4     C  23          1H4         C  23  -1.041   0.606   1.763
  249   2H4     C  23          2H4         C  23  -1.955   0.842   3.239
  250    H5     C  23           H5         C  23  -4.268   0.152   3.468
  251    H6     C  23           H6         C  23  -6.154  -0.900   2.336
  252   1H5*    G  24          1H5*        G  24  -6.621  -5.780  -1.233
  253   2H5*    G  24          2H5*        G  24  -6.113  -7.475  -1.115
  254    H4*    G  24           H4*        G  24  -4.803  -6.088  -2.702
  255    H3*    G  24           H3*        G  24  -3.840  -8.139  -1.263
  256    H2*    G  24           H2*        G  24  -2.971  -6.956   0.621
  257   2HO*    G  24          2HO*        G  24  -1.147  -7.246  -1.418
  258    H1*    G  24           H1*        G  24  -2.017  -4.643  -1.128
  259    H8     G  24           H8         G  24  -4.677  -4.993   1.632
  260    H1     G  24           H1         G  24   0.307  -1.221   3.039
  261   1H2     G  24          1H2         G  24   1.791  -1.265   1.398
  262   2H2     G  24          2H2         G  24   1.539  -2.240  -0.030
  263   1H5*    A  25          1H5*        A  25  -1.758 -10.541  -3.398
  264   2H5*    A  25          2H5*        A  25  -1.253  -8.874  -3.061
  265    H4*    A  25           H4*        A  25  -0.793 -10.146  -5.740
  266    H3*    A  25           H3*        A  25   0.806 -10.664  -3.274
  267    H2*    A  25           H2*        A  25   2.869 -10.229  -4.430
  268   2HO*    A  25          2HO*        A  25   1.378 -11.027  -6.528
  269    H1*    A  25           H1*        A  25   2.006  -7.988  -5.836
  270    H8     A  25           H8         A  25   0.332  -7.756  -2.524
  271   1H6     A  25          1H6         A  25   5.462  -4.990  -0.454
  272   2H6     A  25          2H6         A  25   3.782  -5.325  -0.097
  273    H2     A  25           H2         A  25   6.420  -6.921  -4.364
  274   1H5*    G  26          1H5*        G  26   3.925 -13.122  -5.554
  275   2H5*    G  26          2H5*        G  26   4.365 -13.867  -4.005
  276    H4*    G  26           H4*        G  26   5.821 -11.982  -5.209
  277    H3*    G  26           H3*        G  26   5.640 -12.786  -2.365
  278    H2*    G  26           H2*        G  26   6.637 -10.762  -1.560
  279   2HO*    G  26          2HO*        G  26   7.839 -10.912  -3.961
  280    H1*    G  26           H1*        G  26   5.417  -8.970  -3.279
  281    H8     G  26           H8         G  26   2.589 -11.109  -2.820
  282    H1     G  26           H1         G  26   3.799  -7.728   2.464
  283   1H2     G  26          1H2         G  26   5.588  -7.029   2.545
  284   2H2     G  26          2H2         G  26   6.896  -7.126   1.496
  285   1H5*    C  27          1H5*        C  27  10.024 -10.841  -2.759
  286   2H5*    C  27          2H5*        C  27  10.771 -12.431  -2.505
  287    H4*    C  27           H4*        C  27  11.859 -10.914  -1.061
  288    H3*    C  27           H3*        C  27  10.005 -12.813   0.320
  289    H2*    C  27           H2*        C  27  10.434 -11.776   2.429
  290   2HO*    C  27          2HO*        C  27  12.289 -10.786   2.796
  291    H1*    C  27           H1*        C  27  10.251  -9.151   1.536
  292   1H4     C  27          1H4         C  27   4.428 -10.692   3.415
  293   2H4     C  27          2H4         C  27   3.941 -11.444   2.027
  294    H5     C  27           H5         C  27   5.805 -11.776   0.177
  295    H6     C  27           H6         C  27   8.125 -11.320  -0.393
  296   1H5*    G  28          1H5*        G  28  13.073 -12.390   2.637
  297   2H5*    G  28          2H5*        G  28  13.884 -13.893   3.117
  298    H4*    G  28           H4*        G  28  13.488 -12.692   5.097
  299    H3*    G  28           H3*        G  28  11.565 -14.980   4.777
  300    H2*    G  28           H2*        G  28  10.514 -14.353   6.836
  301   2HO*    G  28          2HO*        G  28  11.637 -13.392   8.375
  302    H1*    G  28           H1*        G  28  10.654 -11.573   6.397
  303    H8     G  28           H8         G  28   9.548 -13.157   3.215
  304    H1     G  28           H1         G  28   4.879 -12.484   7.566
  305   1H2     G  28          1H2         G  28   5.705 -12.034   9.510
  306   2H2     G  28          2H2         G  28   7.426 -11.882   9.782
  307   1H5*    C  29          1H5*        C  29  12.860 -15.061   8.721
  308   2H5*    C  29          2H5*        C  29  13.640 -16.623   9.042
  309    H4*    C  29           H4*        C  29  12.241 -16.320  10.858
  310    H3*    C  29           H3*        C  29  11.013 -18.180   8.861
  311    H2*    C  29           H2*        C  29   9.020 -18.336  10.183
  312   2HO*    C  29          2HO*        C  29  10.762 -17.870  12.155
  313    H1*    C  29           H1*        C  29   8.892 -15.620  10.899
  314   1H4     C  29          1H4         C  29   5.029 -15.856   5.942
  315   2H4     C  29          2H4         C  29   6.172 -15.664   4.766
  316    H5     C  29           H5         C  29   8.699 -15.662   5.595
  317    H6     C  29           H6         C  29  10.131 -15.948   7.551
  318   1H5*    C  30          1H5*        C  30  10.278 -20.054  12.447
  319   2H5*    C  30          2H5*        C  30  11.173 -21.587  12.489
  320    H4*    C  30           H4*        C  30   9.037 -22.147  13.215
  321    H3*    C  30           H3*        C  30   9.444 -22.881  10.337
  322    H2*    C  30           H2*        C  30   7.197 -23.621  10.160
  323   2HO*    C  30          2HO*        C  30   7.545 -24.404  12.601
  324    H1*    C  30           H1*        C  30   6.040 -21.586  11.733
  325   1H4     C  30          1H4         C  30   5.095 -19.825   5.778
  326   2H4     C  30          2H4         C  30   6.668 -19.560   5.332
  327    H5     C  30           H5         C  30   8.498 -20.174   7.158
  328    H6     C  30           H6         C  30   8.827 -20.925   9.441
  329    H3T    C  30           H3T        C  30  10.466 -24.001  11.987
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -4.093 -20.651   4.162
    2   2H5*    G   1          2H5*        G   1  -4.987 -19.121   4.093
    3    H4*    G   1           H4*        G   1  -4.969 -19.674   6.339
    4    H3*    G   1           H3*        G   1  -2.905 -17.587   5.750
    5    H2*    G   1           H2*        G   1  -2.200 -17.628   8.058
    6   2HO*    G   1          2HO*        G   1  -4.704 -18.550   8.402
    7    H1*    G   1           H1*        G   1  -2.047 -20.383   8.243
    8    H8     G   1           H8         G   1  -1.298 -18.887   4.792
    9    H1     G   1           H1         G   1   3.755 -19.943   8.583
   10   1H2     G   1          1H2         G   1   3.277 -20.500  10.348
   11   2H2     G   1          2H2         G   1   1.793 -20.735  11.106
   12    H5T    G   1           H5T        G   1  -2.315 -19.659   3.584
   13   1H5*    G   2          1H5*        G   2  -4.526 -16.738   9.189
   14   2H5*    G   2          2H5*        G   2  -5.202 -15.104   9.333
   15    H4*    G   2           H4*        G   2  -3.855 -15.402  11.221
   16    H3*    G   2           H3*        G   2  -2.513 -13.674   9.169
   17    H2*    G   2           H2*        G   2  -0.576 -13.510  10.589
   18   2HO*    G   2          2HO*        G   2  -2.404 -13.949  12.489
   19    H1*    G   2           H1*        G   2  -0.486 -16.216  11.258
   20    H8     G   2           H8         G   2  -1.619 -15.530   7.685
   21    H1     G   2           H1         G   2   4.699 -16.117   8.559
   22   1H2     G   2          1H2         G   2   5.206 -16.187  10.388
   23   2H2     G   2          2H2         G   2   4.323 -16.138  11.821
   24   1H5*    U   3          1H5*        U   3  -1.707 -12.097  12.640
   25   2H5*    U   3          2H5*        U   3  -2.158 -10.389  12.814
   26    H4*    U   3           H4*        U   3   0.053 -10.483  13.518
   27    H3*    U   3           H3*        U   3  -0.134  -9.433  10.720
   28    H2*    U   3           H2*        U   3   2.265  -9.297  10.600
   29   2HO*    U   3          2HO*        U   3   1.995  -9.104  13.264
   30    H1*    U   3           H1*        U   3   2.751 -11.802  11.698
   31    H3     U   3           H3         U   3   3.471 -12.720   7.328
   32    H5     U   3           H5         U   3  -0.682 -12.338   7.608
   33    H6     U   3           H6         U   3  -0.399 -11.592   9.877
   34   1H5*    G   4          1H5*        G   4   2.583  -7.149  12.762
   35   2H5*    G   4          2H5*        G   4   2.325  -5.412  12.512
   36    H4*    G   4           H4*        G   4   4.591  -5.827  12.050
   37    H3*    G   4           H3*        G   4   3.028  -5.426   9.514
   38    H2*    G   4           H2*        G   4   5.037  -5.796   8.256
   39   2HO*    G   4          2HO*        G   4   6.920  -5.314   9.086
   40    H1*    G   4           H1*        G   4   5.946  -7.949   9.814
   41    H8     G   4           H8         G   4   2.208  -8.078   9.260
   42    H1     G   4           H1         G   4   5.798 -10.608   4.601
   43   1H2     G   4          1H2         G   4   7.640 -10.175   4.748
   44   2H2     G   4          2H2         G   4   8.514  -9.280   5.877
   45   1H5*    C   5          1H5*        C   5   6.439  -3.370   9.414
   46   2H5*    C   5          2H5*        C   5   6.438  -1.762   8.664
   47    H4*    C   5           H4*        C   5   8.100  -3.147   7.623
   48    H3*    C   5           H3*        C   5   5.765  -2.426   5.874
   49    H2*    C   5           H2*        C   5   6.704  -3.717   4.106
   50   2HO*    C   5          2HO*        C   5   9.020  -3.073   5.438
   51    H1*    C   5           H1*        C   5   7.793  -5.769   5.751
   52   1H4     C   5          1H4         C   5   2.736  -8.388   3.097
   53   2H4     C   5          2H4         C   5   1.629  -7.882   4.218
   54    H5     C   5           H5         C   5   2.524  -6.174   6.037
   55    H6     C   5           H6         C   5   4.482  -4.892   6.742
   56   1H5*    G   6          1H5*        G   6   8.826  -2.707   3.327
   57   2H5*    G   6          2H5*        G   6   8.752  -1.363   2.170
   58    H4*    G   6           H4*        G   6   8.512  -3.497   1.052
   59    H3*    G   6           H3*        G   6   6.188  -1.609   0.993
   60    H2*    G   6           H2*        G   6   4.859  -3.187  -0.203
   61   2HO*    G   6          2HO*        G   6   6.862  -3.909  -1.452
   62    H1*    G   6           H1*        G   6   5.571  -5.406   1.313
   63    H8     G   6           H8         G   6   5.376  -2.241   3.339
   64    H1     G   6           H1         G   6  -0.218  -5.288   2.689
   65   1H2     G   6          1H2         G   6  -0.071  -6.831   1.117
   66   2H2     G   6          2H2         G   6   1.420  -7.105   0.248
   67   1H5*    A   7          1H5*        A   7   8.380  -0.430  -3.782
   68   2H5*    A   7          2H5*        A   7   7.246  -0.981  -2.533
   69    H4*    A   7           H4*        A   7   8.449  -2.766  -4.645
   70    H3*    A   7           H3*        A   7   5.857  -1.232  -4.718
   71    H2*    A   7           H2*        A   7   4.843  -3.101  -5.788
   72   2HO*    A   7          2HO*        A   7   5.977  -4.365  -7.080
   73    H1*    A   7           H1*        A   7   6.273  -5.072  -4.298
   74    H8     A   7           H8         A   7   4.861  -2.639  -1.885
   75   1H6     A   7          1H6         A   7  -0.546  -5.612  -2.495
   76   2H6     A   7          2H6         A   7   0.329  -4.433  -1.543
   77    H2     A   7           H2         A   7   2.180  -7.016  -5.737
   78   1H5*    A   8          1H5*        A   8   3.591   0.830  -6.707
   79   2H5*    A   8          2H5*        A   8   4.423  -0.254  -5.577
   80    H4*    A   8           H4*        A   8   4.035  -1.651  -8.016
   81    H3*    A   8           H3*        A   8   1.609  -0.086  -7.221
   82    H2*    A   8           H2*        A   8   0.236  -2.043  -7.473
   83   2HO*    A   8          2HO*        A   8   2.149  -2.687  -9.218
   84    H1*    A   8           H1*        A   8   1.978  -3.807  -6.193
   85    H8     A   8           H8         A   8   2.655  -1.341  -3.832
   86   1H6     A   8          1H6         A   8  -3.178  -1.619  -1.762
   87   2H6     A   8          2H6         A   8  -1.653  -1.007  -1.239
   88    H2     A   8           H2         A   8  -3.105  -3.481  -5.694
   89   1H5*    G   9          1H5*        G   9   0.082  -1.610 -10.150
   90   2H5*    G   9          2H5*        G   9  -0.550  -0.567 -11.439
   91    H4*    G   9           H4*        G   9  -2.393  -1.786 -10.751
   92    H3*    G   9           H3*        G   9  -2.450   0.927  -9.463
   93    H2*    G   9           H2*        G   9  -4.502   0.306  -8.345
   94   2HO*    G   9          2HO*        G   9  -4.688  -1.352 -10.439
   95    H1*    G   9           H1*        G   9  -3.597  -2.197  -7.531
   96    H8     G   9           H8         G   9  -0.524  -0.257  -7.266
   97    H1     G   9           H1         G   9  -4.728   1.133  -2.644
   98   1H2     G   9          1H2         G   9  -6.496   0.570  -3.022
   99   2H2     G   9          2H2         G   9  -7.180  -0.263  -4.313
  100   1H5*    G  10          1H5*        G  10  -5.590   0.162 -10.555
  101   2H5*    G  10          2H5*        G  10  -6.897   0.572 -11.682
  102    H4*    G  10           H4*        G  10  -8.062   1.064  -9.859
  103    H3*    G  10           H3*        G  10  -6.312   3.514 -10.001
  104    H2*    G  10           H2*        G  10  -7.270   4.226  -7.926
  105   2HO*    G  10          2HO*        G  10  -9.309   3.798  -7.583
  106    H1*    G  10           H1*        G  10  -7.401   1.611  -6.801
  107    H8     G  10           H8         G  10  -4.009   2.029  -8.210
  108    H1     G  10           H1         G  10  -4.870   4.998  -2.609
  109   1H2     G  10          1H2         G  10  -6.715   5.099  -2.083
  110   2H2     G  10          2H2         G  10  -8.135   4.558  -2.806
  111   1H5*    G  11          1H5*        G  11 -10.170   4.229  -8.950
  112   2H5*    G  11          2H5*        G  11 -10.956   5.534  -9.860
  113    H4*    G  11           H4*        G  11 -11.475   5.859  -7.583
  114    H3*    G  11           H3*        G  11  -9.476   7.838  -8.621
  115    H2*    G  11           H2*        G  11  -9.311   8.832  -6.459
  116   2HO*    G  11          2HO*        G  11 -11.186   8.981  -5.466
  117    H1*    G  11           H1*        G  11  -9.455   6.437  -5.006
  118    H8     G  11           H8         G  11  -7.088   6.002  -7.886
  119    H1     G  11           H1         G  11  -4.637   8.755  -2.654
  120   1H2     G  11          1H2         G  11  -5.975   9.250  -1.368
  121   2H2     G  11          2H2         G  11  -7.657   9.122  -1.393
  122   1H5*    C  12          1H5*        C  12 -12.459   9.654  -6.314
  123   2H5*    C  12          2H5*        C  12 -13.125  11.063  -7.161
  124    H4*    C  12           H4*        C  12 -12.726  11.869  -5.041
  125    H3*    C  12           H3*        C  12 -10.395  12.588  -6.808
  126    H2*    C  12           H2*        C  12  -9.477  13.792  -4.923
  127   2HO*    C  12          2HO*        C  12 -11.936  14.201  -4.307
  128    H1*    C  12           H1*        C  12 -10.030  11.753  -3.062
  129   1H4     C  12          1H4         C  12  -4.099  10.917  -5.017
  130   2H4     C  12          2H4         C  12  -4.369  10.372  -6.546
  131    H5     C  12           H5         C  12  -6.969  10.390  -7.264
  132    H6     C  12           H6         C  12  -9.228  10.661  -6.428
  133   1H5*    G  13          1H5*        G  13 -11.723  17.411  -7.693
  134   2H5*    G  13          2H5*        G  13  -9.984  17.512  -8.028
  135    H4*    G  13           H4*        G  13 -11.372  18.695  -5.937
  136    H3*    G  13           H3*        G  13  -8.529  18.517  -6.733
  137    H2*    G  13           H2*        G  13  -7.677  18.792  -4.528
  138   2HO*    G  13          2HO*        G  13  -8.753  19.936  -3.053
  139    H1*    G  13           H1*        G  13  -9.559  17.316  -3.127
  140    H8     G  13           H8         G  13  -8.450  15.797  -6.500
  141    H1     G  13           H1         G  13  -5.164  13.977  -1.341
  142   1H2     G  13          1H2         G  13  -5.850  15.042   0.444
  143   2H2     G  13          2H2         G  13  -7.127  16.238   0.360
  144   1H5*    U  14          1H5*        U  14  -6.533  19.807  -5.757
  145   2H5*    U  14          2H5*        U  14  -6.659  20.658  -4.206
  146    H4*    U  14           H4*        U  14  -5.055  22.277  -4.860
  147    H3*    U  14           H3*        U  14  -5.705  22.334  -7.383
  148    H2*    U  14           H2*        U  14  -5.436  19.944  -7.787
  149   2HO*    U  14          2HO*        U  14  -3.211  21.475  -8.606
  150    H1*    U  14           H1*        U  14  -2.628  20.075  -6.564
  151    H3     U  14           H3         U  14  -2.671  15.680  -7.748
  152    H5     U  14           H5         U  14  -5.011  16.100  -4.298
  153    H6     U  14           H6         U  14  -5.252  18.412  -4.824
  154   1H5*    C  15          1H5*        C  15  -1.710  22.907  -2.987
  155   2H5*    C  15          2H5*        C  15  -1.093  23.974  -4.263
  156    H4*    C  15           H4*        C  15   0.666  22.653  -4.375
  157    H3*    C  15           H3*        C  15  -1.334  21.105  -5.865
  158    H2*    C  15           H2*        C  15  -0.353  18.980  -5.534
  159   2HO*    C  15          2HO*        C  15   1.951  20.343  -4.551
  160    H1*    C  15           H1*        C  15   0.515  19.209  -2.930
  161   1H4     C  15          1H4         C  15  -5.830  18.328  -1.861
  162   2H4     C  15          2H4         C  15  -5.377  16.788  -2.559
  163    H5     C  15           H5         C  15  -3.197  16.400  -3.553
  164    H6     C  15           H6         C  15  -1.063  17.382  -4.103
  165   1H5*    G  16          1H5*        G  16   2.124  22.866  -9.050
  166   2H5*    G  16          2H5*        G  16   2.060  21.858 -10.507
  167    H4*    G  16           H4*        G  16   3.563  20.455  -9.716
  168    H3*    G  16           H3*        G  16   1.847  20.228  -7.263
  169    H2*    G  16           H2*        G  16   3.725  19.351  -6.042
  170   2HO*    G  16          2HO*        G  16   4.409  18.130  -8.020
  171    H1*    G  16           H1*        G  16   5.606  21.162  -7.054
  172    H8     G  16           H8         G  16   1.954  21.792  -5.924
  173    H1     G  16           H1         G  16   6.544  24.266  -2.199
  174   1H2     G  16          1H2         G  16   8.531  23.776  -3.004
  175   2H2     G  16          2H2         G  16   8.734  22.844  -4.471
  176   1H5*    U  17          1H5*        U  17  -0.477  15.689  -6.568
  177   2H5*    U  17          2H5*        U  17  -0.576  17.440  -6.321
  178    H4*    U  17           H4*        U  17   1.924  17.214  -5.670
  179    H3*    U  17           H3*        U  17   1.574  14.560  -6.206
  180    H2*    U  17           H2*        U  17   0.216  13.910  -4.398
  181   2HO*    U  17          2HO*        U  17   2.203  14.210  -2.544
  182    H1*    U  17           H1*        U  17   1.464  16.021  -2.572
  183    H3     U  17           H3         U  17  -1.848  16.577   0.320
  184    H5     U  17           H5         U  17  -3.558  14.124  -2.599
  185    H6     U  17           H6         U  17  -1.519  14.283  -3.843
  186   1H5*    C  18          1H5*        C  18   2.780  16.183  -3.533
  187   2H5*    C  18          2H5*        C  18   2.630  17.927  -3.270
  188    H4*    C  18           H4*        C  18   5.145  16.608  -2.438
  189    H3*    C  18           H3*        C  18   3.015  15.247  -1.550
  190    H2*    C  18           H2*        C  18   1.766  16.910  -0.457
  191   2HO*    C  18          2HO*        C  18   3.922  16.498   1.356
  192    H1*    C  18           H1*        C  18   4.161  18.496   0.493
  193   1H4     C  18          1H4         C  18  -0.128  23.130   0.286
  194   2H4     C  18          2H4         C  18  -1.282  22.082  -0.513
  195    H5     C  18           H5         C  18  -0.761  19.824  -1.225
  196    H6     C  18           H6         C  18   1.021  18.198  -1.443
  197   1H5*    G  19          1H5*        G  19   3.108  15.130   0.985
  198   2H5*    G  19          2H5*        G  19   3.269  14.111   2.416
  199    H4*    G  19           H4*        G  19   0.969  14.650   1.996
  200    H3*    G  19           H3*        G  19   1.649  11.769   1.768
  201    H2*    G  19           H2*        G  19  -0.279  11.249   0.609
  202   2HO*    G  19          2HO*        G  19  -1.444  11.850   2.606
  203    H1*    G  19           H1*        G  19  -1.065  14.131   0.138
  204    H8     G  19           H8         G  19   1.434  12.733  -2.141
  205    H1     G  19           H1         G  19  -4.525  10.913  -3.676
  206   1H2     G  19          1H2         G  19  -5.825  11.381  -2.389
  207   2H2     G  19          2H2         G  19  -5.728  12.116  -0.874
  208   1H5*    C  20          1H5*        C  20  -1.794  12.755   4.328
  209   2H5*    C  20          2H5*        C  20  -1.852  11.650   5.710
  210    H4*    C  20           H4*        C  20  -4.037  11.790   4.980
  211    H3*    C  20           H3*        C  20  -2.953   9.237   3.793
  212    H2*    C  20           H2*        C  20  -5.201   8.885   2.957
  213   2HO*    C  20          2HO*        C  20  -6.889   9.920   3.788
  214    H1*    C  20           H1*        C  20  -5.455  11.510   2.019
  215   1H4     C  20          1H4         C  20  -3.377   8.184  -2.906
  216   2H4     C  20          2H4         C  20  -1.763   8.381  -2.662
  217    H5     C  20           H5         C  20  -1.109   9.506  -0.313
  218    H6     C  20           H6         C  20  -2.025  10.532   1.705
  219   1H5*    C  21          1H5*        C  21  -6.493   8.714   5.140
  220   2H5*    C  21          2H5*        C  21  -6.780   7.250   6.099
  221    H4*    C  21           H4*        C  21  -8.449   7.382   4.410
  222    H3*    C  21           H3*        C  21  -6.439   5.213   3.816
  223    H2*    C  21           H2*        C  21  -7.741   4.679   1.862
  224   2HO*    C  21          2HO*        C  21  -9.718   5.666   3.366
  225    H1*    C  21           H1*        C  21  -8.216   7.375   1.153
  226   1H4     C  21          1H4         C  21  -3.486   5.279  -2.463
  227   2H4     C  21          2H4         C  21  -2.247   5.830  -1.510
  228    H5     C  21           H5         C  21  -2.965   6.849   0.832
  229    H6     C  21           H6         C  21  -4.873   7.317   2.276
  230   1H5*    C  22          1H5*        C  22  -9.869   3.920   2.821
  231   2H5*    C  22          2H5*        C  22 -10.532   2.860   4.080
  232    H4*    C  22           H4*        C  22 -11.319   1.720   2.324
  233    H3*    C  22           H3*        C  22  -8.532   0.681   2.661
  234    H2*    C  22           H2*        C  22  -8.698  -0.556   0.631
  235   2HO*    C  22          2HO*        C  22 -11.289  -0.590   1.287
  236    H1*    C  22           H1*        C  22  -9.964   1.423  -0.874
  237   1H4     C  22          1H4         C  22  -3.814   2.028  -2.047
  238   2H4     C  22          2H4         C  22  -3.353   2.730  -0.619
  239    H5     C  22           H5         C  22  -5.277   2.983   1.201
  240    H6     C  22           H6         C  22  -7.640   2.639   1.629
  241   1H5*    C  23          1H5*        C  23 -10.423  -2.343   1.403
  242   2H5*    C  23          2H5*        C  23  -9.928  -3.915   2.058
  243    H4*    C  23           H4*        C  23  -9.452  -3.738  -0.320
  244    H3*    C  23           H3*        C  23  -7.041  -3.923   1.476
  245    H2*    C  23           H2*        C  23  -5.694  -4.062  -0.524
  246   2HO*    C  23          2HO*        C  23  -7.002  -5.230  -1.949
  247    H1*    C  23           H1*        C  23  -6.986  -1.903  -1.735
  248   1H4     C  23          1H4         C  23  -2.040   0.535   1.449
  249   2H4     C  23          2H4         C  23  -3.107   0.906   2.786
  250    H5     C  23           H5         C  23  -5.416   0.166   2.862
  251    H6     C  23           H6         C  23  -7.154  -1.066   1.676
  252   1H5*    G  24          1H5*        G  24  -5.945  -8.049  -0.572
  253   2H5*    G  24          2H5*        G  24  -5.795  -6.392   0.043
  254    H4*    G  24           H4*        G  24  -5.192  -6.863  -2.822
  255    H3*    G  24           H3*        G  24  -3.926  -8.670  -1.350
  256    H2*    G  24           H2*        G  24  -3.050  -7.226   0.364
  257   2HO*    G  24          2HO*        G  24  -0.872  -6.445  -0.782
  258    H1*    G  24           H1*        G  24  -2.273  -5.128  -1.716
  259    H8     G  24           H8         G  24  -4.879  -4.942   1.078
  260    H1     G  24           H1         G  24   0.456  -1.514   2.045
  261   1H2     G  24          1H2         G  24   1.950  -1.969   0.499
  262   2H2     G  24          2H2         G  24   1.628  -3.123  -0.773
  263   1H5*    A  25          1H5*        A  25  -2.393 -11.852  -4.107
  264   2H5*    A  25          2H5*        A  25  -1.424 -12.160  -2.654
  265    H4*    A  25           H4*        A  25  -0.528 -11.726  -5.279
  266    H3*    A  25           H3*        A  25   0.903 -12.063  -2.653
  267    H2*    A  25           H2*        A  25   2.946 -11.429  -3.762
  268   2HO*    A  25          2HO*        A  25   1.770 -12.554  -5.830
  269    H1*    A  25           H1*        A  25   1.758  -9.377  -5.310
  270    H8     A  25           H8         A  25   0.251  -8.697  -2.090
  271   1H6     A  25          1H6         A  25   5.541  -5.992  -0.364
  272   2H6     A  25          2H6         A  25   3.838  -6.185   0.013
  273    H2     A  25           H2         A  25   6.398  -8.533  -3.930
  274   1H5*    G  26          1H5*        G  26   3.560 -14.259  -4.854
  275   2H5*    G  26          2H5*        G  26   4.327 -15.410  -3.743
  276    H4*    G  26           H4*        G  26   5.798 -13.567  -4.530
  277    H3*    G  26           H3*        G  26   5.422 -14.187  -1.644
  278    H2*    G  26           H2*        G  26   6.614 -12.225  -0.955
  279   2HO*    G  26          2HO*        G  26   8.304 -12.444  -2.492
  280    H1*    G  26           H1*        G  26   5.578 -10.463  -2.828
  281    H8     G  26           H8         G  26   2.635 -12.462  -2.084
  282    H1     G  26           H1         G  26   4.060  -8.365   2.611
  283   1H2     G  26          1H2         G  26   5.851  -7.701   2.536
  284   2H2     G  26          2H2         G  26   7.124  -7.975   1.475
  285   1H5*    C  27          1H5*        C  27  10.047 -12.588  -2.285
  286   2H5*    C  27          2H5*        C  27  10.615 -14.219  -1.874
  287    H4*    C  27           H4*        C  27  11.904 -12.687  -0.618
  288    H3*    C  27           H3*        C  27   9.898 -14.212   0.998
  289    H2*    C  27           H2*        C  27  10.531 -13.016   2.974
  290   2HO*    C  27          2HO*        C  27  12.852 -12.813   1.667
  291    H1*    C  27           H1*        C  27  10.583 -10.496   1.801
  292   1H4     C  27          1H4         C  27   4.676 -11.101   3.923
  293   2H4     C  27          2H4         C  27   4.086 -12.042   2.702
  294    H5     C  27           H5         C  27   5.856 -12.849   0.907
  295    H6     C  27           H6         C  27   8.190 -12.709   0.232
  296   1H5*    G  28          1H5*        G  28  13.096 -13.900   3.166
  297   2H5*    G  28          2H5*        G  28  13.752 -15.428   3.786
  298    H4*    G  28           H4*        G  28  13.590 -13.972   5.625
  299    H3*    G  28           H3*        G  28  11.426 -16.056   5.648
  300    H2*    G  28           H2*        G  28  10.541 -15.084   7.652
  301   2HO*    G  28          2HO*        G  28  13.098 -14.451   8.018
  302    H1*    G  28           H1*        G  28  10.946 -12.403   6.884
  303    H8     G  28           H8         G  28   9.560 -14.260   3.957
  304    H1     G  28           H1         G  28   5.152 -12.448   8.252
  305   1H2     G  28          1H2         G  28   6.090 -11.823  10.092
  306   2H2     G  28          2H2         G  28   7.827 -11.824  10.306
  307   1H5*    C  29          1H5*        C  29  12.939 -15.890   9.538
  308   2H5*    C  29          2H5*        C  29  13.577 -17.490   9.966
  309    H4*    C  29           H4*        C  29  12.332 -16.883  11.815
  310    H3*    C  29           H3*        C  29  10.808 -18.770  10.066
  311    H2*    C  29           H2*        C  29   8.883 -18.595  11.479
  312   2HO*    C  29          2HO*        C  29  10.763 -18.135  13.328
  313    H1*    C  29           H1*        C  29   9.065 -15.830  11.944
  314   1H4     C  29          1H4         C  29   4.969 -16.049   7.177
  315   2H4     C  29          2H4         C  29   6.070 -16.113   5.948
  316    H5     C  29           H5         C  29   8.614 -16.351   6.676
  317    H6     C  29           H6         C  29  10.100 -16.605   8.595
  318   1H5*    C  30          1H5*        C  30  10.104 -20.226  13.850
  319   2H5*    C  30          2H5*        C  30  10.846 -21.833  13.996
  320    H4*    C  30           H4*        C  30   8.715 -22.104  14.880
  321    H3*    C  30           H3*        C  30   8.872 -23.129  12.069
  322    H2*    C  30           H2*        C  30   6.556 -23.643  12.074
  323   2HO*    C  30          2HO*        C  30   6.966 -24.246  14.552
  324    H1*    C  30           H1*        C  30   5.700 -21.366  13.501
  325   1H4     C  30          1H4         C  30   4.609 -20.033   7.459
  326   2H4     C  30          2H4         C  30   6.173 -19.980   6.918
  327    H5     C  30           H5         C  30   8.028 -20.630   8.706
  328    H6     C  30           H6         C  30   8.406 -21.213  11.029
  329    H3T    C  30           H3T        C  30   9.877 -24.206  13.744
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -4.045 -15.989  -2.553
    2   2H5*    G   1          2H5*        G   1  -4.722 -14.569  -1.735
    3    H4*    G   1           H4*        G   1  -5.071 -16.307  -0.251
    4    H3*    G   1           H3*        G   1  -2.707 -14.666   0.572
    5    H2*    G   1           H2*        G   1  -2.313 -16.153   2.430
    6   2HO*    G   1          2HO*        G   1  -4.925 -16.599   2.151
    7    H1*    G   1           H1*        G   1  -2.538 -18.488   0.967
    8    H8     G   1           H8         G   1  -1.153 -15.410  -0.869
    9    H1     G   1           H1         G   1   3.161 -19.440   1.607
   10   1H2     G   1          1H2         G   1   2.382 -20.836   2.655
   11   2H2     G   1          2H2         G   1   0.791 -21.191   3.075
   12    H5T    G   1           H5T        G   1  -2.620 -13.985  -1.118
   13   1H5*    G   2          1H5*        G   2  -4.578 -15.694   3.814
   14   2H5*    G   2          2H5*        G   2  -5.106 -14.350   4.846
   15    H4*    G   2           H4*        G   2  -4.023 -15.845   6.274
   16    H3*    G   2           H3*        G   2  -2.292 -13.486   5.620
   17    H2*    G   2           H2*        G   2  -0.529 -14.413   6.964
   18   2HO*    G   2          2HO*        G   2  -1.060 -15.604   8.635
   19    H1*    G   2           H1*        G   2  -0.790 -17.025   6.012
   20    H8     G   2           H8         G   2  -1.330 -14.199   3.481
   21    H1     G   2           H1         G   2   4.625 -16.517   3.954
   22   1H2     G   2          1H2         G   2   4.842 -17.753   5.374
   23   2H2     G   2          2H2         G   2   3.777 -18.368   6.526
   24   1H5*    U   3          1H5*        U   3  -1.815 -14.185   9.471
   25   2H5*    U   3          2H5*        U   3  -2.156 -12.787  10.510
   26    H4*    U   3           H4*        U   3  -0.074 -13.526  11.213
   27    H3*    U   3           H3*        U   3   0.184 -11.156   9.405
   28    H2*    U   3           H2*        U   3   2.574 -11.287   9.542
   29   2HO*    U   3          2HO*        U   3   3.318 -11.926  11.428
   30    H1*    U   3           H1*        U   3   2.748 -14.032   9.187
   31    H3     U   3           H3         U   3   3.950 -12.799   5.038
   32    H5     U   3           H5         U   3  -0.091 -11.742   5.226
   33    H6     U   3           H6         U   3  -0.072 -12.342   7.556
   34   1H5*    G   4          1H5*        G   4   2.663 -10.642  12.736
   35   2H5*    G   4          2H5*        G   4   2.497  -9.012  13.420
   36    H4*    G   4           H4*        G   4   4.795  -9.369  13.168
   37    H3*    G   4           H3*        G   4   3.733  -7.580  11.003
   38    H2*    G   4           H2*        G   4   5.938  -7.471  10.041
   39   2HO*    G   4          2HO*        G   4   7.571  -7.590  11.387
   40    H1*    G   4           H1*        G   4   6.443 -10.205  10.224
   41    H8     G   4           H8         G   4   2.795  -9.464   9.534
   42    H1     G   4           H1         G   4   6.557  -9.727   4.371
   43   1H2     G   4          1H2         G   4   8.419  -9.780   4.789
   44   2H2     G   4          2H2         G   4   9.268  -9.748   6.239
   45   1H5*    C   5          1H5*        C   5   7.169  -6.115  12.437
   46   2H5*    C   5          2H5*        C   5   7.201  -4.386  12.836
   47    H4*    C   5           H4*        C   5   9.072  -4.795  11.474
   48    H3*    C   5           H3*        C   5   6.879  -3.325  10.068
   49    H2*    C   5           H2*        C   5   8.067  -3.409   8.004
   50   2HO*    C   5          2HO*        C   5  10.182  -3.474   9.688
   51    H1*    C   5           H1*        C   5   9.043  -6.026   8.254
   52   1H4     C   5          1H4         C   5   3.909  -6.700   4.702
   53   2H4     C   5          2H4         C   5   2.788  -6.716   5.922
   54    H5     C   5           H5         C   5   3.710  -6.172   8.343
   55    H6     C   5           H6         C   5   5.720  -5.590   9.603
   56   1H5*    G   6          1H5*        G   6   9.931  -1.991   7.949
   57   2H5*    G   6          2H5*        G   6   9.586  -0.303   7.524
   58    H4*    G   6           H4*        G   6   9.472  -1.936   5.637
   59    H3*    G   6           H3*        G   6   7.293  -0.011   6.269
   60    H2*    G   6           H2*        G   6   5.799  -1.001   4.697
   61   2HO*    G   6          2HO*        G   6   7.648  -1.255   3.153
   62    H1*    G   6           H1*        G   6   6.402  -3.671   5.201
   63    H8     G   6           H8         G   6   6.442  -1.661   8.376
   64    H1     G   6           H1         G   6   0.641  -3.770   6.669
   65   1H2     G   6          1H2         G   6   0.679  -4.486   4.571
   66   2H2     G   6          2H2         G   6   2.157  -4.468   3.645
   67   1H5*    A   7          1H5*        A   7   6.703   3.328   3.418
   68   2H5*    A   7          2H5*        A   7   6.603   1.703   4.125
   69    H4*    A   7           H4*        A   7   8.186   1.977   1.642
   70    H3*    A   7           H3*        A   7   5.257   2.576   1.681
   71    H2*    A   7           H2*        A   7   4.876   1.138  -0.173
   72   2HO*    A   7          2HO*        A   7   6.616   1.635  -1.489
   73    H1*    A   7           H1*        A   7   6.466  -0.972   0.682
   74    H8     A   7           H8         A   7   4.992   0.284   3.781
   75   1H6     A   7          1H6         A   7  -0.381  -2.292   2.128
   76   2H6     A   7          2H6         A   7   0.500  -1.563   3.456
   77    H2     A   7           H2         A   7   2.304  -2.290  -1.432
   78   1H5*    A   8          1H5*        A   8   5.864   3.683  -2.631
   79   2H5*    A   8          2H5*        A   8   4.306   4.478  -2.925
   80    H4*    A   8           H4*        A   8   4.947   2.006  -3.779
   81    H3*    A   8           H3*        A   8   2.314   3.318  -3.331
   82    H2*    A   8           H2*        A   8   1.133   1.240  -3.413
   83   2HO*    A   8          2HO*        A   8   2.984   0.637  -5.128
   84    H1*    A   8           H1*        A   8   2.955  -0.298  -1.969
   85    H8     A   8           H8         A   8   3.281   2.511   0.154
   86   1H6     A   8          1H6         A   8  -2.413   1.477   2.346
   87   2H6     A   8          2H6         A   8  -1.000   2.375   2.759
   88    H2     A   8           H2         A   8  -2.028  -0.772  -1.365
   89   1H5*    G   9          1H5*        G   9  -0.783   3.253  -6.955
   90   2H5*    G   9          2H5*        G   9  -0.942   3.808  -5.280
   91    H4*    G   9           H4*        G   9  -1.813   1.242  -6.531
   92    H3*    G   9           H3*        G   9  -3.078   3.491  -5.124
   93    H2*    G   9           H2*        G   9  -4.378   2.191  -3.618
   94   2HO*    G   9          2HO*        G   9  -3.542  -0.176  -4.955
   95    H1*    G   9           H1*        G   9  -2.502   0.318  -2.960
   96    H8     G   9           H8         G   9  -0.024   2.756  -3.194
   97    H1     G   9           H1         G   9  -4.157   4.387   1.411
   98   1H2     G   9          1H2         G   9  -5.845   3.534   1.265
   99   2H2     G   9          2H2         G   9  -6.478   2.421   0.176
  100   1H5*    G  10          1H5*        G  10  -5.581   0.127  -5.389
  101   2H5*    G  10          2H5*        G  10  -6.919  -0.564  -6.327
  102    H4*    G  10           H4*        G  10  -8.307   0.950  -5.541
  103    H3*    G  10           H3*        G  10  -6.423   3.095  -6.546
  104    H2*    G  10           H2*        G  10  -7.765   4.629  -5.302
  105   2HO*    G  10          2HO*        G  10  -9.711   3.054  -5.998
  106    H1*    G  10           H1*        G  10  -8.220   2.787  -3.152
  107    H8     G  10           H8         G  10  -4.744   3.679  -4.518
  108    H1     G  10           H1         G  10  -6.712   6.886   0.653
  109   1H2     G  10          1H2         G  10  -8.552   6.587   1.070
  110   2H2     G  10          2H2         G  10  -9.734   5.616   0.371
  111   1H5*    G  11          1H5*        G  11 -10.811   3.710  -7.730
  112   2H5*    G  11          2H5*        G  11 -10.806   4.404  -9.363
  113    H4*    G  11           H4*        G  11 -12.414   5.634  -8.250
  114    H3*    G  11           H3*        G  11  -9.845   7.138  -8.403
  115    H2*    G  11           H2*        G  11 -10.726   8.915  -7.056
  116   2HO*    G  11          2HO*        G  11 -12.787   9.311  -7.295
  117    H1*    G  11           H1*        G  11 -11.849   7.318  -5.115
  118    H8     G  11           H8         G  11  -8.861   5.626  -6.619
  119    H1     G  11           H1         G  11  -7.460   9.602  -1.824
  120   1H2     G  11          1H2         G  11  -8.937  10.712  -1.294
  121   2H2     G  11          2H2         G  11 -10.521  10.842  -1.838
  122   1H5*    C  12          1H5*        C  12 -12.537  10.006  -9.003
  123   2H5*    C  12          2H5*        C  12 -12.201  10.955 -10.464
  124    H4*    C  12           H4*        C  12 -12.382  12.510  -8.728
  125    H3*    C  12           H3*        C  12  -9.496  12.049  -9.437
  126    H2*    C  12           H2*        C  12  -8.870  13.622  -7.720
  127   2HO*    C  12          2HO*        C  12 -11.268  14.614  -8.268
  128    H1*    C  12           H1*        C  12 -10.629  12.622  -5.793
  129   1H4     C  12          1H4         C  12  -5.215   9.489  -4.642
  130   2H4     C  12          2H4         C  12  -5.517   8.279  -5.716
  131    H5     C  12           H5         C  12  -7.620   8.499  -7.276
  132    H6     C  12           H6         C  12  -9.549   9.875  -7.815
  133   1H5*    G  13          1H5*        G  13  -8.112  17.070  -9.793
  134   2H5*    G  13          2H5*        G  13  -8.343  16.556 -11.474
  135    H4*    G  13           H4*        G  13  -6.000  17.080 -10.916
  136    H3*    G  13           H3*        G  13  -6.707  14.325 -11.874
  137    H2*    G  13           H2*        G  13  -4.424  13.654 -11.654
  138   2HO*    G  13          2HO*        G  13  -4.021  16.415 -11.726
  139    H1*    G  13           H1*        G  13  -3.994  14.848  -9.195
  140    H8     G  13           H8         G  13  -7.456  13.600  -9.098
  141    H1     G  13           H1         G  13  -3.178   8.988  -8.062
  142   1H2     G  13          1H2         G  13  -1.136   9.676  -8.658
  143   2H2     G  13          2H2         G  13  -0.835  11.286  -9.239
  144   1H5*    U  14          1H5*        U  14  -5.007  19.760 -11.768
  145   2H5*    U  14          2H5*        U  14  -4.120  19.550 -13.289
  146    H4*    U  14           H4*        U  14  -2.348  20.095 -12.084
  147    H3*    U  14           H3*        U  14  -2.281  17.382 -12.209
  148    H2*    U  14           H2*        U  14  -3.107  16.851 -10.047
  149   2HO*    U  14          2HO*        U  14  -1.397  16.371  -8.830
  150    H1*    U  14           H1*        U  14  -1.767  19.324  -8.850
  151    H3     U  14           H3         U  14  -4.831  20.150  -5.590
  152    H5     U  14           H5         U  14  -5.404  16.166  -6.777
  153    H6     U  14           H6         U  14  -4.081  16.604  -8.682
  154   1H5*    C  15          1H5*        C  15   0.080  14.487 -11.504
  155   2H5*    C  15          2H5*        C  15  -1.079  15.352 -10.478
  156    H4*    C  15           H4*        C  15   1.614  14.619  -9.403
  157    H3*    C  15           H3*        C  15  -0.639  12.670  -9.806
  158    H2*    C  15           H2*        C  15  -0.135  11.732  -7.638
  159   2HO*    C  15          2HO*        C  15   1.750  12.283  -6.547
  160    H1*    C  15           H1*        C  15   0.198  14.204  -6.359
  161   1H4     C  15          1H4         C  15  -6.307  13.878  -6.551
  162   2H4     C  15          2H4         C  15  -5.990  12.355  -5.750
  163    H5     C  15           H5         C  15  -3.738  11.480  -5.471
  164    H6     C  15           H6         C  15  -1.388  11.877  -5.916
  165   1H5*    G  16          1H5*        G  16   2.317   8.617 -11.075
  166   2H5*    G  16          2H5*        G  16   0.836   7.809 -10.526
  167    H4*    G  16           H4*        G  16   2.296   6.826  -9.122
  168    H3*    G  16           H3*        G  16   1.365   9.296  -7.720
  169    H2*    G  16           H2*        G  16   2.991   9.038  -6.001
  170   2HO*    G  16          2HO*        G  16   2.488   6.586  -6.157
  171    H1*    G  16           H1*        G  16   5.099   8.099  -7.626
  172    H8     G  16           H8         G  16   3.042  11.016  -8.966
  173    H1     G  16           H1         G  16   8.147  12.665  -5.460
  174   1H2     G  16          1H2         G  16   9.048  10.887  -4.541
  175   2H2     G  16          2H2         G  16   8.405   9.279  -4.791
  176   1H5*    U  17          1H5*        U  17  -0.517   8.674  -4.783
  177   2H5*    U  17          2H5*        U  17  -1.522  10.117  -5.015
  178    H4*    U  17           H4*        U  17   1.411  10.096  -5.645
  179    H3*    U  17           H3*        U  17   0.583   9.635  -3.080
  180    H2*    U  17           H2*        U  17  -0.518  11.655  -2.684
  181   2HO*    U  17          2HO*        U  17   0.876  12.364  -1.229
  182    H1*    U  17           H1*        U  17   1.442  13.158  -4.460
  183    H3     U  17           H3         U  17  -0.843  16.958  -4.614
  184    H5     U  17           H5         U  17  -3.814  14.179  -3.688
  185    H6     U  17           H6         U  17  -2.126  12.455  -3.767
  186   1H5*    C  18          1H5*        C  18   2.352  14.081  -3.474
  187   2H5*    C  18          2H5*        C  18   4.078  14.248  -3.829
  188    H4*    C  18           H4*        C  18   4.278  14.177  -1.230
  189    H3*    C  18           H3*        C  18   1.643  13.962  -1.050
  190    H2*    C  18           H2*        C  18   0.974  15.908  -2.235
  191   2HO*    C  18          2HO*        C  18   0.098  16.805  -0.519
  192    H1*    C  18           H1*        C  18   3.233  17.580  -1.060
  193   1H4     C  18          1H4         C  18   2.760  20.873  -6.477
  194   2H4     C  18          2H4         C  18   1.192  20.153  -6.777
  195    H5     C  18           H5         C  18   0.279  18.370  -5.392
  196    H6     C  18           H6         C  18   0.669  17.009  -3.434
  197   1H5*    G  19          1H5*        G  19   0.983  15.877   0.754
  198   2H5*    G  19          2H5*        G  19   0.280  16.236   2.337
  199    H4*    G  19           H4*        G  19  -1.425  16.336   0.686
  200    H3*    G  19           H3*        G  19  -1.626  14.072   2.598
  201    H2*    G  19           H2*        G  19  -3.176  12.940   1.326
  202   2HO*    G  19          2HO*        G  19  -4.708  14.656   1.729
  203    H1*    G  19           H1*        G  19  -2.801  14.739  -1.102
  204    H8     G  19           H8         G  19  -0.549  11.772  -0.344
  205    H1     G  19           H1         G  19  -5.497  10.784  -4.306
  206   1H2     G  19          1H2         G  19  -6.774  12.268  -4.253
  207   2H2     G  19          2H2         G  19  -6.745  13.736  -3.404
  208   1H5*    C  20          1H5*        C  20  -5.455  16.430   2.637
  209   2H5*    C  20          2H5*        C  20  -5.944  16.535   4.339
  210    H4*    C  20           H4*        C  20  -7.883  15.897   3.339
  211    H3*    C  20           H3*        C  20  -6.561  13.334   4.211
  212    H2*    C  20           H2*        C  20  -8.474  12.178   3.347
  213   2HO*    C  20          2HO*        C  20  -9.707  14.375   4.118
  214    H1*    C  20           H1*        C  20  -8.790  13.919   1.098
  215   1H4     C  20          1H4         C  20  -6.157   9.017  -1.669
  216   2H4     C  20          2H4         C  20  -4.643   9.074  -0.984
  217    H5     C  20           H5         C  20  -4.349  10.894   0.938
  218    H6     C  20           H6         C  20  -5.477  12.704   2.121
  219   1H5*    C  21          1H5*        C  21 -10.331  12.931   5.422
  220   2H5*    C  21          2H5*        C  21 -10.445  12.389   7.107
  221    H4*    C  21           H4*        C  21 -11.735  10.881   5.874
  222    H3*    C  21           H3*        C  21  -9.075   9.646   6.549
  223    H2*    C  21           H2*        C  21  -9.753   7.660   5.384
  224   2HO*    C  21          2HO*        C  21 -12.152   8.441   6.189
  225    H1*    C  21           H1*        C  21 -11.018   9.019   3.252
  226   1H4     C  21          1H4         C  21  -5.472   7.569   0.753
  227   2H4     C  21          2H4         C  21  -4.518   8.648   1.573
  228    H5     C  21           H5         C  21  -5.752  10.072   3.446
  229    H6     C  21           H6         C  21  -7.906  10.472   4.519
  230   1H5*    C  22          1H5*        C  22  -8.320   5.923   8.198
  231   2H5*    C  22          2H5*        C  22  -8.456   7.107   6.883
  232    H4*    C  22           H4*        C  22 -10.501   5.056   6.719
  233    H3*    C  22           H3*        C  22  -7.703   4.085   7.062
  234    H2*    C  22           H2*        C  22  -7.780   2.777   5.093
  235   2HO*    C  22          2HO*        C  22  -9.584   1.775   4.630
  236    H1*    C  22           H1*        C  22  -9.266   4.521   3.489
  237   1H4     C  22          1H4         C  22  -3.182   5.199   2.038
  238   2H4     C  22          2H4         C  22  -2.744   6.208   3.274
  239    H5     C  22           H5         C  22  -4.647   6.654   5.087
  240    H6     C  22           H6         C  22  -6.965   6.230   5.652
  241   1H5*    C  23          1H5*        C  23  -9.737   0.286   5.601
  242   2H5*    C  23          2H5*        C  23  -8.814  -0.851   6.602
  243    H4*    C  23           H4*        C  23  -8.581  -0.993   4.064
  244    H3*    C  23           H3*        C  23  -6.227  -0.964   5.931
  245    H2*    C  23           H2*        C  23  -4.771  -1.215   4.039
  246   2HO*    C  23          2HO*        C  23  -5.941  -2.609   2.697
  247    H1*    C  23           H1*        C  23  -6.094   0.706   2.495
  248   1H4     C  23          1H4         C  23  -1.419   3.888   5.385
  249   2H4     C  23          2H4         C  23  -2.496   4.260   6.715
  250    H5     C  23           H5         C  23  -4.726   3.325   6.900
  251    H6     C  23           H6         C  23  -6.365   1.854   5.846
  252   1H5*    G  24          1H5*        G  24  -5.157  -5.468   3.915
  253   2H5*    G  24          2H5*        G  24  -5.066  -3.888   4.711
  254    H4*    G  24           H4*        G  24  -4.412  -4.011   1.828
  255    H3*    G  24           H3*        G  24  -3.135  -5.943   3.161
  256    H2*    G  24           H2*        G  24  -2.088  -4.735   4.897
  257   2HO*    G  24          2HO*        G  24  -0.552  -4.882   2.653
  258    H1*    G  24           H1*        G  24  -1.565  -2.256   3.238
  259    H8     G  24           H8         G  24  -4.327  -2.640   5.801
  260    H1     G  24           H1         G  24   0.988   0.131   8.072
  261   1H2     G  24          1H2         G  24   2.567   0.109   6.570
  262   2H2     G  24          2H2         G  24   2.328  -0.592   4.987
  263   1H5*    A  25          1H5*        A  25  -1.496  -7.884  -1.876
  264   2H5*    A  25          2H5*        A  25  -0.286  -7.896  -0.578
  265    H4*    A  25           H4*        A  25  -0.298  -6.502  -3.169
  266    H3*    A  25           H3*        A  25   1.794  -7.752  -1.421
  267    H2*    A  25           H2*        A  25   3.448  -6.245  -2.318
  268   2HO*    A  25          2HO*        A  25   3.207  -5.717  -4.356
  269    H1*    A  25           H1*        A  25   1.833  -3.968  -2.270
  270    H8     A  25           H8         A  25   0.692  -4.978   0.893
  271   1H6     A  25          1H6         A  25   6.177  -3.535   3.369
  272   2H6     A  25          2H6         A  25   4.487  -3.850   3.706
  273    H2     A  25           H2         A  25   6.757  -4.069  -1.024
  274   1H5*    G  26          1H5*        G  26   4.085  -7.703  -4.619
  275   2H5*    G  26          2H5*        G  26   4.789  -9.310  -4.882
  276    H4*    G  26           H4*        G  26   6.563  -7.769  -4.566
  277    H3*    G  26           H3*        G  26   6.202  -9.814  -2.468
  278    H2*    G  26           H2*        G  26   7.604  -8.730  -0.874
  279   2HO*    G  26          2HO*        G  26   9.378  -8.154  -1.974
  280    H1*    G  26           H1*        G  26   6.916  -6.097  -1.351
  281    H8     G  26           H8         G  26   3.760  -7.978  -1.734
  282    H1     G  26           H1         G  26   5.289  -6.786   4.351
  283   1H2     G  26          1H2         G  26   7.126  -6.260   4.592
  284   2H2     G  26          2H2         G  26   8.405  -6.060   3.524
  285   1H5*    C  27          1H5*        C  27  10.952  -8.753  -2.411
  286   2H5*    C  27          2H5*        C  27  11.339 -10.391  -2.973
  287    H4*    C  27           H4*        C  27  12.737  -9.932  -1.126
  288    H3*    C  27           H3*        C  27  10.562 -11.902  -0.569
  289    H2*    C  27           H2*        C  27  11.187 -12.036   1.736
  290   2HO*    C  27          2HO*        C  27  13.575 -11.482   0.767
  291    H1*    C  27           H1*        C  27  11.534  -9.309   2.146
  292   1H4     C  27          1H4         C  27   5.492 -10.319   3.618
  293   2H4     C  27          2H4         C  27   4.880 -10.360   2.075
  294    H5     C  27           H5         C  27   6.665 -10.301   0.131
  295    H6     C  27           H6         C  27   9.038 -10.100  -0.366
  296   1H5*    G  28          1H5*        G  28  13.647 -13.188   1.400
  297   2H5*    G  28          2H5*        G  28  14.166 -14.837   1.001
  298    H4*    G  28           H4*        G  28  14.010 -14.815   3.319
  299    H3*    G  28           H3*        G  28  11.603 -16.136   2.114
  300    H2*    G  28           H2*        G  28  10.652 -16.412   4.297
  301   2HO*    G  28          2HO*        G  28  13.228 -16.480   4.989
  302    H1*    G  28           H1*        G  28  11.406 -13.897   5.285
  303    H8     G  28           H8         G  28  10.208 -13.636   1.725
  304    H1     G  28           H1         G  28   5.563 -13.427   6.145
  305   1H2     G  28          1H2         G  28   6.329 -14.028   8.086
  306   2H2     G  28          2H2         G  28   8.005 -14.476   8.329
  307   1H5*    C  29          1H5*        C  29  12.573 -18.586   5.260
  308   2H5*    C  29          2H5*        C  29  12.942 -20.210   4.645
  309    H4*    C  29           H4*        C  29  11.471 -20.606   6.380
  310    H3*    C  29           H3*        C  29  10.061 -20.716   3.744
  311    H2*    C  29           H2*        C  29   7.956 -21.045   4.839
  312   2HO*    C  29          2HO*        C  29   9.551 -22.163   6.684
  313    H1*    C  29           H1*        C  29   8.398 -19.233   6.945
  314   1H4     C  29          1H4         C  29   5.124 -15.631   2.989
  315   2H4     C  29          2H4         C  29   6.362 -15.169   2.005
  316    H5     C  29           H5         C  29   8.713 -16.356   2.482
  317    H6     C  29           H6         C  29   9.830 -18.031   3.863
  318   1H5*    C  30          1H5*        C  30   8.610 -24.004   5.795
  319   2H5*    C  30          2H5*        C  30   9.127 -25.476   4.947
  320    H4*    C  30           H4*        C  30   6.876 -25.831   5.375
  321    H3*    C  30           H3*        C  30   7.324 -24.945   2.547
  322    H2*    C  30           H2*        C  30   4.985 -24.929   2.134
  323   2HO*    C  30          2HO*        C  30   5.047 -26.859   4.022
  324    H1*    C  30           H1*        C  30   4.205 -23.876   4.632
  325   1H4     C  30          1H4         C  30   4.144 -18.986   0.698
  326   2H4     C  30          2H4         C  30   5.759 -18.908   0.339
  327    H5     C  30           H5         C  30   7.256 -20.836   1.400
  328    H6     C  30           H6         C  30   7.232 -22.760   2.876
  329    H3T    C  30           H3T        C  30   7.878 -27.026   3.467
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  -1.168 -22.578   2.045
    2   2H5*    G   1          2H5*        G   1  -2.420 -21.479   2.650
    3    H4*    G   1           H4*        G   1  -1.656 -22.577   4.538
    4    H3*    G   1           H3*        G   1  -0.471 -19.837   4.352
    5    H2*    G   1           H2*        G   1   0.835 -20.240   6.328
    6   2HO*    G   1          2HO*        G   1   0.121 -21.608   7.782
    7    H1*    G   1           H1*        G   1   1.729 -22.754   5.577
    8    H8     G   1           H8         G   1   1.163 -20.228   2.749
    9    H1     G   1           H1         G   1   7.102 -20.550   5.120
   10   1H2     G   1          1H2         G   1   7.252 -21.688   6.642
   11   2H2     G   1          2H2         G   1   6.127 -22.600   7.501
   12    H5T    G   1           H5T        G   1  -0.899 -19.793   2.581
   13   1H5*    G   2          1H5*        G   2  -1.310 -20.601   8.102
   14   2H5*    G   2          2H5*        G   2  -2.371 -19.421   8.896
   15    H4*    G   2           H4*        G   2  -0.585 -19.733  10.363
   16    H3*    G   2           H3*        G   2  -0.354 -17.160   8.846
   17    H2*    G   2           H2*        G   2   1.739 -16.698   9.929
   18   2HO*    G   2          2HO*        G   2   1.908 -17.376  11.932
   19    H1*    G   2           H1*        G   2   2.787 -19.267   9.650
   20    H8     G   2           H8         G   2   0.628 -18.031   6.750
   21    H1     G   2           H1         G   2   6.897 -16.787   6.328
   22   1H2     G   2          1H2         G   2   7.862 -17.213   7.910
   23   2H2     G   2          2H2         G   2   7.396 -17.863   9.390
   24   1H5*    U   3          1H5*        U   3   0.685 -16.313  12.550
   25   2H5*    U   3          2H5*        U   3  -0.248 -14.989  13.275
   26    H4*    U   3           H4*        U   3   1.967 -14.401  13.635
   27    H3*    U   3           H3*        U   3   0.807 -12.901  11.320
   28    H2*    U   3           H2*        U   3   2.920 -11.842  10.917
   29   2HO*    U   3          2HO*        U   3   4.058 -11.419  12.653
   30    H1*    U   3           H1*        U   3   4.462 -14.140  11.183
   31    H3     U   3           H3         U   3   4.484 -13.778   6.691
   32    H5     U   3           H5         U   3   0.562 -14.936   7.572
   33    H6     U   3           H6         U   3   1.078 -14.676   9.906
   34   1H5*    G   4          1H5*        G   4   2.902 -10.289  13.825
   35   2H5*    G   4          2H5*        G   4   1.998  -8.790  14.116
   36    H4*    G   4           H4*        G   4   4.188  -8.196  13.451
   37    H3*    G   4           H3*        G   4   2.139  -7.655  11.332
   38    H2*    G   4           H2*        G   4   3.871  -6.905   9.842
   39   2HO*    G   4          2HO*        G   4   5.147  -6.494  12.211
   40    H1*    G   4           H1*        G   4   5.629  -8.985  10.387
   41    H8     G   4           H8         G   4   2.061 -10.230  10.470
   42    H1     G   4           H1         G   4   4.825 -10.097   4.705
   43   1H2     G   4          1H2         G   4   6.479  -9.139   4.684
   44   2H2     G   4          2H2         G   4   7.330  -8.301   5.874
   45   1H5*    C   5          1H5*        C   5   4.729  -4.969  11.562
   46   2H5*    C   5          2H5*        C   5   4.383  -3.230  11.589
   47    H4*    C   5           H4*        C   5   5.966  -3.558   9.893
   48    H3*    C   5           H3*        C   5   3.220  -3.063   8.803
   49    H2*    C   5           H2*        C   5   4.032  -3.356   6.576
   50   2HO*    C   5          2HO*        C   5   5.897  -2.178   6.614
   51    H1*    C   5           H1*        C   5   5.852  -5.448   7.161
   52   1H4     C   5          1H4         C   5   0.941  -8.560   4.753
   53   2H4     C   5          2H4         C   5  -0.011  -8.546   6.104
   54    H5     C   5           H5         C   5   0.915  -7.154   8.165
   55    H6     C   5           H6         C   5   2.707  -5.684   8.904
   56   1H5*    G   6          1H5*        G   6   5.282   0.324   5.040
   57   2H5*    G   6          2H5*        G   6   3.568   0.210   5.481
   58    H4*    G   6           H4*        G   6   5.175  -1.425   3.637
   59    H3*    G   6           H3*        G   6   2.295  -0.579   3.833
   60    H2*    G   6           H2*        G   6   1.720  -2.405   2.364
   61   2HO*    G   6          2HO*        G   6   4.379  -2.251   1.694
   62    H1*    G   6           H1*        G   6   3.185  -4.281   3.790
   63    H8     G   6           H8         G   6   2.087  -1.807   6.228
   64    H1     G   6           H1         G   6  -2.676  -5.746   4.582
   65   1H2     G   6          1H2         G   6  -2.158  -6.842   2.755
   66   2H2     G   6          2H2         G   6  -0.614  -6.606   1.971
   67   1H5*    A   7          1H5*        A   7   7.140  -2.321   0.691
   68   2H5*    A   7          2H5*        A   7   6.949  -0.640   0.158
   69    H4*    A   7           H4*        A   7   6.512  -2.441  -1.557
   70    H3*    A   7           H3*        A   7   4.412  -0.329  -1.045
   71    H2*    A   7           H2*        A   7   3.182  -1.307  -2.860
   72   2HO*    A   7          2HO*        A   7   5.515  -1.722  -3.859
   73    H1*    A   7           H1*        A   7   3.927  -3.987  -2.168
   74    H8     A   7           H8         A   7   2.526  -1.926   0.753
   75   1H6     A   7          1H6         A   7  -2.915  -4.410  -0.863
   76   2H6     A   7          2H6         A   7  -2.085  -3.469   0.356
   77    H2     A   7           H2         A   7   0.040  -5.391  -4.060
   78   1H5*    A   8          1H5*        A   8   3.103   1.911  -5.281
   79   2H5*    A   8          2H5*        A   8   2.717   1.314  -3.656
   80    H4*    A   8           H4*        A   8   3.108  -0.547  -5.979
   81    H3*    A   8           H3*        A   8   0.635   1.034  -5.384
   82    H2*    A   8           H2*        A   8  -0.721  -0.930  -5.692
   83   2HO*    A   8          2HO*        A   8   1.023  -1.572  -7.436
   84    H1*    A   8           H1*        A   8   0.936  -2.673  -4.280
   85    H8     A   8           H8         A   8   1.454  -0.236  -1.883
   86   1H6     A   8          1H6         A   8  -4.503  -0.436  -0.214
   87   2H6     A   8          2H6         A   8  -2.996   0.127   0.414
   88    H2     A   8           H2         A   8  -4.196  -2.274  -4.149
   89   1H5*    G   9          1H5*        G   9  -0.709  -0.638  -8.403
   90   2H5*    G   9          2H5*        G   9  -1.339   0.400  -9.697
   91    H4*    G   9           H4*        G   9  -3.143  -0.923  -9.035
   92    H3*    G   9           H3*        G   9  -3.339   1.850  -7.918
   93    H2*    G   9           H2*        G   9  -5.368   1.239  -6.763
   94   2HO*    G   9          2HO*        G   9  -5.566  -0.481  -8.753
   95    H1*    G   9           H1*        G   9  -4.407  -1.137  -5.742
   96    H8     G   9           H8         G   9  -1.348   0.813  -5.705
   97    H1     G   9           H1         G   9  -5.476   2.782  -1.240
   98   1H2     G   9          1H2         G   9  -7.268   2.165  -1.525
   99   2H2     G   9          2H2         G   9  -7.967   1.189  -2.700
  100   1H5*    G  10          1H5*        G  10  -6.510   1.026  -9.271
  101   2H5*    G  10          2H5*        G  10  -7.391   1.420 -10.760
  102    H4*    G  10           H4*        G  10  -9.107   1.850  -9.427
  103    H3*    G  10           H3*        G  10  -7.474   4.329  -8.911
  104    H2*    G  10           H2*        G  10  -9.159   4.964  -7.287
  105   2HO*    G  10          2HO*        G  10 -10.729   3.568  -8.826
  106    H1*    G  10           H1*        G  10  -9.237   2.451  -6.083
  107    H8     G  10           H8         G  10  -5.705   2.845  -7.061
  108    H1     G  10           H1         G  10  -7.264   6.256  -1.876
  109   1H2     G  10          1H2         G  10  -9.139   6.472  -1.635
  110   2H2     G  10          2H2         G  10 -10.471   5.911  -2.490
  111   1H5*    G  11          1H5*        G  11 -11.399   5.588  -9.531
  112   2H5*    G  11          2H5*        G  11 -11.462   6.956 -10.660
  113    H4*    G  11           H4*        G  11 -12.709   7.543  -8.734
  114    H3*    G  11           H3*        G  11 -10.101   9.005  -8.938
  115    H2*    G  11           H2*        G  11 -10.521  10.080  -6.839
  116   2HO*    G  11          2HO*        G  11 -12.511  10.287  -6.050
  117    H1*    G  11           H1*        G  11 -11.396   7.808  -5.517
  118    H8     G  11           H8         G  11  -8.694   6.577  -7.744
  119    H1     G  11           H1         G  11  -6.643   9.676  -2.546
  120   1H2     G  11          1H2         G  11  -8.036  10.727  -1.704
  121   2H2     G  11          2H2         G  11  -9.666  10.937  -2.089
  122   1H5*    C  12          1H5*        C  12 -12.742  11.447  -7.413
  123   2H5*    C  12          2H5*        C  12 -13.020  12.895  -8.400
  124    H4*    C  12           H4*        C  12 -12.833  13.669  -6.203
  125    H3*    C  12           H3*        C  12 -10.342  14.178  -7.797
  126    H2*    C  12           H2*        C  12  -9.288  15.116  -5.856
  127   2HO*    C  12          2HO*        C  12 -10.584  15.521  -3.948
  128    H1*    C  12           H1*        C  12 -10.369  13.285  -3.988
  129   1H4     C  12          1H4         C  12  -4.540  11.029  -4.929
  130   2H4     C  12          2H4         C  12  -4.923  10.087  -6.223
  131    H5     C  12           H5         C  12  -7.354  10.366  -7.224
  132    H6     C  12           H6         C  12  -9.497  11.485  -6.929
  133   1H5*    G  13          1H5*        G  13  -9.170  18.072  -9.562
  134   2H5*    G  13          2H5*        G  13  -8.310  16.699  -8.843
  135    H4*    G  13           H4*        G  13  -8.468  19.528  -7.824
  136    H3*    G  13           H3*        G  13  -6.429  18.003  -9.303
  137    H2*    G  13           H2*        G  13  -4.677  18.371  -7.785
  138   2HO*    G  13          2HO*        G  13  -4.871  20.579  -7.485
  139    H1*    G  13           H1*        G  13  -6.045  18.234  -5.383
  140    H8     G  13           H8         G  13  -7.773  15.683  -6.863
  141    H1     G  13           H1         G  13  -1.733  13.802  -6.234
  142   1H2     G  13          1H2         G  13  -0.455  15.525  -5.845
  143   2H2     G  13          2H2         G  13  -1.098  17.150  -5.741
  144   1H5*    U  14          1H5*        U  14  -3.662  22.529  -8.173
  145   2H5*    U  14          2H5*        U  14  -3.266  22.210  -9.873
  146    H4*    U  14           H4*        U  14  -1.224  21.937  -8.945
  147    H3*    U  14           H3*        U  14  -2.178  19.585  -9.810
  148    H2*    U  14           H2*        U  14  -3.041  18.725  -7.754
  149   2HO*    U  14          2HO*        U  14  -0.275  18.161  -7.932
  150    H1*    U  14           H1*        U  14  -0.675  19.876  -6.212
  151    H3     U  14           H3         U  14  -2.992  21.095  -2.430
  152    H5     U  14           H5         U  14  -4.922  17.754  -4.069
  153    H6     U  14           H6         U  14  -3.733  18.131  -6.105
  154   1H5*    C  15          1H5*        C  15   1.403  16.022 -10.447
  155   2H5*    C  15          2H5*        C  15   0.010  16.692  -9.581
  156    H4*    C  15           H4*        C  15   2.365  17.548  -8.250
  157    H3*    C  15           H3*        C  15   2.427  14.582  -8.850
  158    H2*    C  15           H2*        C  15   3.238  14.260  -6.612
  159   2HO*    C  15          2HO*        C  15   3.411  16.271  -5.269
  160    H1*    C  15           H1*        C  15   1.247  15.843  -5.477
  161   1H4     C  15          1H4         C  15  -1.710  10.346  -7.586
  162   2H4     C  15          2H4         C  15  -1.340  10.044  -5.902
  163    H5     C  15           H5         C  15  -0.087  11.620  -4.540
  164    H6     C  15           H6         C  15   1.118  13.699  -4.535
  165   1H5*    G  16          1H5*        G  16   7.078  14.711 -11.221
  166   2H5*    G  16          2H5*        G  16   5.734  14.229 -10.168
  167    H4*    G  16           H4*        G  16   8.154  14.737  -9.236
  168    H3*    G  16           H3*        G  16   5.509  15.221  -7.909
  169    H2*    G  16           H2*        G  16   6.616  16.316  -6.084
  170   2HO*    G  16          2HO*        G  16   8.388  15.103  -5.672
  171    H1*    G  16           H1*        G  16   8.465  17.734  -7.654
  172    H8     G  16           H8         G  16   4.739  17.179  -7.074
  173    H1     G  16           H1         G  16   6.409  23.166  -8.647
  174   1H2     G  16          1H2         G  16   8.518  23.236  -9.246
  175   2H2     G  16          2H2         G  16   9.531  21.810  -9.256
  176   1H5*    U  17          1H5*        U  17   4.114  11.227  -5.394
  177   2H5*    U  17          2H5*        U  17   2.773  12.337  -5.735
  178    H4*    U  17           H4*        U  17   5.001  12.856  -3.798
  179    H3*    U  17           H3*        U  17   2.869  11.156  -3.262
  180    H2*    U  17           H2*        U  17   1.194  12.768  -3.012
  181   2HO*    U  17          2HO*        U  17   2.454  12.253  -0.786
  182    H1*    U  17           H1*        U  17   3.284  14.843  -2.158
  183    H3     U  17           H3         U  17   1.086  18.429  -4.148
  184    H5     U  17           H5         U  17  -1.765  15.588  -2.970
  185    H6     U  17           H6         U  17   0.045  14.017  -2.701
  186   1H5*    C  18          1H5*        C  18   4.670  13.946  -2.305
  187   2H5*    C  18          2H5*        C  18   6.168  14.869  -2.209
  188    H4*    C  18           H4*        C  18   5.788  14.296   0.362
  189    H3*    C  18           H3*        C  18   3.294  13.520  -0.372
  190    H2*    C  18           H2*        C  18   2.387  15.641  -0.920
  191   2HO*    C  18          2HO*        C  18   2.626  16.379   1.772
  192    H1*    C  18           H1*        C  18   4.218  17.061   1.071
  193   1H4     C  18          1H4         C  18   3.346  21.704  -3.304
  194   2H4     C  18          2H4         C  18   1.676  21.179  -3.341
  195    H5     C  18           H5         C  18   0.915  19.150  -2.220
  196    H6     C  18           H6         C  18   1.589  17.296  -0.839
  197   1H5*    G  19          1H5*        G  19   2.172  14.837   2.146
  198   2H5*    G  19          2H5*        G  19   1.387  14.543   3.705
  199    H4*    G  19           H4*        G  19  -0.171  15.523   2.192
  200    H3*    G  19           H3*        G  19  -0.736  12.718   2.980
  201    H2*    G  19           H2*        G  19  -2.230  12.372   1.255
  202   2HO*    G  19          2HO*        G  19  -3.597  13.999   2.334
  203    H1*    G  19           H1*        G  19  -1.528  14.961  -0.165
  204    H8     G  19           H8         G  19   0.718  12.160  -0.957
  205    H1     G  19           H1         G  19  -4.895  12.089  -4.108
  206   1H2     G  19          1H2         G  19  -6.175  13.273  -3.374
  207   2H2     G  19          2H2         G  19  -6.104  14.344  -2.071
  208   1H5*    C  20          1H5*        C  20  -4.263  15.321   3.550
  209   2H5*    C  20          2H5*        C  20  -5.002  14.899   5.106
  210    H4*    C  20           H4*        C  20  -6.796  14.994   3.678
  211    H3*    C  20           H3*        C  20  -5.994  12.089   3.837
  212    H2*    C  20           H2*        C  20  -7.861  11.620   2.403
  213   2HO*    C  20          2HO*        C  20  -8.687  14.113   3.374
  214    H1*    C  20           H1*        C  20  -7.495  13.956   0.803
  215   1H4     C  20          1H4         C  20  -5.287   9.324  -2.770
  216   2H4     C  20          2H4         C  20  -3.763   9.233  -2.128
  217    H5     C  20           H5         C  20  -3.346  10.719   0.045
  218    H6     C  20           H6         C  20  -4.366  12.363   1.532
  219   1H5*    C  21          1H5*        C  21  -9.837  12.223   4.027
  220   2H5*    C  21          2H5*        C  21 -10.563  11.363   5.398
  221    H4*    C  21           H4*        C  21 -11.734  10.621   3.523
  222    H3*    C  21           H3*        C  21  -9.681   8.540   4.275
  223    H2*    C  21           H2*        C  21 -10.536   7.196   2.476
  224   2HO*    C  21          2HO*        C  21 -12.770   7.619   2.968
  225    H1*    C  21           H1*        C  21 -11.007   9.421   0.736
  226   1H4     C  21          1H4         C  21  -5.924   6.669  -1.707
  227   2H4     C  21          2H4         C  21  -4.787   7.346  -0.713
  228    H5     C  21           H5         C  21  -5.740   8.824   1.281
  229    H6     C  21           H6         C  21  -7.787   9.660   2.312
  230   1H5*    C  22          1H5*        C  22  -9.874   4.836   5.189
  231   2H5*    C  22          2H5*        C  22  -9.834   6.051   3.898
  232    H4*    C  22           H4*        C  22 -12.042   4.200   3.583
  233    H3*    C  22           H3*        C  22  -9.362   2.975   4.041
  234    H2*    C  22           H2*        C  22  -9.472   1.705   2.046
  235   2HO*    C  22          2HO*        C  22 -11.339   0.983   1.302
  236    H1*    C  22           H1*        C  22 -10.713   3.604   0.414
  237   1H4     C  22          1H4         C  22  -4.565   3.820  -0.836
  238   2H4     C  22          2H4         C  22  -4.077   4.724   0.470
  239    H5     C  22           H5         C  22  -5.988   5.272   2.238
  240    H6     C  22           H6         C  22  -8.357   5.056   2.703
  241   1H5*    C  23          1H5*        C  23 -11.950  -0.157   2.554
  242   2H5*    C  23          2H5*        C  23 -11.445  -1.646   3.376
  243    H4*    C  23           H4*        C  23 -11.258  -1.595   0.854
  244    H3*    C  23           H3*        C  23  -9.102  -2.526   2.689
  245    H2*    C  23           H2*        C  23  -7.532  -2.729   0.894
  246   2HO*    C  23          2HO*        C  23  -8.203  -3.175  -1.076
  247    H1*    C  23           H1*        C  23  -8.215  -0.392  -0.465
  248   1H4     C  23          1H4         C  23  -3.365   1.315   3.252
  249   2H4     C  23          2H4         C  23  -4.492   1.734   4.526
  250    H5     C  23           H5         C  23  -6.864   1.286   4.384
  251    H6     C  23           H6         C  23  -8.638   0.365   2.983
  252   1H5*    G  24          1H5*        G  24  -8.931  -4.783  -0.627
  253   2H5*    G  24          2H5*        G  24  -8.715  -6.517  -0.321
  254    H4*    G  24           H4*        G  24  -6.988  -5.431  -1.772
  255    H3*    G  24           H3*        G  24  -6.600  -7.542  -0.168
  256    H2*    G  24           H2*        G  24  -5.841  -6.431   1.808
  257   2HO*    G  24          2HO*        G  24  -3.790  -7.076   0.067
  258    H1*    G  24           H1*        G  24  -4.254  -4.392   0.184
  259    H8     G  24           H8         G  24  -7.290  -4.247   2.557
  260    H1     G  24           H1         G  24  -2.030  -1.183   4.557
  261   1H2     G  24          1H2         G  24  -0.388  -1.452   3.112
  262   2H2     G  24          2H2         G  24  -0.595  -2.409   1.664
  263   1H5*    A  25          1H5*        A  25  -4.654 -10.813  -3.033
  264   2H5*    A  25          2H5*        A  25  -3.620 -11.283  -1.671
  265    H4*    A  25           H4*        A  25  -2.851 -10.411  -4.235
  266    H3*    A  25           H3*        A  25  -1.332 -11.188  -1.765
  267    H2*    A  25           H2*        A  25   0.657 -10.221  -2.691
  268   2HO*    A  25          2HO*        A  25   0.623 -10.945  -4.771
  269    H1*    A  25           H1*        A  25  -0.623  -8.002  -3.901
  270    H8     A  25           H8         A  25  -2.055  -8.193  -0.503
  271   1H6     A  25          1H6         A  25   2.867  -4.993   1.449
  272   2H6     A  25          2H6         A  25   1.254  -5.519   1.875
  273    H2     A  25           H2         A  25   3.783  -6.587  -2.627
  274   1H5*    G  26          1H5*        G  26   2.897 -13.500  -4.227
  275   2H5*    G  26          2H5*        G  26   2.392 -13.596  -2.529
  276    H4*    G  26           H4*        G  26   3.934 -11.542  -3.941
  277    H3*    G  26           H3*        G  26   3.765 -12.550  -1.120
  278    H2*    G  26           H2*        G  26   4.693 -10.482  -0.336
  279   2HO*    G  26          2HO*        G  26   6.203  -9.914  -1.895
  280    H1*    G  26           H1*        G  26   3.067  -8.881  -1.913
  281    H8     G  26           H8         G  26   0.617 -11.372  -1.219
  282    H1     G  26           H1         G  26   2.048  -8.047   4.048
  283   1H2     G  26          1H2         G  26   3.723  -7.107   3.935
  284   2H2     G  26          2H2         G  26   4.871  -6.964   2.718
  285   1H5*    C  27          1H5*        C  27   7.696  -9.135  -2.934
  286   2H5*    C  27          2H5*        C  27   8.922 -10.376  -3.260
  287    H4*    C  27           H4*        C  27   9.870  -8.845  -1.737
  288    H3*    C  27           H3*        C  27   9.146 -11.474  -0.497
  289    H2*    C  27           H2*        C  27   9.857 -10.687   1.648
  290   2HO*    C  27          2HO*        C  27  11.355  -9.181   1.821
  291    H1*    C  27           H1*        C  27   8.720  -8.141   1.443
  292   1H4     C  27          1H4         C  27   4.270 -11.398   4.444
  293   2H4     C  27          2H4         C  27   3.660 -12.239   3.148
  294    H5     C  27           H5         C  27   5.018 -11.992   0.887
  295    H6     C  27           H6         C  27   6.883 -10.844  -0.185
  296   1H5*    G  28          1H5*        G  28  12.549 -10.348   1.048
  297   2H5*    G  28          2H5*        G  28  13.858 -11.542   0.942
  298    H4*    G  28           H4*        G  28  13.813 -10.917   3.181
  299    H3*    G  28           H3*        G  28  12.404 -13.546   2.813
  300    H2*    G  28           H2*        G  28  11.949 -13.591   5.172
  301   2HO*    G  28          2HO*        G  28  13.531 -12.800   6.363
  302    H1*    G  28           H1*        G  28  11.272 -10.875   5.370
  303    H8     G  28           H8         G  28   9.877 -12.435   2.225
  304    H1     G  28           H1         G  28   6.219 -13.126   7.452
  305   1H2     G  28          1H2         G  28   7.316 -12.558   9.231
  306   2H2     G  28          2H2         G  28   8.972 -11.994   9.164
  307   1H5*    C  29          1H5*        C  29  14.770 -14.056   6.123
  308   2H5*    C  29          2H5*        C  29  15.900 -15.395   5.843
  309    H4*    C  29           H4*        C  29  15.018 -15.842   7.933
  310    H3*    C  29           H3*        C  29  13.686 -17.509   5.835
  311    H2*    C  29           H2*        C  29  12.196 -18.433   7.468
  312   2HO*    C  29          2HO*        C  29  14.285 -17.909   9.073
  313    H1*    C  29           H1*        C  29  11.746 -16.046   8.885
  314   1H4     C  29          1H4         C  29   6.757 -16.166   5.075
  315   2H4     C  29          2H4         C  29   7.465 -15.501   3.745
  316    H5     C  29           H5         C  29  10.097 -15.086   3.925
  317    H6     C  29           H6         C  29  12.047 -15.401   5.359
  318   1H5*    C  30          1H5*        C  30  14.401 -20.165   8.916
  319   2H5*    C  30          2H5*        C  30  15.563 -21.387   8.361
  320    H4*    C  30           H4*        C  30  13.898 -22.616   9.413
  321    H3*    C  30           H3*        C  30  13.585 -22.677   6.434
  322    H2*    C  30           H2*        C  30  11.582 -23.936   6.619
  323   2HO*    C  30          2HO*        C  30  12.780 -25.011   8.656
  324    H1*    C  30           H1*        C  30  10.537 -22.591   8.865
  325   1H4     C  30          1H4         C  30   7.633 -20.057   3.902
  326   2H4     C  30          2H4         C  30   8.936 -19.332   3.182
  327    H5     C  30           H5         C  30  11.286 -19.787   4.330
  328    H6     C  30           H6         C  30  12.383 -20.832   6.225
  329    H3T    C  30           H3T        C  30  15.246 -23.783   7.397
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  -4.522 -15.594   0.376
    2   2H5*    G   1          2H5*        G   1  -5.211 -14.497   1.585
    3    H4*    G   1           H4*        G   1  -4.659 -16.416   2.767
    4    H3*    G   1           H3*        G   1  -2.617 -14.265   3.206
    5    H2*    G   1           H2*        G   1  -1.321 -15.751   4.563
    6   2HO*    G   1          2HO*        G   1  -2.327 -17.210   5.720
    7    H1*    G   1           H1*        G   1  -1.666 -18.026   2.949
    8    H8     G   1           H8         G   1  -1.128 -14.821   0.985
    9    H1     G   1           H1         G   1   4.179 -17.980   2.679
   10   1H2     G   1          1H2         G   1   3.851 -19.427   3.882
   11   2H2     G   1          2H2         G   1   2.444 -20.009   4.601
   12    H5T    G   1           H5T        G   1  -2.656 -13.991   1.604
   13   1H5*    G   2          1H5*        G   2  -3.308 -16.048   6.693
   14   2H5*    G   2          2H5*        G   2  -3.761 -14.935   7.999
   15    H4*    G   2           H4*        G   2  -2.065 -16.237   8.901
   16    H3*    G   2           H3*        G   2  -0.975 -13.573   8.034
   17    H2*    G   2           H2*        G   2   1.204 -14.263   8.787
   18   2HO*    G   2          2HO*        G   2  -0.228 -15.704  10.473
   19    H1*    G   2           H1*        G   2   1.045 -16.858   7.729
   20    H8     G   2           H8         G   2  -0.472 -14.161   5.510
   21    H1     G   2           H1         G   2   5.781 -15.280   4.689
   22   1H2     G   2          1H2         G   2   6.522 -16.428   6.027
   23   2H2     G   2          2H2         G   2   5.844 -17.200   7.363
   24   1H5*    U   3          1H5*        U   3   0.656 -14.338  11.493
   25   2H5*    U   3          2H5*        U   3   0.431 -13.076  12.719
   26    H4*    U   3           H4*        U   3   2.712 -13.493  12.724
   27    H3*    U   3           H3*        U   3   2.088 -10.995  11.199
   28    H2*    U   3           H2*        U   3   4.408 -10.740  10.628
   29   2HO*    U   3          2HO*        U   3   4.706 -12.133  12.901
   30    H1*    U   3           H1*        U   3   4.858 -13.411   9.977
   31    H3     U   3           H3         U   3   4.724 -11.749   5.810
   32    H5     U   3           H5         U   3   0.739 -11.540   7.085
   33    H6     U   3           H6         U   3   1.477 -12.192   9.280
   34   1H5*    G   4          1H5*        G   4   5.419 -10.317  13.349
   35   2H5*    G   4          2H5*        G   4   5.365  -8.797  14.263
   36    H4*    G   4           H4*        G   4   7.363  -8.767  13.016
   37    H3*    G   4           H3*        G   4   5.275  -6.938  11.868
   38    H2*    G   4           H2*        G   4   6.745  -6.408  10.051
   39   2HO*    G   4          2HO*        G   4   8.553  -6.563  11.876
   40    H1*    G   4           H1*        G   4   7.910  -8.994   9.836
   41    H8     G   4           H8         G   4   4.127  -9.020   9.971
   42    H1     G   4           H1         G   4   6.754  -8.597   4.148
   43   1H2     G   4          1H2         G   4   8.610  -8.195   4.180
   44   2H2     G   4          2H2         G   4   9.699  -7.918   5.433
   45   1H5*    C   5          1H5*        C   5   5.677  -3.107  10.836
   46   2H5*    C   5          2H5*        C   5   5.939  -4.809  10.414
   47    H4*    C   5           H4*        C   5   8.324  -3.115  10.211
   48    H3*    C   5           H3*        C   5   5.875  -2.276   8.773
   49    H2*    C   5           H2*        C   5   6.879  -2.343   6.630
   50   2HO*    C   5          2HO*        C   5   9.044  -1.674   8.067
   51    H1*    C   5           H1*        C   5   8.484  -4.600   6.949
   52   1H4     C   5          1H4         C   5   3.292  -6.911   4.217
   53   2H4     C   5          2H4         C   5   2.445  -7.197   5.607
   54    H5     C   5           H5         C   5   3.563  -6.313   7.846
   55    H6     C   5           H6         C   5   5.432  -5.024   8.730
   56   1H5*    G   6          1H5*        G   6   6.792   1.581   5.746
   57   2H5*    G   6          2H5*        G   6   5.354   0.844   6.478
   58    H4*    G   6           H4*        G   6   7.064  -0.130   4.228
   59    H3*    G   6           H3*        G   6   4.224   0.656   4.494
   60    H2*    G   6           H2*        G   6   3.383  -1.270   3.357
   61   2HO*    G   6          2HO*        G   6   5.750  -1.032   2.115
   62    H1*    G   6           H1*        G   6   5.092  -3.191   4.389
   63    H8     G   6           H8         G   6   4.578  -0.985   7.232
   64    H1     G   6           H1         G   6  -0.571  -4.615   6.083
   65   1H2     G   6          1H2         G   6  -0.480  -5.442   4.047
   66   2H2     G   6          2H2         G   6   0.863  -5.110   2.980
   67   1H5*    A   7          1H5*        A   7   7.426   1.167   1.819
   68   2H5*    A   7          2H5*        A   7   7.973   2.388   0.653
   69    H4*    A   7           H4*        A   7   7.106   0.860  -0.777
   70    H3*    A   7           H3*        A   7   4.753   2.623  -0.105
   71    H2*    A   7           H2*        A   7   3.434   1.255  -1.554
   72   2HO*    A   7          2HO*        A   7   4.352  -0.069  -3.096
   73    H1*    A   7           H1*        A   7   4.795  -1.183  -0.887
   74    H8     A   7           H8         A   7   3.563   0.568   2.232
   75   1H6     A   7          1H6         A   7  -1.787  -2.405   1.238
   76   2H6     A   7          2H6         A   7  -0.892  -1.410   2.362
   77    H2     A   7           H2         A   7   0.799  -2.975  -2.361
   78   1H5*    A   8          1H5*        A   8   2.630   3.876  -4.644
   79   2H5*    A   8          2H5*        A   8   2.497   3.840  -2.875
   80    H4*    A   8           H4*        A   8   3.286   1.331  -4.239
   81    H3*    A   8           H3*        A   8   0.535   2.497  -4.581
   82    H2*    A   8           H2*        A   8  -0.406   0.344  -4.119
   83   2HO*    A   8          2HO*        A   8   1.615  -0.494  -5.454
   84    H1*    A   8           H1*        A   8   1.582  -0.426  -2.217
   85    H8     A   8           H8         A   8   1.014   2.368  -0.435
   86   1H6     A   8          1H6         A   8  -4.706   0.566   1.097
   87   2H6     A   8          2H6         A   8  -3.484   1.665   1.629
   88    H2     A   8           H2         A   8  -3.546  -1.672  -2.469
   89   1H5*    G   9          1H5*        G   9  -0.420  -0.796  -5.999
   90   2H5*    G   9          2H5*        G   9  -0.777  -0.594  -7.726
   91    H4*    G   9           H4*        G   9  -2.733  -1.506  -7.012
   92    H3*    G   9           H3*        G   9  -3.039   1.464  -6.788
   93    H2*    G   9           H2*        G   9  -5.246   1.161  -5.900
   94   2HO*    G   9          2HO*        G   9  -4.865  -1.632  -6.350
   95    H1*    G   9           H1*        G   9  -4.503  -0.817  -4.099
   96    H8     G   9           H8         G   9  -1.652   1.600  -4.434
   97    H1     G   9           H1         G   9  -6.216   3.401  -0.332
   98   1H2     G   9          1H2         G   9  -7.813   2.377  -0.474
   99   2H2     G   9          2H2         G   9  -8.269   1.094  -1.461
  100   1H5*    G  10          1H5*        G  10  -6.188   1.635  -9.797
  101   2H5*    G  10          2H5*        G  10  -5.642   1.840  -8.122
  102    H4*    G  10           H4*        G  10  -8.450   1.105  -8.934
  103    H3*    G  10           H3*        G  10  -7.219   3.803  -8.531
  104    H2*    G  10           H2*        G  10  -9.140   4.525  -7.285
  105   2HO*    G  10          2HO*        G  10 -11.051   3.427  -7.338
  106    H1*    G  10           H1*        G  10  -9.423   2.203  -5.782
  107    H8     G  10           H8         G  10  -5.760   2.737  -6.141
  108    H1     G  10           H1         G  10  -8.466   6.260  -1.531
  109   1H2     G  10          1H2         G  10 -10.380   6.291  -1.607
  110   2H2     G  10          2H2         G  10 -11.485   5.588  -2.657
  111   1H5*    G  11          1H5*        G  11 -10.833   4.875 -10.311
  112   2H5*    G  11          2H5*        G  11 -10.522   5.831 -11.775
  113    H4*    G  11           H4*        G  11 -11.974   7.141 -10.541
  114    H3*    G  11           H3*        G  11  -9.164   8.100 -10.251
  115    H2*    G  11           H2*        G  11  -9.800   9.722  -8.629
  116   2HO*    G  11          2HO*        G  11 -11.745  10.570  -8.665
  117    H1*    G  11           H1*        G  11 -11.523   8.097  -7.189
  118    H8     G  11           H8         G  11  -8.631   5.979  -8.307
  119    H1     G  11           H1         G  11  -7.603   9.475  -3.053
  120   1H2     G  11          1H2         G  11  -9.021  10.768  -2.733
  121   2H2     G  11          2H2         G  11 -10.423  11.130  -3.604
  122   1H5*    C  12          1H5*        C  12 -11.540  11.269 -10.274
  123   2H5*    C  12          2H5*        C  12 -11.148  12.431 -11.555
  124    H4*    C  12           H4*        C  12 -11.388  13.740  -9.671
  125    H3*    C  12           H3*        C  12  -8.461  13.252 -10.134
  126    H2*    C  12           H2*        C  12  -7.986  14.615  -8.211
  127   2HO*    C  12          2HO*        C  12  -9.792  16.108  -8.826
  128    H1*    C  12           H1*        C  12 -10.046  13.537  -6.616
  129   1H4     C  12          1H4         C  12  -4.946  10.169  -4.998
  130   2H4     C  12          2H4         C  12  -5.038   9.057  -6.231
  131    H5     C  12           H5         C  12  -6.782   9.592  -8.127
  132    H6     C  12           H6         C  12  -8.631  11.038  -8.762
  133   1H5*    G  13          1H5*        G  13  -5.847  17.264 -11.217
  134   2H5*    G  13          2H5*        G  13  -5.732  15.794 -10.226
  135    H4*    G  13           H4*        G  13  -6.487  18.549  -9.264
  136    H3*    G  13           H3*        G  13  -3.880  17.067  -9.030
  137    H2*    G  13           H2*        G  13  -3.643  17.973  -6.806
  138   2HO*    G  13          2HO*        G  13  -4.383  20.016  -6.830
  139    H1*    G  13           H1*        G  13  -6.286  17.479  -6.043
  140    H8     G  13           H8         G  13  -4.924  14.718  -8.249
  141    H1     G  13           H1         G  13  -3.517  14.120  -2.051
  142   1H2     G  13          1H2         G  13  -4.149  15.918  -0.937
  143   2H2     G  13          2H2         G  13  -4.906  17.275  -1.744
  144   1H5*    U  14          1H5*        U  14   0.049  19.714  -8.513
  145   2H5*    U  14          2H5*        U  14  -0.005  19.817 -10.283
  146    H4*    U  14           H4*        U  14   1.504  18.209 -10.276
  147    H3*    U  14           H3*        U  14  -0.721  16.866 -10.657
  148    H2*    U  14           H2*        U  14  -1.457  16.445  -8.470
  149   2HO*    U  14          2HO*        U  14   0.437  14.442  -8.126
  150    H1*    U  14           H1*        U  14   1.243  15.912  -7.224
  151    H3     U  14           H3         U  14   0.214  19.401  -4.069
  152    H5     U  14           H5         U  14  -3.132  17.012  -4.902
  153    H6     U  14           H6         U  14  -1.925  16.071  -6.732
  154   1H5*    C  15          1H5*        C  15   3.180  13.077  -9.254
  155   2H5*    C  15          2H5*        C  15   1.427  13.204  -9.003
  156    H4*    C  15           H4*        C  15   3.430  13.765  -6.837
  157    H3*    C  15           H3*        C  15   2.235  11.067  -7.513
  158    H2*    C  15           H2*        C  15   2.253  10.641  -5.137
  159   2HO*    C  15          2HO*        C  15   4.281  12.190  -5.118
  160    H1*    C  15           H1*        C  15   1.038  13.074  -4.523
  161   1H4     C  15          1H4         C  15  -3.504   9.230  -7.342
  162   2H4     C  15          2H4         C  15  -3.550   8.790  -5.639
  163    H5     C  15           H5         C  15  -2.061   9.759  -3.996
  164    H6     C  15           H6         C  15  -0.098  11.094  -3.683
  165   1H5*    G  16          1H5*        G  16   6.551   7.950  -8.953
  166   2H5*    G  16          2H5*        G  16   4.804   8.173  -9.164
  167    H4*    G  16           H4*        G  16   5.274   6.463  -7.516
  168    H3*    G  16           H3*        G  16   3.918   8.948  -6.508
  169    H2*    G  16           H2*        G  16   3.898   8.002  -4.296
  170   2HO*    G  16          2HO*        G  16   3.391   5.854  -4.744
  171    H1*    G  16           H1*        G  16   6.523   7.028  -4.392
  172    H8     G  16           H8         G  16   4.446  10.190  -4.854
  173    H1     G  16           H1         G  16  10.111  11.041  -1.982
  174   1H2     G  16          1H2         G  16  11.297   9.183  -2.067
  175   2H2     G  16          2H2         G  16  10.680   7.734  -2.828
  176   1H5*    U  17          1H5*        U  17   0.819   7.387  -3.565
  177   2H5*    U  17          2H5*        U  17   0.080   8.941  -3.985
  178    H4*    U  17           H4*        U  17   2.807   8.581  -2.781
  179    H3*    U  17           H3*        U  17   0.449   8.314  -1.370
  180    H2*    U  17           H2*        U  17  -0.248  10.540  -1.452
  181   2HO*    U  17          2HO*        U  17   1.415  10.067   0.673
  182    H1*    U  17           H1*        U  17   2.672  11.431  -1.517
  183    H3     U  17           H3         U  17   2.228  15.492  -3.299
  184    H5     U  17           H5         U  17  -1.718  14.176  -2.824
  185    H6     U  17           H6         U  17  -0.841  12.013  -2.231
  186   1H5*    C  18          1H5*        C  18   2.296  11.820   0.007
  187   2H5*    C  18          2H5*        C  18   4.043  12.108  -0.099
  188    H4*    C  18           H4*        C  18   3.562  11.931   2.583
  189    H3*    C  18           H3*        C  18   1.028  12.242   1.700
  190    H2*    C  18           H2*        C  18   1.180  14.378   0.695
  191   2HO*    C  18          2HO*        C  18   1.175  14.953   3.488
  192    H1*    C  18           H1*        C  18   3.249  15.298   2.742
  193   1H4     C  18          1H4         C  18   4.865  19.575  -1.582
  194   2H4     C  18          2H4         C  18   3.702  18.950  -2.733
  195    H5     C  18           H5         C  18   2.375  16.969  -2.290
  196    H6     C  18           H6         C  18   1.957  15.165  -0.728
  197   1H5*    G  19          1H5*        G  19   0.024  13.911   3.123
  198   2H5*    G  19          2H5*        G  19  -1.168  14.269   4.374
  199    H4*    G  19           H4*        G  19  -2.060  14.865   2.266
  200    H3*    G  19           H3*        G  19  -3.330  12.500   3.554
  201    H2*    G  19           H2*        G  19  -4.447  11.908   1.628
  202   2HO*    G  19          2HO*        G  19  -5.718  13.854   1.813
  203    H1*    G  19           H1*        G  19  -2.873  13.885  -0.080
  204    H8     G  19           H8         G  19  -1.223  10.635   0.311
  205    H1     G  19           H1         G  19  -5.871  10.799  -4.133
  206   1H2     G  19          1H2         G  19  -6.952  12.337  -4.043
  207   2H2     G  19          2H2         G  19  -6.975  13.639  -2.973
  208   1H5*    C  20          1H5*        C  20  -6.606  15.375   2.857
  209   2H5*    C  20          2H5*        C  20  -7.604  15.357   4.322
  210    H4*    C  20           H4*        C  20  -9.156  15.039   2.685
  211    H3*    C  20           H3*        C  20  -8.393  12.261   3.581
  212    H2*    C  20           H2*        C  20  -9.992  11.438   1.997
  213   2HO*    C  20          2HO*        C  20 -11.247  13.669   2.641
  214    H1*    C  20           H1*        C  20  -9.427  13.464   0.051
  215   1H4     C  20          1H4         C  20  -6.673   8.508  -2.523
  216   2H4     C  20          2H4         C  20  -5.386   8.332  -1.491
  217    H5     C  20           H5         C  20  -5.409   9.945   0.642
  218    H6     C  20           H6         C  20  -6.643  11.754   1.731
  219   1H5*    C  21          1H5*        C  21 -12.392  12.192   3.342
  220   2H5*    C  21          2H5*        C  21 -13.141  11.498   4.793
  221    H4*    C  21           H4*        C  21 -14.050  10.293   3.021
  222    H3*    C  21           H3*        C  21 -11.833   8.663   4.258
  223    H2*    C  21           H2*        C  21 -12.344   6.931   2.678
  224   2HO*    C  21          2HO*        C  21 -14.783   7.914   2.949
  225    H1*    C  21           H1*        C  21 -12.897   8.726   0.525
  226   1H4     C  21          1H4         C  21  -7.217   6.462  -0.876
  227   2H4     C  21          2H4         C  21  -6.330   7.252   0.279
  228    H5     C  21           H5         C  21  -7.728   8.709   2.005
  229    H6     C  21           H6         C  21  -9.986   9.402   2.628
  230   1H5*    C  22          1H5*        C  22 -11.494   5.250   5.893
  231   2H5*    C  22          2H5*        C  22 -11.418   6.265   4.441
  232    H4*    C  22           H4*        C  22 -13.188   3.974   4.129
  233    H3*    C  22           H3*        C  22 -10.394   3.416   5.047
  234    H2*    C  22           H2*        C  22 -10.043   1.871   3.281
  235   2HO*    C  22          2HO*        C  22 -11.695   0.880   2.215
  236    H1*    C  22           H1*        C  22 -11.457   3.247   1.285
  237   1H4     C  22          1H4         C  22  -5.352   4.309   0.317
  238   2H4     C  22          2H4         C  22  -5.113   5.490   1.455
  239    H5     C  22           H5         C  22  -7.207   5.949   3.048
  240    H6     C  22           H6         C  22  -9.530   5.381   3.457
  241   1H5*    C  23          1H5*        C  23 -12.068  -0.103   3.506
  242   2H5*    C  23          2H5*        C  23 -11.835  -1.383   4.711
  243    H4*    C  23           H4*        C  23 -11.026  -2.089   2.556
  244    H3*    C  23           H3*        C  23  -9.042  -1.813   4.767
  245    H2*    C  23           H2*        C  23  -7.222  -2.333   3.290
  246   2HO*    C  23          2HO*        C  23  -8.117  -4.014   2.122
  247    H1*    C  23           H1*        C  23  -8.094  -0.810   1.110
  248   1H4     C  23          1H4         C  23  -4.242   3.214   4.110
  249   2H4     C  23          2H4         C  23  -5.466   3.548   5.317
  250    H5     C  23           H5         C  23  -7.589   2.383   5.391
  251    H6     C  23           H6         C  23  -8.979   0.704   4.294
  252   1H5*    G  24          1H5*        G  24  -6.463  -6.480   3.622
  253   2H5*    G  24          2H5*        G  24  -6.190  -4.932   4.443
  254    H4*    G  24           H4*        G  24  -6.382  -5.154   1.454
  255    H3*    G  24           H3*        G  24  -4.402  -6.534   2.534
  256    H2*    G  24           H2*        G  24  -3.508  -4.914   4.038
  257   2HO*    G  24          2HO*        G  24  -1.827  -3.698   2.813
  258    H1*    G  24           H1*        G  24  -3.793  -2.625   2.069
  259    H8     G  24           H8         G  24  -6.083  -3.040   5.008
  260    H1     G  24           H1         G  24  -0.953   0.613   6.217
  261   1H2     G  24          1H2         G  24   0.459   0.511   4.561
  262   2H2     G  24          2H2         G  24   0.176  -0.455   3.138
  263   1H5*    A  25          1H5*        A  25  -2.853  -8.893  -1.396
  264   2H5*    A  25          2H5*        A  25  -1.311  -8.948  -0.522
  265    H4*    A  25           H4*        A  25  -1.894  -7.964  -3.147
  266    H3*    A  25           H3*        A  25   0.547  -8.703  -1.630
  267    H2*    A  25           H2*        A  25   1.939  -7.167  -2.824
  268   2HO*    A  25          2HO*        A  25   1.036  -7.707  -4.892
  269    H1*    A  25           H1*        A  25   0.163  -5.034  -2.982
  270    H8     A  25           H8         A  25  -0.650  -6.017   0.386
  271   1H6     A  25          1H6         A  25   4.522  -3.232   2.313
  272   2H6     A  25          2H6         A  25   2.986  -3.909   2.816
  273    H2     A  25           H2         A  25   4.873  -3.892  -2.097
  274   1H5*    G  26          1H5*        G  26   2.950  -8.978  -5.554
  275   2H5*    G  26          2H5*        G  26   3.918 -10.295  -4.865
  276    H4*    G  26           H4*        G  26   5.001  -7.990  -5.293
  277    H3*    G  26           H3*        G  26   5.472  -9.818  -3.008
  278    H2*    G  26           H2*        G  26   6.615  -8.167  -1.718
  279   2HO*    G  26          2HO*        G  26   6.530  -6.325  -3.865
  280    H1*    G  26           H1*        G  26   5.021  -5.975  -2.327
  281    H8     G  26           H8         G  26   2.609  -8.735  -2.071
  282    H1     G  26           H1         G  26   4.497  -6.517   3.612
  283   1H2     G  26          1H2         G  26   6.117  -5.480   3.540
  284   2H2     G  26          2H2         G  26   7.125  -5.028   2.278
  285   1H5*    C  27          1H5*        C  27   9.554  -7.118  -3.404
  286   2H5*    C  27          2H5*        C  27  10.370  -8.558  -4.043
  287    H4*    C  27           H4*        C  27  11.799  -7.773  -2.395
  288    H3*    C  27           H3*        C  27  10.175 -10.081  -1.393
  289    H2*    C  27           H2*        C  27  11.189  -9.880   0.770
  290   2HO*    C  27          2HO*        C  27  13.216  -8.945  -0.627
  291    H1*    C  27           H1*        C  27  10.980  -7.110   0.944
  292   1H4     C  27          1H4         C  27   5.667  -9.292   3.573
  293   2H4     C  27          2H4         C  27   4.827  -9.567   2.175
  294    H5     C  27           H5         C  27   6.182  -9.251  -0.074
  295    H6     C  27           H6         C  27   8.332  -8.603  -1.012
  296   1H5*    G  28          1H5*        G  28  13.666 -10.665   0.110
  297   2H5*    G  28          2H5*        G  28  14.393 -12.240  -0.266
  298    H4*    G  28           H4*        G  28  14.535 -12.057   2.049
  299    H3*    G  28           H3*        G  28  12.195 -13.801   1.311
  300    H2*    G  28           H2*        G  28  11.741 -14.085   3.651
  301   2HO*    G  28          2HO*        G  28  14.351 -13.806   3.825
  302    H1*    G  28           H1*        G  28  12.286 -11.405   4.350
  303    H8     G  28           H8         G  28  10.266 -11.405   1.216
  304    H1     G  28           H1         G  28   6.799 -12.194   6.550
  305   1H2     G  28          1H2         G  28   8.093 -12.664   8.241
  306   2H2     G  28          2H2         G  28   9.831 -12.786   8.080
  307   1H5*    C  29          1H5*        C  29  14.128 -15.889   4.291
  308   2H5*    C  29          2H5*        C  29  14.598 -17.485   3.671
  309    H4*    C  29           H4*        C  29  13.586 -17.958   5.696
  310    H3*    C  29           H3*        C  29  11.670 -18.418   3.438
  311    H2*    C  29           H2*        C  29   9.946 -18.995   4.997
  312   2HO*    C  29          2HO*        C  29  10.583 -20.059   6.719
  313    H1*    C  29           H1*        C  29  10.557 -16.993   6.880
  314   1H4     C  29          1H4         C  29   5.881 -14.423   3.563
  315   2H4     C  29          2H4         C  29   6.795 -13.770   2.353
  316    H5     C  29           H5         C  29   9.390 -14.395   2.403
  317    H6     C  29           H6         C  29  11.069 -15.732   3.567
  318   1H5*    C  30          1H5*        C  30  11.045 -21.666   5.787
  319   2H5*    C  30          2H5*        C  30  11.493 -23.137   4.899
  320    H4*    C  30           H4*        C  30   9.402 -23.617   5.791
  321    H3*    C  30           H3*        C  30   9.186 -22.840   2.898
  322    H2*    C  30           H2*        C  30   6.824 -23.047   2.996
  323   2HO*    C  30          2HO*        C  30   7.400 -24.961   4.727
  324    H1*    C  30           H1*        C  30   6.510 -21.978   5.600
  325   1H4     C  30          1H4         C  30   4.903 -17.405   1.608
  326   2H4     C  30          2H4         C  30   6.393 -17.095   0.952
  327    H5     C  30           H5         C  30   8.350 -18.712   1.749
  328    H6     C  30           H6         C  30   8.910 -20.535   3.247
  329    H3T    C  30           H3T        C  30   9.522 -24.823   2.687
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  -5.391 -13.759   4.673
    2   2H5*    G   1          2H5*        G   1  -5.629 -12.007   4.541
    3    H4*    G   1           H4*        G   1  -5.507 -12.400   6.818
    4    H3*    G   1           H3*        G   1  -2.917 -11.320   5.781
    5    H2*    G   1           H2*        G   1  -1.918 -11.542   7.947
    6   2HO*    G   1          2HO*        G   1  -3.148 -11.285   9.650
    7    H1*    G   1           H1*        G   1  -3.002 -14.051   8.543
    8    H8     G   1           H8         G   1  -2.097 -13.958   4.905
    9    H1     G   1           H1         G   1   2.771 -15.261   8.856
   10   1H2     G   1          1H2         G   1   2.360 -14.965  10.695
   11   2H2     G   1          2H2         G   1   0.975 -14.416  11.477
   12    H5T    G   1           H5T        G   1  -4.019 -12.375   3.148
   13   1H5*    G   2          1H5*        G   2  -3.786  -9.581   9.319
   14   2H5*    G   2          2H5*        G   2  -3.915  -7.813   9.219
   15    H4*    G   2           H4*        G   2  -2.622  -8.206  11.109
   16    H3*    G   2           H3*        G   2  -0.946  -7.376   8.772
   17    H2*    G   2           H2*        G   2   1.053  -7.644  10.074
   18   2HO*    G   2          2HO*        G   2  -0.552  -7.011  12.053
   19    H1*    G   2           H1*        G   2   0.331 -10.063  11.255
   20    H8     G   2           H8         G   2  -0.895  -9.822   7.680
   21    H1     G   2           H1         G   2   5.079 -12.006   8.405
   22   1H2     G   2          1H2         G   2   5.751 -11.797  10.184
   23   2H2     G   2          2H2         G   2   5.069 -11.172  11.590
   24   1H5*    U   3          1H5*        U   3   0.693  -5.400  11.734
   25   2H5*    U   3          2H5*        U   3   0.787  -3.651  11.446
   26    H4*    U   3           H4*        U   3   2.968  -4.271  11.950
   27    H3*    U   3           H3*        U   3   2.582  -3.957   8.996
   28    H2*    U   3           H2*        U   3   4.854  -4.627   8.608
   29   2HO*    U   3          2HO*        U   3   6.326  -4.283  10.095
   30    H1*    U   3           H1*        U   3   4.828  -6.777  10.379
   31    H3     U   3           H3         U   3   4.620  -8.925   6.433
   32    H5     U   3           H5         U   3   0.787  -7.299   6.892
   33    H6     U   3           H6         U   3   1.597  -6.117   8.825
   34   1H5*    G   4          1H5*        G   4   6.099  -2.485   9.862
   35   2H5*    G   4          2H5*        G   4   6.392  -0.847   9.245
   36    H4*    G   4           H4*        G   4   8.215  -2.085   8.511
   37    H3*    G   4           H3*        G   4   6.233  -1.820   6.259
   38    H2*    G   4           H2*        G   4   7.780  -3.033   4.870
   39   2HO*    G   4          2HO*        G   4   9.867  -2.993   5.282
   40    H1*    G   4           H1*        G   4   8.427  -4.933   6.853
   41    H8     G   4           H8         G   4   4.745  -4.082   6.824
   42    H1     G   4           H1         G   4   6.540  -8.641   2.700
   43   1H2     G   4          1H2         G   4   8.421  -8.803   2.517
   44   2H2     G   4          2H2         G   4   9.713  -7.983   3.216
   45   1H5*    C   5          1H5*        C   5   9.721  -1.175   5.139
   46   2H5*    C   5          2H5*        C   5  10.219   0.282   4.258
   47    H4*    C   5           H4*        C   5  11.099  -1.438   2.993
   48    H3*    C   5           H3*        C   5   8.514  -0.515   1.779
   49    H2*    C   5           H2*        C   5   8.674  -2.218   0.119
   50   2HO*    C   5          2HO*        C   5  11.262  -1.723   0.419
   51    H1*    C   5           H1*        C   5   9.857  -4.183   1.805
   52   1H4     C   5          1H4         C   5   3.984  -6.317   1.332
   53   2H4     C   5          2H4         C   5   3.278  -5.288   2.412
   54    H5     C   5           H5         C   5   4.826  -3.348   3.359
   55    H6     C   5           H6         C   5   7.073  -2.389   3.265
   56   1H5*    G   6          1H5*        G   6   7.110   0.587  -1.389
   57   2H5*    G   6          2H5*        G   6   7.496  -0.349   0.066
   58    H4*    G   6           H4*        G   6   8.539  -1.649  -2.276
   59    H3*    G   6           H3*        G   6   5.793  -0.619  -2.608
   60    H2*    G   6           H2*        G   6   4.809  -2.754  -2.975
   61   2HO*    G   6          2HO*        G   6   6.548  -3.444  -4.408
   62    H1*    G   6           H1*        G   6   6.201  -4.232  -1.103
   63    H8     G   6           H8         G   6   5.797  -0.915   0.404
   64    H1     G   6           H1         G   6   0.438  -4.385   0.776
   65   1H2     G   6          1H2         G   6   0.522  -6.081  -0.627
   66   2H2     G   6          2H2         G   6   1.952  -6.341  -1.601
   67   1H5*    A   7          1H5*        A   7   7.553  -2.482  -5.581
   68   2H5*    A   7          2H5*        A   7   8.030  -2.166  -7.260
   69    H4*    A   7           H4*        A   7   6.796  -3.982  -7.671
   70    H3*    A   7           H3*        A   7   4.618  -1.893  -7.474
   71    H2*    A   7           H2*        A   7   3.067  -3.667  -7.887
   72   2HO*    A   7          2HO*        A   7   3.777  -5.694  -8.658
   73    H1*    A   7           H1*        A   7   4.582  -5.603  -6.398
   74    H8     A   7           H8         A   7   3.814  -2.510  -4.294
   75   1H6     A   7          1H6         A   7  -1.471  -5.450  -2.936
   76   2H6     A   7          2H6         A   7  -0.437  -4.092  -2.549
   77    H2     A   7           H2         A   7   0.500  -7.634  -6.307
   78   1H5*    A   8          1H5*        A   8   2.263  -1.048 -10.939
   79   2H5*    A   8          2H5*        A   8   1.421  -0.507  -9.475
   80    H4*    A   8           H4*        A   8   2.297  -3.301 -10.182
   81    H3*    A   8           H3*        A   8  -0.386  -1.979 -10.035
   82    H2*    A   8           H2*        A   8  -1.325  -3.890  -8.956
   83   2HO*    A   8          2HO*        A   8   0.309  -5.134 -10.575
   84    H1*    A   8           H1*        A   8   1.017  -4.648  -7.518
   85    H8     A   8           H8         A   8   1.238  -1.681  -6.020
   86   1H6     A   8          1H6         A   8  -4.125  -2.503  -3.029
   87   2H6     A   8          2H6         A   8  -2.703  -1.545  -2.872
   88    H2     A   8           H2         A   8  -4.154  -5.129  -6.488
   89   1H5*    G   9          1H5*        G   9  -2.926  -1.356 -11.056
   90   2H5*    G   9          2H5*        G   9  -2.112  -2.666 -10.185
   91    H4*    G   9           H4*        G   9  -4.194  -3.851 -11.653
   92    H3*    G   9           H3*        G   9  -4.993  -1.170 -10.763
   93    H2*    G   9           H2*        G   9  -6.698  -1.854  -9.262
   94   2HO*    G   9          2HO*        G   9  -7.534  -4.000  -9.350
   95    H1*    G   9           H1*        G   9  -5.520  -4.120  -8.195
   96    H8     G   9           H8         G   9  -2.572  -1.992  -8.482
   97    H1     G   9           H1         G   9  -6.461  -0.267  -3.702
   98   1H2     G   9          1H2         G   9  -8.214  -1.053  -3.827
   99   2H2     G   9          2H2         G   9  -8.898  -2.110  -4.944
  100   1H5*    G  10          1H5*        G  10  -6.130   1.738 -12.553
  101   2H5*    G  10          2H5*        G  10  -5.562   0.412 -11.524
  102    H4*    G  10           H4*        G  10  -8.399   0.276 -12.249
  103    H3*    G  10           H3*        G  10  -7.370   2.726 -10.905
  104    H2*    G  10           H2*        G  10  -9.031   2.581  -9.177
  105   2HO*    G  10          2HO*        G  10 -10.450   1.506 -11.081
  106    H1*    G  10           H1*        G  10  -8.818  -0.152  -8.727
  107    H8     G  10           H8         G  10  -5.387   0.187  -9.309
  108    H1     G  10           H1         G  10  -6.957   3.452  -4.033
  109   1H2     G  10          1H2         G  10  -8.844   3.698  -3.811
  110   2H2     G  10          2H2         G  10 -10.171   3.252  -4.741
  111   1H5*    G  11          1H5*        G  11 -11.201   3.887 -11.368
  112   2H5*    G  11          2H5*        G  11 -11.306   5.372 -12.337
  113    H4*    G  11           H4*        G  11 -12.431   5.825 -10.338
  114    H3*    G  11           H3*        G  11  -9.726   7.106 -10.411
  115    H2*    G  11           H2*        G  11 -10.010   7.902  -8.174
  116   2HO*    G  11          2HO*        G  11 -11.952   8.329  -7.446
  117    H1*    G  11           H1*        G  11 -11.083   5.561  -7.147
  118    H8     G  11           H8         G  11  -8.498   4.264  -9.448
  119    H1     G  11           H1         G  11  -6.182   6.838  -4.072
  120   1H2     G  11          1H2         G  11  -7.507   7.880  -3.113
  121   2H2     G  11          2H2         G  11  -9.123   8.223  -3.454
  122   1H5*    C  12          1H5*        C  12 -12.224   9.572  -8.641
  123   2H5*    C  12          2H5*        C  12 -12.330  11.179  -9.386
  124    H4*    C  12           H4*        C  12 -12.097  11.566  -7.095
  125    H3*    C  12           H3*        C  12  -9.507  12.035  -8.545
  126    H2*    C  12           H2*        C  12  -8.463  12.583  -6.459
  127   2HO*    C  12          2HO*        C  12  -9.711  13.709  -5.158
  128    H1*    C  12           H1*        C  12  -9.767  10.580  -4.946
  129   1H4     C  12          1H4         C  12  -4.039   8.245  -6.211
  130   2H4     C  12          2H4         C  12  -4.416   7.549  -7.662
  131    H5     C  12           H5         C  12  -6.860   8.034  -8.587
  132    H6     C  12           H6         C  12  -8.935   9.235  -8.138
  133   1H5*    G  13          1H5*        G  13  -6.994  15.214  -8.513
  134   2H5*    G  13          2H5*        G  13  -7.676  13.608  -8.187
  135    H4*    G  13           H4*        G  13  -7.946  15.199  -5.848
  136    H3*    G  13           H3*        G  13  -5.331  15.623  -7.177
  137    H2*    G  13           H2*        G  13  -4.068  14.920  -5.279
  138   2HO*    G  13          2HO*        G  13  -4.916  15.716  -3.474
  139    H1*    G  13           H1*        G  13  -5.668  12.796  -4.473
  140    H8     G  13           H8         G  13  -5.759  12.599  -8.139
  141    H1     G  13           H1         G  13  -0.285  10.368  -5.678
  142   1H2     G  13          1H2         G  13  -0.066  11.028  -3.581
  143   2H2     G  13          2H2         G  13  -1.287  12.003  -2.794
  144   1H5*    U  14          1H5*        U  14  -2.571  17.095  -7.734
  145   2H5*    U  14          2H5*        U  14  -3.473  15.991  -6.684
  146    H4*    U  14           H4*        U  14  -2.514  17.485  -4.773
  147    H3*    U  14           H3*        U  14  -1.312  19.032  -6.526
  148    H2*    U  14           H2*        U  14  -0.129  17.400  -7.815
  149   2HO*    U  14          2HO*        U  14   2.022  17.120  -6.723
  150    H1*    U  14           H1*        U  14   0.726  15.754  -5.422
  151    H3     U  14           H3         U  14   2.030  13.643  -9.360
  152    H5     U  14           H5         U  14  -2.005  12.716  -8.695
  153    H6     U  14           H6         U  14  -2.013  14.356  -6.924
  154   1H5*    C  15          1H5*        C  15  -3.524  19.198  -1.412
  155   2H5*    C  15          2H5*        C  15  -2.329  20.499  -1.574
  156    H4*    C  15           H4*        C  15  -1.871  19.314   0.440
  157    H3*    C  15           H3*        C  15   0.112  18.796  -1.756
  158    H2*    C  15           H2*        C  15   1.336  17.341  -0.285
  159   2HO*    C  15          2HO*        C  15   0.094  18.807   1.630
  160    H1*    C  15           H1*        C  15  -0.918  15.984   0.629
  161   1H4     C  15          1H4         C  15  -0.536  13.367  -5.310
  162   2H4     C  15          2H4         C  15   1.161  13.237  -4.888
  163    H5     C  15           H5         C  15   2.096  14.249  -2.904
  164    H6     C  15           H6         C  15   1.601  15.566  -0.919
  165   1H5*    G  16          1H5*        G  16  -0.191  21.320   3.800
  166   2H5*    G  16          2H5*        G  16   1.387  20.690   3.290
  167    H4*    G  16           H4*        G  16   0.850  19.593   5.294
  168    H3*    G  16           H3*        G  16   0.538  17.819   2.902
  169    H2*    G  16           H2*        G  16  -0.325  16.055   4.271
  170   2HO*    G  16          2HO*        G  16   1.307  16.987   6.017
  171    H1*    G  16           H1*        G  16  -1.935  17.664   5.912
  172    H8     G  16           H8         G  16  -1.413  17.711   2.067
  173    H1     G  16           H1         G  16  -7.212  15.961   4.164
  174   1H2     G  16          1H2         G  16  -7.274  16.011   6.368
  175   2H2     G  16          2H2         G  16  -5.882  16.486   7.316
  176   1H5*    U  17          1H5*        U  17   4.409  16.292   1.220
  177   2H5*    U  17          2H5*        U  17   3.029  15.771   0.236
  178    H4*    U  17           H4*        U  17   3.916  14.812   2.916
  179    H3*    U  17           H3*        U  17   4.397  13.660   0.498
  180    H2*    U  17           H2*        U  17   2.207  13.035  -0.100
  181   2HO*    U  17          2HO*        U  17   3.153  11.194   1.816
  182    H1*    U  17           H1*        U  17   1.465  12.536   2.817
  183    H3     U  17           H3         U  17  -2.938  13.655   2.540
  184    H5     U  17           H5         U  17  -1.634  13.224  -1.429
  185    H6     U  17           H6         U  17   0.619  13.098  -0.582
  186   1H5*    C  18          1H5*        C  18   6.950  10.294   0.998
  187   2H5*    C  18          2H5*        C  18   6.926  10.884  -0.677
  188    H4*    C  18           H4*        C  18   4.583  10.808   1.190
  189    H3*    C  18           H3*        C  18   5.478   8.693  -0.456
  190    H2*    C  18           H2*        C  18   4.200   9.175  -2.302
  191   2HO*    C  18          2HO*        C  18   2.176   8.792  -0.355
  192    H1*    C  18           H1*        C  18   2.428  11.096  -0.730
  193   1H4     C  18          1H4         C  18   3.196  13.612  -6.739
  194   2H4     C  18          2H4         C  18   2.229  12.213  -7.153
  195    H5     C  18           H5         C  18   1.679  10.489  -5.522
  196    H6     C  18           H6         C  18   1.843   9.827  -3.215
  197   1H5*    G  19          1H5*        G  19   2.794   9.572   1.511
  198   2H5*    G  19          2H5*        G  19   1.890   9.130   2.967
  199    H4*    G  19           H4*        G  19   0.736  10.751   1.689
  200    H3*    G  19           H3*        G  19  -0.516   8.072   1.979
  201    H2*    G  19           H2*        G  19  -1.977   8.363   0.223
  202   2HO*    G  19          2HO*        G  19  -3.168   9.895   1.458
  203    H1*    G  19           H1*        G  19  -0.741  10.980  -0.638
  204    H8     G  19           H8         G  19   1.167   8.367  -2.070
  205    H1     G  19           H1         G  19  -4.455   9.009  -5.097
  206   1H2     G  19          1H2         G  19  -5.703  10.097  -4.136
  207   2H2     G  19          2H2         G  19  -5.606  10.892  -2.655
  208   1H5*    C  20          1H5*        C  20  -3.597  10.996   2.990
  209   2H5*    C  20          2H5*        C  20  -4.406  10.433   4.465
  210    H4*    C  20           H4*        C  20  -6.163  10.870   3.062
  211    H3*    C  20           H3*        C  20  -5.574   7.926   2.755
  212    H2*    C  20           H2*        C  20  -7.450   7.827   1.264
  213   2HO*    C  20          2HO*        C  20  -8.365   9.734   2.829
  214    H1*    C  20           H1*        C  20  -6.886  10.351   0.052
  215   1H4     C  20          1H4         C  20  -5.019   6.028  -4.104
  216   2H4     C  20          2H4         C  20  -3.490   5.792  -3.516
  217    H5     C  20           H5         C  20  -2.961   6.985  -1.188
  218    H6     C  20           H6         C  20  -3.887   8.456   0.528
  219   1H5*    C  21          1H5*        C  21  -9.407   8.135   2.949
  220   2H5*    C  21          2H5*        C  21 -10.147   7.079   4.166
  221    H4*    C  21           H4*        C  21 -11.317   6.619   2.216
  222    H3*    C  21           H3*        C  21  -9.223   4.470   2.560
  223    H2*    C  21           H2*        C  21 -10.136   3.435   0.592
  224   2HO*    C  21          2HO*        C  21 -12.368   4.600   1.498
  225    H1*    C  21           H1*        C  21 -10.640   5.918  -0.746
  226   1H4     C  21          1H4         C  21  -5.598   3.462  -3.587
  227   2H4     C  21          2H4         C  21  -4.441   3.944  -2.501
  228    H5     C  21           H5         C  21  -5.376   5.119  -0.298
  229    H6     C  21           H6         C  21  -7.414   5.824   0.847
  230   1H5*    C  22          1H5*        C  22 -12.306   2.665   1.521
  231   2H5*    C  22          2H5*        C  22 -13.059   1.653   2.768
  232    H4*    C  22           H4*        C  22 -13.167   0.173   1.090
  233    H3*    C  22           H3*        C  22 -10.388  -0.236   2.166
  234    H2*    C  22           H2*        C  22  -9.926  -1.740   0.384
  235   2HO*    C  22          2HO*        C  22 -11.714  -3.037   0.412
  236    H1*    C  22           H1*        C  22 -11.490  -0.383  -1.579
  237   1H4     C  22          1H4         C  22  -5.577   0.750  -3.245
  238   2H4     C  22          2H4         C  22  -5.116   1.722  -1.985
  239    H5     C  22           H5         C  22  -6.958   2.074  -0.078
  240    H6     C  22           H6         C  22  -9.233   1.513   0.588
  241   1H5*    C  23          1H5*        C  23  -9.077  -4.619   2.472
  242   2H5*    C  23          2H5*        C  23  -8.682  -2.995   1.879
  243    H4*    C  23           H4*        C  23  -9.834  -5.103   0.077
  244    H3*    C  23           H3*        C  23  -7.051  -5.026   1.093
  245    H2*    C  23           H2*        C  23  -6.063  -5.045  -1.072
  246   2HO*    C  23          2HO*        C  23  -8.204  -6.498  -1.609
  247    H1*    C  23           H1*        C  23  -7.874  -3.373  -2.386
  248   1H4     C  23          1H4         C  23  -3.066   0.366  -0.510
  249   2H4     C  23          2H4         C  23  -4.052   0.886   0.838
  250    H5     C  23           H5         C  23  -6.190  -0.126   1.370
  251    H6     C  23           H6         C  23  -7.810  -1.817   0.708
  252   1H5*    G  24          1H5*        G  24  -4.225  -7.385   1.859
  253   2H5*    G  24          2H5*        G  24  -5.365  -6.088   1.460
  254    H4*    G  24           H4*        G  24  -5.359  -7.824  -0.742
  255    H3*    G  24           H3*        G  24  -3.030  -8.530   0.264
  256    H2*    G  24           H2*        G  24  -2.044  -6.407   0.696
  257   2HO*    G  24          2HO*        G  24  -1.382  -7.459  -1.732
  258    H1*    G  24           H1*        G  24  -3.033  -5.135  -1.862
  259    H8     G  24           H8         G  24  -4.763  -4.401   1.357
  260    H1     G  24           H1         G  24   0.149  -0.461   0.117
  261   1H2     G  24          1H2         G  24   1.311  -1.188  -1.555
  262   2H2     G  24          2H2         G  24   0.901  -2.664  -2.396
  263   1H5*    A  25          1H5*        A  25  -2.988 -10.593  -4.672
  264   2H5*    A  25          2H5*        A  25  -2.693 -12.093  -3.771
  265    H4*    A  25           H4*        A  25  -1.221 -11.879  -5.699
  266    H3*    A  25           H3*        A  25   0.132 -11.868  -3.005
  267    H2*    A  25           H2*        A  25   2.236 -11.740  -4.159
  268   2HO*    A  25          2HO*        A  25   2.011 -13.216  -5.795
  269    H1*    A  25           H1*        A  25   1.258 -10.039  -6.240
  270    H8     A  25           H8         A  25   0.257  -8.617  -2.912
  271   1H6     A  25          1H6         A  25   5.630  -5.567  -3.040
  272   2H6     A  25          2H6         A  25   4.061  -5.658  -2.267
  273    H2     A  25           H2         A  25   5.807  -8.813  -6.117
  274   1H5*    G  26          1H5*        G  26   3.398 -15.352  -3.045
  275   2H5*    G  26          2H5*        G  26   3.564 -14.268  -1.651
  276    H4*    G  26           H4*        G  26   4.781 -14.143  -4.284
  277    H3*    G  26           H3*        G  26   5.474 -13.285  -1.546
  278    H2*    G  26           H2*        G  26   6.511 -11.242  -2.216
  279   2HO*    G  26          2HO*        G  26   7.249 -12.698  -4.240
  280    H1*    G  26           H1*        G  26   4.799 -10.517  -4.266
  281    H8     G  26           H8         G  26   2.099 -11.519  -2.326
  282    H1     G  26           H1         G  26   5.050  -6.594   0.462
  283   1H2     G  26          1H2         G  26   6.887  -6.386  -0.093
  284   2H2     G  26          2H2         G  26   7.845  -7.221  -1.195
  285   1H5*    C  27          1H5*        C  27   9.182 -14.623  -3.001
  286   2H5*    C  27          2H5*        C  27  10.079 -15.855  -2.092
  287    H4*    C  27           H4*        C  27  11.216 -13.883  -1.649
  288    H3*    C  27           H3*        C  27   9.360 -14.489   0.643
  289    H2*    C  27           H2*        C  27  10.150 -12.526   1.733
  290   2HO*    C  27          2HO*        C  27  12.266 -12.292   1.550
  291    H1*    C  27           H1*        C  27  10.371 -10.963  -0.636
  292   1H4     C  27          1H4         C  27   5.236  -9.165   2.626
  293   2H4     C  27          2H4         C  27   4.158 -10.111   1.805
  294    H5     C  27           H5         C  27   5.233 -11.861   0.116
  295    H6     C  27           H6         C  27   7.312 -12.612  -0.892
  296   1H5*    G  28          1H5*        G  28  13.096 -13.792   2.350
  297   2H5*    G  28          2H5*        G  28  13.552 -15.180   3.356
  298    H4*    G  28           H4*        G  28  13.959 -13.339   4.704
  299    H3*    G  28           H3*        G  28  11.296 -14.530   5.454
  300    H2*    G  28           H2*        G  28  11.123 -12.854   7.174
  301   2HO*    G  28          2HO*        G  28  13.702 -13.051   7.238
  302    H1*    G  28           H1*        G  28  12.052 -10.756   5.556
  303    H8     G  28           H8         G  28   9.827 -12.875   3.457
  304    H1     G  28           H1         G  28   6.672  -8.829   7.293
  305   1H2     G  28          1H2         G  28   8.009  -8.013   8.813
  306   2H2     G  28          2H2         G  28   9.702  -8.444   8.888
  307   1H5*    C  29          1H5*        C  29  13.171 -14.020   9.075
  308   2H5*    C  29          2H5*        C  29  13.293 -15.592   9.890
  309    H4*    C  29           H4*        C  29  12.459 -14.182  11.522
  310    H3*    C  29           H3*        C  29  10.237 -15.793  10.316
  311    H2*    C  29           H2*        C  29   8.644 -14.648  11.697
  312   2HO*    C  29          2HO*        C  29  10.770 -14.434  13.300
  313    H1*    C  29           H1*        C  29   9.753 -12.091  11.382
  314   1H4     C  29          1H4         C  29   5.218 -12.304   7.030
  315   2H4     C  29          2H4         C  29   6.116 -12.946   5.800
  316    H5     C  29           H5         C  29   8.605 -13.664   6.451
  317    H6     C  29           H6         C  29  10.171 -13.862   8.314
  318   1H5*    C  30          1H5*        C  30   9.295 -15.763  14.110
  319   2H5*    C  30          2H5*        C  30   9.447 -17.373  14.844
  320    H4*    C  30           H4*        C  30   7.403 -16.577  15.612
  321    H3*    C  30           H3*        C  30   7.022 -18.487  13.328
  322    H2*    C  30           H2*        C  30   4.675 -18.145  13.401
  323   2HO*    C  30          2HO*        C  30   5.067 -17.961  15.962
  324    H1*    C  30           H1*        C  30   4.763 -15.371  13.958
  325   1H4     C  30          1H4         C  30   3.508 -15.877   7.824
  326   2H4     C  30          2H4         C  30   4.945 -16.516   7.313
  327    H5     C  30           H5         C  30   6.695 -17.078   9.237
  328    H6     C  30           H6         C  30   7.117 -16.923  11.622
  329    H3T    C  30           H3T        C  30   7.724 -19.216  15.322
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -2.338 -19.583  -0.968
    2   2H5*    G   1          2H5*        G   1  -3.273 -18.092  -0.745
    3    H4*    G   1           H4*        G   1  -3.681 -19.310   1.177
    4    H3*    G   1           H3*        G   1  -1.638 -17.186   1.688
    5    H2*    G   1           H2*        G   1  -1.372 -17.956   3.952
    6   2HO*    G   1          2HO*        G   1  -3.874 -18.801   3.559
    7    H1*    G   1           H1*        G   1  -1.221 -20.655   3.328
    8    H8     G   1           H8         G   1   0.321 -18.694   0.514
    9    H1     G   1           H1         G   1   4.217 -19.827   5.466
   10   1H2     G   1          1H2         G   1   3.320 -20.531   6.992
   11   2H2     G   1          2H2         G   1   1.706 -20.891   7.302
   12    H5T    G   1           H5T        G   1  -1.351 -17.071  -0.064
   13   1H5*    G   2          1H5*        G   2  -4.122 -17.379   4.847
   14   2H5*    G   2          2H5*        G   2  -4.983 -15.856   5.143
   15    H4*    G   2           H4*        G   2  -4.242 -16.582   7.237
   16    H3*    G   2           H3*        G   2  -2.602 -14.330   6.151
   17    H2*    G   2           H2*        G   2  -1.143 -14.428   8.057
   18   2HO*    G   2          2HO*        G   2  -3.335 -15.405   9.219
   19    H1*    G   2           H1*        G   2  -0.877 -17.194   8.095
   20    H8     G   2           H8         G   2  -1.221 -15.812   4.578
   21    H1     G   2           H1         G   2   4.745 -15.996   6.889
   22   1H2     G   2          1H2         G   2   4.827 -16.428   8.750
   23   2H2     G   2          2H2         G   2   3.643 -16.778   9.891
   24   1H5*    U   3          1H5*        U   3  -3.044 -13.576   9.993
   25   2H5*    U   3          2H5*        U   3  -3.786 -12.003  10.344
   26    H4*    U   3           H4*        U   3  -1.888 -12.047  11.675
   27    H3*    U   3           H3*        U   3  -1.456 -10.424   9.202
   28    H2*    U   3           H2*        U   3   0.828 -10.035   9.817
   29   2HO*    U   3          2HO*        U   3   1.158  -9.843  11.904
   30    H1*    U   3           H1*        U   3   1.407 -12.646  10.524
   31    H3     U   3           H3         U   3   3.347 -12.530   6.464
   32    H5     U   3           H5         U   3  -0.748 -12.632   5.612
   33    H6     U   3           H6         U   3  -1.168 -12.351   7.962
   34   1H5*    G   4          1H5*        G   4   0.076  -8.299  12.465
   35   2H5*    G   4          2H5*        G   4  -0.457  -6.606  12.437
   36    H4*    G   4           H4*        G   4   1.872  -6.555  12.717
   37    H3*    G   4           H3*        G   4   1.057  -5.838   9.923
   38    H2*    G   4           H2*        G   4   3.367  -5.640   9.289
   39   2HO*    G   4          2HO*        G   4   4.850  -5.174  10.744
   40    H1*    G   4           H1*        G   4   4.200  -7.987  10.537
   41    H8     G   4           H8         G   4   0.701  -8.359   9.179
   42    H1     G   4           H1         G   4   5.388  -9.447   4.975
   43   1H2     G   4          1H2         G   4   7.103  -8.882   5.588
   44   2H2     G   4          2H2         G   4   7.627  -8.139   7.004
   45   1H5*    C   5          1H5*        C   5   3.922  -3.622  10.895
   46   2H5*    C   5          2H5*        C   5   3.905  -1.878  10.571
   47    H4*    C   5           H4*        C   5   5.830  -2.762   9.528
   48    H3*    C   5           H3*        C   5   3.664  -2.012   7.595
   49    H2*    C   5           H2*        C   5   4.950  -2.849   5.775
   50   2HO*    C   5          2HO*        C   5   7.169  -3.191   5.951
   51    H1*    C   5           H1*        C   5   6.147  -5.019   7.180
   52   1H4     C   5          1H4         C   5   1.887  -7.929   3.649
   53   2H4     C   5          2H4         C   5   0.558  -7.661   4.605
   54    H5     C   5           H5         C   5   0.955  -6.043   6.681
   55    H6     C   5           H6         C   5   2.619  -4.648   7.803
   56   1H5*    G   6          1H5*        G   6   6.934  -1.528   5.281
   57   2H5*    G   6          2H5*        G   6   6.811   0.092   4.568
   58    H4*    G   6           H4*        G   6   6.795  -1.479   2.791
   59    H3*    G   6           H3*        G   6   4.062  -0.344   3.338
   60    H2*    G   6           H2*        G   6   3.280  -1.523   1.386
   61   2HO*    G   6          2HO*        G   6   5.566  -1.318   0.334
   62    H1*    G   6           H1*        G   6   4.475  -3.916   2.179
   63    H8     G   6           H8         G   6   3.220  -1.519   4.848
   64    H1     G   6           H1         G   6  -1.017  -5.975   3.063
   65   1H2     G   6          1H2         G   6  -0.247  -7.110   1.333
   66   2H2     G   6          2H2         G   6   1.318  -6.762   0.644
   67   1H5*    A   7          1H5*        A   7   7.858  -1.919   0.030
   68   2H5*    A   7          2H5*        A   7   8.323  -0.490  -0.913
   69    H4*    A   7           H4*        A   7   7.924  -2.088  -2.529
   70    H3*    A   7           H3*        A   7   5.404  -0.448  -2.258
   71    H2*    A   7           H2*        A   7   4.464  -1.784  -4.015
   72   2HO*    A   7          2HO*        A   7   5.941  -2.076  -5.542
   73    H1*    A   7           H1*        A   7   5.691  -4.211  -3.133
   74    H8     A   7           H8         A   7   3.927  -2.329  -0.331
   75   1H6     A   7          1H6         A   7  -1.094  -5.564  -1.959
   76   2H6     A   7          2H6         A   7  -0.423  -4.465  -0.766
   77    H2     A   7           H2         A   7   2.059  -6.283  -5.039
   78   1H5*    A   8          1H5*        A   8   4.879   0.672  -7.096
   79   2H5*    A   8          2H5*        A   8   3.385   1.035  -6.211
   80    H4*    A   8           H4*        A   8   4.144  -1.321  -7.747
   81    H3*    A   8           H3*        A   8   1.570  -0.016  -6.946
   82    H2*    A   8           H2*        A   8   0.414  -2.114  -7.179
   83   2HO*    A   8          2HO*        A   8   2.197  -2.545  -9.012
   84    H1*    A   8           H1*        A   8   2.342  -3.669  -5.902
   85    H8     A   8           H8         A   8   2.796  -1.269  -3.493
   86   1H6     A   8          1H6         A   8  -3.019  -1.876  -1.493
   87   2H6     A   8          2H6         A   8  -1.498  -1.245  -0.960
   88    H2     A   8           H2         A   8  -2.845  -3.589  -5.496
   89   1H5*    G   9          1H5*        G   9  -0.430  -1.419 -10.254
   90   2H5*    G   9          2H5*        G   9  -1.196   0.045 -10.903
   91    H4*    G   9           H4*        G   9  -2.856  -1.564 -10.171
   92    H3*    G   9           H3*        G   9  -2.727   1.035  -8.677
   93    H2*    G   9           H2*        G   9  -4.552   0.288  -7.276
   94   2HO*    G   9          2HO*        G   9  -5.813  -0.811  -8.778
   95    H1*    G   9           H1*        G   9  -3.465  -2.203  -6.767
   96    H8     G   9           H8         G   9  -0.356  -0.446  -6.945
   97    H1     G   9           H1         G   9  -3.749   1.412  -1.851
   98   1H2     G   9          1H2         G   9  -5.611   0.979  -1.977
   99   2H2     G   9          2H2         G   9  -6.513   0.171  -3.144
  100   1H5*    G  10          1H5*        G  10  -6.170   0.565  -9.966
  101   2H5*    G  10          2H5*        G  10  -7.319   1.552 -10.890
  102    H4*    G  10           H4*        G  10  -8.455   1.340  -8.939
  103    H3*    G  10           H3*        G  10  -6.774   3.814  -8.555
  104    H2*    G  10           H2*        G  10  -7.844   4.033  -6.388
  105   2HO*    G  10          2HO*        G  10  -9.817   2.813  -7.546
  106    H1*    G  10           H1*        G  10  -7.456   1.353  -5.722
  107    H8     G  10           H8         G  10  -4.388   1.983  -7.548
  108    H1     G  10           H1         G  10  -4.450   4.962  -1.888
  109   1H2     G  10          1H2         G  10  -6.203   5.115  -1.123
  110   2H2     G  10          2H2         G  10  -7.715   4.586  -1.628
  111   1H5*    G  11          1H5*        G  11 -10.756   4.905  -7.740
  112   2H5*    G  11          2H5*        G  11 -11.162   6.435  -8.545
  113    H4*    G  11           H4*        G  11 -11.801   6.604  -6.265
  114    H3*    G  11           H3*        G  11  -9.387   8.263  -6.920
  115    H2*    G  11           H2*        G  11  -9.236   8.927  -4.616
  116   2HO*    G  11          2HO*        G  11 -11.035   9.060  -3.504
  117    H1*    G  11           H1*        G  11  -9.592   6.398  -3.568
  118    H8     G  11           H8         G  11  -7.654   5.721  -6.634
  119    H1     G  11           H1         G  11  -4.227   8.471  -1.990
  120   1H2     G  11          1H2         G  11  -5.331   9.275  -0.618
  121   2H2     G  11          2H2         G  11  -7.004   9.338  -0.419
  122   1H5*    C  12          1H5*        C  12 -11.872  10.375  -4.494
  123   2H5*    C  12          2H5*        C  12 -12.251  11.999  -5.096
  124    H4*    C  12           H4*        C  12 -11.689  12.182  -2.803
  125    H3*    C  12           H3*        C  12  -9.556  13.308  -4.590
  126    H2*    C  12           H2*        C  12  -8.204  13.773  -2.651
  127   2HO*    C  12          2HO*        C  12  -9.110  13.427  -0.531
  128    H1*    C  12           H1*        C  12  -8.657  11.338  -1.382
  129   1H4     C  12          1H4         C  12  -3.335  10.378  -4.727
  130   2H4     C  12          2H4         C  12  -4.105   9.720  -6.027
  131    H5     C  12           H5         C  12  -6.737   9.756  -6.036
  132    H6     C  12           H6         C  12  -8.714  10.491  -4.804
  133   1H5*    G  13          1H5*        G  13  -8.028  15.294  -3.421
  134   2H5*    G  13          2H5*        G  13  -8.007  16.386  -2.042
  135    H4*    G  13           H4*        G  13  -7.366  18.215  -3.301
  136    H3*    G  13           H3*        G  13  -8.595  16.962  -5.654
  137    H2*    G  13           H2*        G  13  -6.796  17.350  -7.142
  138   2HO*    G  13          2HO*        G  13  -6.145  19.405  -6.845
  139    H1*    G  13           H1*        G  13  -4.655  16.891  -5.465
  140    H8     G  13           H8         G  13  -7.742  14.790  -4.911
  141    H1     G  13           H1         G  13  -3.223  11.954  -8.397
  142   1H2     G  13          1H2         G  13  -1.697  13.449  -9.053
  143   2H2     G  13          2H2         G  13  -1.776  15.114  -8.541
  144   1H5*    U  14          1H5*        U  14  -7.200  20.511  -4.152
  145   2H5*    U  14          2H5*        U  14  -7.841  22.118  -4.539
  146    H4*    U  14           H4*        U  14  -5.795  23.015  -4.939
  147    H3*    U  14           H3*        U  14  -5.070  20.919  -6.479
  148    H2*    U  14           H2*        U  14  -4.417  19.355  -4.820
  149   2HO*    U  14          2HO*        U  14  -2.283  19.394  -4.774
  150    H1*    U  14           H1*        U  14  -3.306  21.517  -2.990
  151    H3     U  14           H3         U  14  -3.940  19.382   0.896
  152    H5     U  14           H5         U  14  -5.132  16.607  -2.014
  153    H6     U  14           H6         U  14  -5.082  18.348  -3.622
  154   1H5*    C  15          1H5*        C  15  -3.903  18.770  -8.148
  155   2H5*    C  15          2H5*        C  15  -3.607  19.365  -6.514
  156    H4*    C  15           H4*        C  15  -1.205  19.531  -8.090
  157    H3*    C  15           H3*        C  15  -2.664  16.937  -8.303
  158    H2*    C  15           H2*        C  15  -0.725  15.685  -7.649
  159   2HO*    C  15          2HO*        C  15   1.283  17.018  -7.283
  160    H1*    C  15           H1*        C  15   0.092  17.345  -5.584
  161   1H4     C  15          1H4         C  15  -5.073  14.578  -2.699
  162   2H4     C  15          2H4         C  15  -4.473  13.121  -3.458
  163    H5     C  15           H5         C  15  -2.577  13.140  -4.982
  164    H6     C  15           H6         C  15  -0.949  14.553  -6.105
  165   1H5*    G  16          1H5*        G  16  -1.372  15.270 -12.802
  166   2H5*    G  16          2H5*        G  16  -1.043  15.558 -11.083
  167    H4*    G  16           H4*        G  16   0.726  15.757 -13.256
  168    H3*    G  16           H3*        G  16   0.968  16.224 -10.307
  169    H2*    G  16           H2*        G  16   3.022  17.412 -10.633
  170   2HO*    G  16          2HO*        G  16   3.385  15.742 -12.539
  171    H1*    G  16           H1*        G  16   2.214  18.837 -12.913
  172    H8     G  16           H8         G  16   1.357  18.141  -9.273
  173    H1     G  16           H1         G  16   0.266  24.150 -11.204
  174   1H2     G  16          1H2         G  16   0.511  24.311 -13.390
  175   2H2     G  16          2H2         G  16   0.949  22.931 -14.373
  176   1H5*    U  17          1H5*        U  17   0.986  12.601  -8.134
  177   2H5*    U  17          2H5*        U  17  -0.008  13.846  -7.365
  178    H4*    U  17           H4*        U  17   2.666  14.652  -8.323
  179    H3*    U  17           H3*        U  17   2.729  12.354  -6.893
  180    H2*    U  17           H2*        U  17   1.738  13.099  -4.891
  181   2HO*    U  17          2HO*        U  17   4.298  14.304  -4.546
  182    H1*    U  17           H1*        U  17   3.070  15.826  -5.216
  183    H3     U  17           H3         U  17   0.234  18.312  -2.800
  184    H5     U  17           H5         U  17  -1.328  14.470  -2.455
  185    H6     U  17           H6         U  17   0.264  13.758  -4.121
  186   1H5*    C  18          1H5*        C  18   4.087  17.214  -4.812
  187   2H5*    C  18          2H5*        C  18   5.775  17.224  -5.352
  188    H4*    C  18           H4*        C  18   6.524  16.333  -3.321
  189    H3*    C  18           H3*        C  18   4.292  14.924  -2.888
  190    H2*    C  18           H2*        C  18   2.838  16.704  -2.263
  191   2HO*    C  18          2HO*        C  18   2.711  15.874  -0.286
  192    H1*    C  18           H1*        C  18   5.084  18.165  -0.798
  193   1H4     C  18          1H4         C  18   1.501  23.240  -2.403
  194   2H4     C  18          2H4         C  18   0.101  22.221  -2.151
  195    H5     C  18           H5         C  18   0.285  19.812  -1.779
  196    H6     C  18           H6         C  18   1.830  17.979  -1.486
  197   1H5*    G  19          1H5*        G  19   4.612  15.247   0.198
  198   2H5*    G  19          2H5*        G  19   4.734  14.377   1.737
  199    H4*    G  19           H4*        G  19   2.456  14.985   1.260
  200    H3*    G  19           H3*        G  19   3.026  12.075   1.358
  201    H2*    G  19           H2*        G  19   1.085  11.491   0.263
  202   2HO*    G  19          2HO*        G  19  -0.768  13.195   0.715
  203    H1*    G  19           H1*        G  19   0.399  14.334  -0.525
  204    H8     G  19           H8         G  19   2.754  12.518  -2.775
  205    H1     G  19           H1         G  19  -3.470  11.310  -3.727
  206   1H2     G  19          1H2         G  19  -4.564  11.901  -2.198
  207   2H2     G  19          2H2         G  19  -4.140  12.733  -0.781
  208   1H5*    C  20          1H5*        C  20  -0.314  13.506   3.891
  209   2H5*    C  20          2H5*        C  20  -0.326  12.590   5.406
  210    H4*    C  20           H4*        C  20  -2.541  12.705   4.793
  211    H3*    C  20           H3*        C  20  -1.610  10.000   3.822
  212    H2*    C  20           H2*        C  20  -3.922   9.647   3.197
  213   2HO*    C  20          2HO*        C  20  -4.359  11.338   5.187
  214    H1*    C  20           H1*        C  20  -4.198  12.229   2.093
  215   1H4     C  20          1H4         C  20  -3.033   8.421  -2.761
  216   2H4     C  20          2H4         C  20  -1.378   8.474  -2.707
  217    H5     C  20           H5         C  20  -0.340   9.775  -0.627
  218    H6     C  20           H6         C  20  -0.901  11.046   1.383
  219   1H5*    C  21          1H5*        C  21  -5.065   9.665   5.515
  220   2H5*    C  21          2H5*        C  21  -5.246   8.324   6.661
  221    H4*    C  21           H4*        C  21  -7.075   8.260   5.150
  222    H3*    C  21           H3*        C  21  -5.126   6.035   4.539
  223    H2*    C  21           H2*        C  21  -6.691   5.306   2.855
  224   2HO*    C  21          2HO*        C  21  -8.428   6.490   4.512
  225    H1*    C  21           H1*        C  21  -7.270   7.929   1.955
  226   1H4     C  21          1H4         C  21  -3.158   5.517  -2.151
  227   2H4     C  21          2H4         C  21  -1.784   6.139  -1.454
  228    H5     C  21           H5         C  21  -2.137   7.340   0.888
  229    H6     C  21           H6         C  21  -3.809   7.957   2.555
  230   1H5*    C  22          1H5*        C  22  -8.709   4.670   4.391
  231   2H5*    C  22          2H5*        C  22  -9.081   3.290   5.442
  232    H4*    C  22           H4*        C  22  -9.966   2.711   3.370
  233    H3*    C  22           H3*        C  22  -7.329   1.327   3.785
  234    H2*    C  22           H2*        C  22  -7.487   0.381   1.618
  235   2HO*    C  22          2HO*        C  22  -9.377  -0.184   0.829
  236    H1*    C  22           H1*        C  22  -8.716   2.607   0.365
  237   1H4     C  22          1H4         C  22  -2.724   2.343  -1.489
  238   2H4     C  22          2H4         C  22  -2.028   3.084  -0.174
  239    H5     C  22           H5         C  22  -3.707   3.623   1.831
  240    H6     C  22           H6         C  22  -6.031   3.546   2.526
  241   1H5*    C  23          1H5*        C  23 -10.193  -1.510   1.733
  242   2H5*    C  23          2H5*        C  23  -9.841  -3.029   2.580
  243    H4*    C  23           H4*        C  23  -9.658  -3.182   0.123
  244    H3*    C  23           H3*        C  23  -7.351  -3.912   1.876
  245    H2*    C  23           H2*        C  23  -5.934  -4.263  -0.032
  246   2HO*    C  23          2HO*        C  23  -8.268  -4.853  -1.170
  247    H1*    C  23           H1*        C  23  -6.742  -2.026  -1.485
  248   1H4     C  23          1H4         C  23  -1.741   0.147   1.714
  249   2H4     C  23          2H4         C  23  -2.750   0.486   3.105
  250    H5     C  23           H5         C  23  -5.077  -0.172   3.225
  251    H6     C  23           H6         C  23  -6.900  -1.270   2.034
  252   1H5*    G  24          1H5*        G  24  -6.610  -8.365  -0.551
  253   2H5*    G  24          2H5*        G  24  -5.392  -8.265   0.736
  254    H4*    G  24           H4*        G  24  -5.180  -7.684  -2.101
  255    H3*    G  24           H3*        G  24  -3.640  -9.170  -0.570
  256    H2*    G  24           H2*        G  24  -2.988  -7.549   1.071
  257   2HO*    G  24          2HO*        G  24  -1.012  -6.510  -0.471
  258    H1*    G  24           H1*        G  24  -2.500  -5.371  -0.987
  259    H8     G  24           H8         G  24  -5.367  -5.676   1.508
  260    H1     G  24           H1         G  24  -0.738  -1.584   3.198
  261   1H2     G  24          1H2         G  24   0.938  -1.682   1.770
  262   2H2     G  24          2H2         G  24   0.902  -2.767   0.401
  263   1H5*    A  25          1H5*        A  25  -1.386 -11.919  -3.725
  264   2H5*    A  25          2H5*        A  25  -0.675 -10.946  -2.422
  265    H4*    A  25           H4*        A  25   0.292 -11.435  -5.197
  266    H3*    A  25           H3*        A  25   1.500 -11.587  -2.467
  267    H2*    A  25           H2*        A  25   3.625 -10.836  -3.312
  268   2HO*    A  25          2HO*        A  25   3.859 -11.893  -5.211
  269    H1*    A  25           H1*        A  25   2.625  -8.837  -4.975
  270    H8     A  25           H8         A  25   0.451  -8.723  -1.964
  271   1H6     A  25          1H6         A  25   4.740  -5.090   0.624
  272   2H6     A  25          2H6         A  25   3.095  -5.672   0.759
  273    H2     A  25           H2         A  25   6.552  -7.011  -2.982
  274   1H5*    G  26          1H5*        G  26   5.991 -14.210  -3.506
  275   2H5*    G  26          2H5*        G  26   5.184 -14.053  -1.934
  276    H4*    G  26           H4*        G  26   7.085 -12.295  -3.250
  277    H3*    G  26           H3*        G  26   6.119 -12.697  -0.441
  278    H2*    G  26           H2*        G  26   6.940 -10.507   0.142
  279   2HO*    G  26          2HO*        G  26   8.807 -10.252  -1.052
  280    H1*    G  26           H1*        G  26   5.821  -9.257  -2.042
  281    H8     G  26           H8         G  26   3.186 -11.591  -1.708
  282    H1     G  26           H1         G  26   3.243  -7.624   3.301
  283   1H2     G  26          1H2         G  26   4.951  -6.755   3.571
  284   2H2     G  26          2H2         G  26   6.406  -6.814   2.735
  285   1H5*    C  27          1H5*        C  27  10.936  -9.729  -1.105
  286   2H5*    C  27          2H5*        C  27  11.803 -11.271  -0.971
  287    H4*    C  27           H4*        C  27  12.510  -9.901   0.823
  288    H3*    C  27           H3*        C  27  10.693 -12.127   1.696
  289    H2*    C  27           H2*        C  27  10.850 -11.341   3.962
  290   2HO*    C  27          2HO*        C  27  12.567 -10.270   4.609
  291    H1*    C  27           H1*        C  27  10.518  -8.643   3.350
  292   1H4     C  27          1H4         C  27   4.669 -10.622   4.547
  293   2H4     C  27          2H4         C  27   4.382 -11.415   3.116
  294    H5     C  27           H5         C  27   6.449 -11.633   1.496
  295    H6     C  27           H6         C  27   8.770 -10.971   1.145
  296   1H5*    G  28          1H5*        G  28  13.549 -11.826   4.392
  297   2H5*    G  28          2H5*        G  28  14.367 -13.354   4.772
  298    H4*    G  28           H4*        G  28  13.742 -12.478   6.836
  299    H3*    G  28           H3*        G  28  11.795 -14.622   6.020
  300    H2*    G  28           H2*        G  28  10.614 -14.238   8.089
  301   2HO*    G  28          2HO*        G  28  12.981 -13.563   8.955
  302    H1*    G  28           H1*        G  28  10.705 -11.455   7.917
  303    H8     G  28           H8         G  28  10.174 -12.915   4.491
  304    H1     G  28           H1         G  28   4.827 -12.291   7.981
  305   1H2     G  28          1H2         G  28   5.320 -11.867  10.060
  306   2H2     G  28          2H2         G  28   6.974 -11.725  10.614
  307   1H5*    C  29          1H5*        C  29  12.477 -15.316   9.945
  308   2H5*    C  29          2H5*        C  29  13.135 -16.948  10.175
  309    H4*    C  29           H4*        C  29  11.436 -16.800  11.739
  310    H3*    C  29           H3*        C  29  10.521 -18.332   9.335
  311    H2*    C  29           H2*        C  29   8.324 -18.538  10.269
  312   2HO*    C  29          2HO*        C  29   9.714 -18.360  12.556
  313    H1*    C  29           H1*        C  29   8.154 -15.920  11.261
  314   1H4     C  29          1H4         C  29   5.284 -15.466   5.692
  315   2H4     C  29          2H4         C  29   6.622 -15.154   4.776
  316    H5     C  29           H5         C  29   8.955 -15.300   6.063
  317    H6     C  29           H6         C  29   9.991 -15.870   8.197
  318   1H5*    C  30          1H5*        C  30   8.924 -20.286  12.335
  319   2H5*    C  30          2H5*        C  30   9.658 -21.888  12.552
  320    H4*    C  30           H4*        C  30   7.371 -22.264  12.746
  321    H3*    C  30           H3*        C  30   8.373 -23.033  10.024
  322    H2*    C  30           H2*        C  30   6.172 -23.594   9.336
  323   2HO*    C  30          2HO*        C  30   5.902 -24.387  11.790
  324    H1*    C  30           H1*        C  30   4.855 -21.472  10.655
  325   1H4     C  30          1H4         C  30   5.350 -19.794   4.621
  326   2H4     C  30          2H4         C  30   6.991 -19.597   4.536
  327    H5     C  30           H5         C  30   8.332 -20.246   6.740
  328    H6     C  30           H6         C  30   8.102 -20.967   9.045
  329    H3T    C  30           H3T        C  30   8.890 -24.215  11.881
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1  -3.248 -17.876   1.568
    2   2H5*    G   1          2H5*        G   1  -3.890 -16.348   2.196
    3    H4*    G   1           H4*        G   1  -3.685 -17.813   4.023
    4    H3*    G   1           H3*        G   1  -1.603 -15.657   4.006
    5    H2*    G   1           H2*        G   1  -0.632 -16.582   6.009
    6   2HO*    G   1          2HO*        G   1  -3.129 -17.494   6.335
    7    H1*    G   1           H1*        G   1  -0.675 -19.221   5.146
    8    H8     G   1           H8         G   1  -0.051 -16.467   2.529
    9    H1     G   1           H1         G   1   5.115 -19.353   4.978
   10   1H2     G   1          1H2         G   1   4.704 -20.563   6.405
   11   2H2     G   1          2H2         G   1   3.250 -20.990   7.139
   12    H5T    G   1           H5T        G   1  -1.251 -16.978   1.400
   13   1H5*    G   2          1H5*        G   2  -2.739 -16.198   7.723
   14   2H5*    G   2          2H5*        G   2  -3.415 -14.748   8.491
   15    H4*    G   2           H4*        G   2  -1.919 -15.569  10.053
   16    H3*    G   2           H3*        G   2  -0.707 -13.293   8.530
   17    H2*    G   2           H2*        G   2   1.341 -13.556   9.763
   18   2HO*    G   2          2HO*        G   2  -0.304 -14.493  11.615
   19    H1*    G   2           H1*        G   2   1.435 -16.335   9.577
   20    H8     G   2           H8         G   2   0.066 -14.376   6.573
   21    H1     G   2           H1         G   2   6.285 -15.905   6.405
   22   1H2     G   2          1H2         G   2   6.918 -16.689   8.015
   23   2H2     G   2          2H2         G   2   6.166 -17.065   9.470
   24   1H5*    U   3          1H5*        U   3   0.352 -12.702  12.284
   25   2H5*    U   3          2H5*        U   3  -0.115 -11.108  12.912
   26    H4*    U   3           H4*        U   3   2.140 -11.270  13.409
   27    H3*    U   3           H3*        U   3   1.678  -9.608  10.967
   28    H2*    U   3           H2*        U   3   4.045  -9.338  10.672
   29   2HO*    U   3          2HO*        U   3   4.066  -9.634  13.286
   30    H1*    U   3           H1*        U   3   4.715 -11.990  11.101
   31    H3     U   3           H3         U   3   4.975 -12.192   6.634
   32    H5     U   3           H5         U   3   0.900 -11.517   7.326
   33    H6     U   3           H6         U   3   1.408 -11.267   9.662
   34   1H5*    G   4          1H5*        G   4   4.418  -7.619  13.413
   35   2H5*    G   4          2H5*        G   4   3.981  -5.910  13.614
   36    H4*    G   4           H4*        G   4   6.230  -5.919  12.973
   37    H3*    G   4           H3*        G   4   4.429  -5.146  10.711
   38    H2*    G   4           H2*        G   4   6.309  -5.028   9.220
   39   2HO*    G   4          2HO*        G   4   7.610  -4.532  11.504
   40    H1*    G   4           H1*        G   4   7.485  -7.410  10.055
   41    H8     G   4           H8         G   4   3.695  -7.535  10.155
   42    H1     G   4           H1         G   4   6.371  -9.173   4.589
   43   1H2     G   4          1H2         G   4   8.257  -8.793   4.512
   44   2H2     G   4          2H2         G   4   9.320  -8.065   5.594
   45   1H5*    C   5          1H5*        C   5   7.514  -2.961  10.500
   46   2H5*    C   5          2H5*        C   5   7.376  -1.220  10.188
   47    H4*    C   5           H4*        C   5   8.724  -2.113   8.476
   48    H3*    C   5           H3*        C   5   5.959  -1.427   7.541
   49    H2*    C   5           H2*        C   5   6.449  -2.284   5.373
   50   2HO*    C   5          2HO*        C   5   8.406  -1.445   4.909
   51    H1*    C   5           H1*        C   5   8.085  -4.444   6.236
   52   1H4     C   5          1H4         C   5   2.687  -7.293   4.787
   53   2H4     C   5          2H4         C   5   1.833  -6.893   6.145
   54    H5     C   5           H5         C   5   3.051  -5.235   7.830
   55    H6     C   5           H6         C   5   5.076  -3.915   8.182
   56   1H5*    G   6          1H5*        G   6   7.286   0.890   2.943
   57   2H5*    G   6          2H5*        G   6   5.742   0.698   3.794
   58    H4*    G   6           H4*        G   6   7.286  -1.268   2.162
   59    H3*    G   6           H3*        G   6   4.528  -0.156   2.086
   60    H2*    G   6           H2*        G   6   3.554  -2.276   1.556
   61   2HO*    G   6          2HO*        G   6   5.706  -2.644   0.223
   62    H1*    G   6           H1*        G   6   5.048  -3.839   3.290
   63    H8     G   6           H8         G   6   4.591  -0.736   5.151
   64    H1     G   6           H1         G   6  -0.774  -4.220   4.975
   65   1H2     G   6          1H2         G   6  -0.647  -5.732   3.370
   66   2H2     G   6          2H2         G   6   0.766  -5.885   2.357
   67   1H5*    A   7          1H5*        A   7   7.637  -0.610  -0.841
   68   2H5*    A   7          2H5*        A   7   8.096   0.246  -2.326
   69    H4*    A   7           H4*        A   7   7.179  -1.629  -3.213
   70    H3*    A   7           H3*        A   7   4.846   0.271  -2.955
   71    H2*    A   7           H2*        A   7   3.479  -1.445  -3.904
   72   2HO*    A   7          2HO*        A   7   5.784  -2.061  -5.134
   73    H1*    A   7           H1*        A   7   4.857  -3.590  -2.597
   74    H8     A   7           H8         A   7   3.838  -0.969  -0.087
   75   1H6     A   7          1H6         A   7  -1.652  -3.842   0.050
   76   2H6     A   7          2H6         A   7  -0.664  -2.609   0.807
   77    H2     A   7           H2         A   7   0.699  -5.524  -3.352
   78   1H5*    A   8          1H5*        A   8   3.027   1.698  -6.642
   79   2H5*    A   8          2H5*        A   8   1.876   1.888  -5.305
   80    H4*    A   8           H4*        A   8   2.984  -0.621  -6.516
   81    H3*    A   8           H3*        A   8   0.225   0.489  -6.161
   82    H2*    A   8           H2*        A   8  -0.639  -1.713  -5.763
   83   2HO*    A   8          2HO*        A   8   1.947  -2.683  -6.491
   84    H1*    A   8           H1*        A   8   1.487  -2.602  -4.163
   85    H8     A   8           H8         A   8   1.464   0.277  -2.354
   86   1H6     A   8          1H6         A   8  -4.276  -0.825  -0.299
   87   2H6     A   8          2H6         A   8  -2.915   0.148   0.128
   88    H2     A   8           H2         A   8  -3.673  -3.266  -3.847
   89   1H5*    G   9          1H5*        G   9  -1.366  -1.635  -9.594
   90   2H5*    G   9          2H5*        G   9  -2.422  -0.360 -10.229
   91    H4*    G   9           H4*        G   9  -3.555  -2.396  -9.258
   92    H3*    G   9           H3*        G   9  -4.287   0.395  -8.479
   93    H2*    G   9           H2*        G   9  -5.814  -0.408  -6.820
   94   2HO*    G   9          2HO*        G   9  -6.016  -2.444  -8.508
   95    H1*    G   9           H1*        G   9  -4.195  -2.474  -5.861
   96    H8     G   9           H8         G   9  -1.581  -0.082  -6.106
   97    H1     G   9           H1         G   9  -5.903   1.619  -1.704
   98   1H2     G   9          1H2         G   9  -7.577   0.726  -1.910
   99   2H2     G   9          2H2         G   9  -8.122  -0.428  -3.012
  100   1H5*    G  10          1H5*        G  10  -4.464   3.090 -10.480
  101   2H5*    G  10          2H5*        G  10  -4.234   2.031  -9.084
  102    H4*    G  10           H4*        G  10  -6.622   1.538 -10.767
  103    H3*    G  10           H3*        G  10  -6.194   4.159  -9.491
  104    H2*    G  10           H2*        G  10  -8.167   4.082  -8.153
  105   2HO*    G  10          2HO*        G  10  -9.066   2.750 -10.234
  106    H1*    G  10           H1*        G  10  -8.096   1.411  -7.406
  107    H8     G  10           H8         G  10  -4.612   1.742  -7.195
  108    H1     G  10           H1         G  10  -7.354   5.358  -2.680
  109   1H2     G  10          1H2         G  10  -9.231   5.634  -2.940
  110   2H2     G  10          2H2         G  10 -10.307   5.130  -4.125
  111   1H5*    G  11          1H5*        G  11  -9.816   4.987 -10.768
  112   2H5*    G  11          2H5*        G  11  -9.817   6.329 -11.930
  113    H4*    G  11           H4*        G  11 -11.256   6.989 -10.222
  114    H3*    G  11           H3*        G  11  -8.608   8.360  -9.997
  115    H2*    G  11           H2*        G  11  -9.262   9.391  -7.950
  116   2HO*    G  11          2HO*        G  11 -11.292   9.939  -7.740
  117    H1*    G  11           H1*        G  11 -10.530   7.171  -6.858
  118    H8     G  11           H8         G  11  -7.502   5.745  -8.450
  119    H1     G  11           H1         G  11  -6.430   8.825  -2.955
  120   1H2     G  11          1H2         G  11  -7.964   9.909  -2.411
  121   2H2     G  11          2H2         G  11  -9.464  10.172  -3.146
  122   1H5*    C  12          1H5*        C  12 -11.576  10.993  -9.048
  123   2H5*    C  12          2H5*        C  12 -11.493  12.449 -10.058
  124    H4*    C  12           H4*        C  12 -11.786  13.270  -7.913
  125    H3*    C  12           H3*        C  12  -8.860  13.407  -8.617
  126    H2*    C  12           H2*        C  12  -8.499  14.472  -6.479
  127   2HO*    C  12          2HO*        C  12 -10.419  15.750  -6.496
  128    H1*    C  12           H1*        C  12 -10.117  12.672  -5.055
  129   1H4     C  12          1H4         C  12  -4.178  10.463  -4.738
  130   2H4     C  12          2H4         C  12  -4.195   9.632  -6.168
  131    H5     C  12           H5         C  12  -6.328   9.983  -7.687
  132    H6     C  12           H6         C  12  -8.541  10.973  -7.785
  133   1H5*    G  13          1H5*        G  13  -9.093  18.265  -8.787
  134   2H5*    G  13          2H5*        G  13  -7.325  18.337  -8.666
  135    H4*    G  13           H4*        G  13  -9.233  18.624  -6.619
  136    H3*    G  13           H3*        G  13  -6.220  18.549  -6.612
  137    H2*    G  13           H2*        G  13  -6.314  18.470  -4.213
  138   2HO*    G  13          2HO*        G  13  -8.520  19.839  -4.579
  139    H1*    G  13           H1*        G  13  -8.442  16.626  -4.110
  140    H8     G  13           H8         G  13  -6.220  15.426  -6.795
  141    H1     G  13           H1         G  13  -3.843  14.353  -0.972
  142   1H2     G  13          1H2         G  13  -5.026  15.389   0.551
  143   2H2     G  13          2H2         G  13  -6.410  16.372   0.130
  144   1H5*    U  14          1H5*        U  14  -4.040  22.960  -5.434
  145   2H5*    U  14          2H5*        U  14  -4.373  22.951  -7.176
  146    H4*    U  14           H4*        U  14  -2.110  22.537  -7.099
  147    H3*    U  14           H3*        U  14  -3.393  20.590  -8.280
  148    H2*    U  14           H2*        U  14  -4.053  19.375  -6.296
  149   2HO*    U  14          2HO*        U  14  -1.571  18.097  -6.494
  150    H1*    U  14           H1*        U  14  -1.207  19.512  -5.176
  151    H3     U  14           H3         U  14  -3.088  20.474  -0.878
  152    H5     U  14           H5         U  14  -5.189  17.426  -2.850
  153    H6     U  14           H6         U  14  -4.058  18.023  -4.853
  154   1H5*    C  15          1H5*        C  15  -0.448  16.347  -9.227
  155   2H5*    C  15          2H5*        C  15  -1.670  17.228  -8.291
  156    H4*    C  15           H4*        C  15   0.703  17.916  -7.063
  157    H3*    C  15           H3*        C  15   0.931  15.039  -7.947
  158    H2*    C  15           H2*        C  15   1.888  14.554  -5.791
  159   2HO*    C  15          2HO*        C  15   2.432  16.188  -4.369
  160    H1*    C  15           H1*        C  15  -0.130  15.826  -4.386
  161   1H4     C  15          1H4         C  15  -2.798  10.473  -7.171
  162   2H4     C  15          2H4         C  15  -2.189   9.879  -5.638
  163    H5     C  15           H5         C  15  -0.954  11.317  -4.091
  164    H6     C  15           H6         C  15   0.049  13.488  -3.797
  165   1H5*    G  16          1H5*        G  16   4.995  17.453  -9.174
  166   2H5*    G  16          2H5*        G  16   5.788  16.608 -10.518
  167    H4*    G  16           H4*        G  16   6.626  14.960  -9.193
  168    H3*    G  16           H3*        G  16   4.235  15.289  -7.446
  169    H2*    G  16           H2*        G  16   5.481  14.779  -5.467
  170   2HO*    G  16          2HO*        G  16   6.910  13.350  -7.216
  171    H1*    G  16           H1*        G  16   7.783  16.225  -6.095
  172    H8     G  16           H8         G  16   4.219  16.335  -5.127
  173    H1     G  16           H1         G  16   7.089  22.060  -4.786
  174   1H2     G  16          1H2         G  16   9.024  22.005  -5.830
  175   2H2     G  16          2H2         G  16   9.620  20.550  -6.598
  176   1H5*    U  17          1H5*        U  17   3.002  11.531  -5.548
  177   2H5*    U  17          2H5*        U  17   1.650  12.618  -5.189
  178    H4*    U  17           H4*        U  17   4.472  13.039  -4.267
  179    H3*    U  17           H3*        U  17   2.983  11.052  -3.211
  180    H2*    U  17           H2*        U  17   1.186  12.341  -2.386
  181   2HO*    U  17          2HO*        U  17   2.153  11.532  -0.482
  182    H1*    U  17           H1*        U  17   3.108  14.612  -1.656
  183    H3     U  17           H3         U  17  -0.012  17.939  -2.636
  184    H5     U  17           H5         U  17  -2.059  14.514  -1.346
  185    H6     U  17           H6         U  17  -0.011  13.284  -1.642
  186   1H5*    C  18          1H5*        C  18   4.125  13.496  -0.680
  187   2H5*    C  18          2H5*        C  18   5.734  13.706   0.034
  188    H4*    C  18           H4*        C  18   4.677  13.375   2.254
  189    H3*    C  18           H3*        C  18   2.355  12.628   1.020
  190    H2*    C  18           H2*        C  18   1.585  14.785   0.409
  191   2HO*    C  18          2HO*        C  18   0.047  14.632   1.912
  192    H1*    C  18           H1*        C  18   3.005  15.991   2.842
  193   1H4     C  18          1H4         C  18   2.968  21.356  -0.584
  194   2H4     C  18          2H4         C  18   1.484  20.799  -1.332
  195    H5     C  18           H5         C  18   0.597  18.566  -0.968
  196    H6     C  18           H6         C  18   0.968  16.447   0.105
  197   1H5*    G  19          1H5*        G  19   0.867  13.799   3.600
  198   2H5*    G  19          2H5*        G  19  -0.148  13.411   5.001
  199    H4*    G  19           H4*        G  19  -1.479  14.414   3.300
  200    H3*    G  19           H3*        G  19  -2.056  11.560   3.871
  201    H2*    G  19           H2*        G  19  -3.237  11.240   1.907
  202   2HO*    G  19          2HO*        G  19  -5.022  12.448   2.131
  203    H1*    G  19           H1*        G  19  -2.415  13.904   0.719
  204    H8     G  19           H8         G  19   0.136  11.374   0.116
  205    H1     G  19           H1         G  19  -5.026  10.831  -3.673
  206   1H2     G  19          1H2         G  19  -6.478  11.887  -3.126
  207   2H2     G  19          2H2         G  19  -6.695  12.900  -1.794
  208   1H5*    C  20          1H5*        C  20  -5.698  13.980   3.888
  209   2H5*    C  20          2H5*        C  20  -6.716  13.474   5.247
  210    H4*    C  20           H4*        C  20  -8.170  13.574   3.457
  211    H3*    C  20           H3*        C  20  -7.365  10.677   3.728
  212    H2*    C  20           H2*        C  20  -8.880  10.225   1.921
  213   2HO*    C  20          2HO*        C  20 -10.150  12.328   2.952
  214    H1*    C  20           H1*        C  20  -8.202  12.599   0.491
  215   1H4     C  20          1H4         C  20  -5.361   7.945  -2.579
  216   2H4     C  20          2H4         C  20  -4.006   7.812  -1.633
  217    H5     C  20           H5         C  20  -4.039   9.256   0.615
  218    H6     C  20           H6         C  20  -5.336  10.887   1.892
  219   1H5*    C  21          1H5*        C  21 -11.129  10.802   2.990
  220   2H5*    C  21          2H5*        C  21 -12.150   9.940   4.156
  221    H4*    C  21           H4*        C  21 -12.912   9.223   2.084
  222    H3*    C  21           H3*        C  21 -11.037   7.135   3.192
  223    H2*    C  21           H2*        C  21 -11.517   5.817   1.240
  224   2HO*    C  21          2HO*        C  21 -13.876   6.939   1.472
  225    H1*    C  21           H1*        C  21 -11.650   8.065  -0.533
  226   1H4     C  21          1H4         C  21  -6.167   5.320  -1.886
  227   2H4     C  21          2H4         C  21  -5.267   5.896  -0.617
  228    H5     C  21           H5         C  21  -6.638   7.301   1.188
  229    H6     C  21           H6         C  21  -8.852   8.146   1.759
  230   1H5*    C  22          1H5*        C  22 -11.191   3.704   4.490
  231   2H5*    C  22          2H5*        C  22 -10.881   4.574   2.975
  232    H4*    C  22           H4*        C  22 -12.806   2.336   2.842
  233    H3*    C  22           H3*        C  22  -9.936   1.852   3.567
  234    H2*    C  22           H2*        C  22  -9.789   0.126   1.925
  235   2HO*    C  22          2HO*        C  22 -11.560  -0.839   1.060
  236    H1*    C  22           H1*        C  22 -11.164   1.476  -0.087
  237   1H4     C  22          1H4         C  22  -5.078   2.626  -1.171
  238   2H4     C  22          2H4         C  22  -4.791   3.670   0.074
  239    H5     C  22           H5         C  22  -6.830   4.066   1.743
  240    H6     C  22           H6         C  22  -9.158   3.520   2.174
  241   1H5*    C  23          1H5*        C  23 -11.584  -1.724   2.708
  242   2H5*    C  23          2H5*        C  23 -10.937  -3.020   3.732
  243    H4*    C  23           H4*        C  23 -10.505  -3.314   1.310
  244    H3*    C  23           H3*        C  23  -8.258  -3.295   3.285
  245    H2*    C  23           H2*        C  23  -6.647  -3.467   1.522
  246   2HO*    C  23          2HO*        C  23  -8.449  -4.904   0.388
  247    H1*    C  23           H1*        C  23  -7.901  -1.706  -0.263
  248   1H4     C  23          1H4         C  23  -3.509   1.808   2.664
  249   2H4     C  23          2H4         C  23  -4.661   2.194   3.926
  250    H5     C  23           H5         C  23  -6.849   1.179   4.069
  251    H6     C  23           H6         C  23  -8.384  -0.403   3.024
  252   1H5*    G  24          1H5*        G  24  -5.350  -5.793   4.185
  253   2H5*    G  24          2H5*        G  24  -6.396  -4.445   3.699
  254    H4*    G  24           H4*        G  24  -6.087  -5.918   1.381
  255    H3*    G  24           H3*        G  24  -4.053  -7.016   2.639
  256    H2*    G  24           H2*        G  24  -2.932  -5.093   3.497
  257   2HO*    G  24          2HO*        G  24  -1.347  -4.412   1.840
  258    H1*    G  24           H1*        G  24  -3.327  -3.421   1.007
  259    H8     G  24           H8         G  24  -5.529  -2.885   3.968
  260    H1     G  24           H1         G  24  -0.162   0.613   4.133
  261   1H2     G  24          1H2         G  24   1.222  -0.026   2.562
  262   2H2     G  24          2H2         G  24   0.831  -1.327   1.465
  263   1H5*    A  25          1H5*        A  25  -3.299 -10.597  -0.740
  264   2H5*    A  25          2H5*        A  25  -2.106  -9.628   0.148
  265    H4*    A  25           H4*        A  25  -2.238 -10.302  -2.761
  266    H3*    A  25           H3*        A  25  -0.233 -10.713  -0.601
  267    H2*    A  25           H2*        A  25   1.601 -10.140  -2.035
  268   2HO*    A  25          2HO*        A  25   1.048 -11.249  -3.877
  269    H1*    A  25           H1*        A  25   0.398  -8.008  -3.362
  270    H8     A  25           H8         A  25  -0.823  -7.561   0.087
  271   1H6     A  25          1H6         A  25   4.489  -4.619   1.283
  272   2H6     A  25          2H6         A  25   2.872  -4.948   1.875
  273    H2     A  25           H2         A  25   4.989  -6.866  -2.548
  274   1H5*    G  26          1H5*        G  26   3.192 -13.883  -3.260
  275   2H5*    G  26          2H5*        G  26   3.033 -13.773  -1.496
  276    H4*    G  26           H4*        G  26   4.658 -12.228  -3.310
  277    H3*    G  26           H3*        G  26   4.561 -12.636  -0.342
  278    H2*    G  26           H2*        G  26   5.869 -10.647  -0.028
  279   2HO*    G  26          2HO*        G  26   6.354  -9.410  -2.072
  280    H1*    G  26           H1*        G  26   4.376  -9.100  -1.752
  281    H8     G  26           H8         G  26   1.707 -11.159  -0.491
  282    H1     G  26           H1         G  26   3.831  -7.104   3.969
  283   1H2     G  26          1H2         G  26   5.575  -6.396   3.588
  284   2H2     G  26          2H2         G  26   6.641  -6.601   2.305
  285   1H5*    C  27          1H5*        C  27   9.092 -10.476  -2.888
  286   2H5*    C  27          2H5*        C  27   9.911 -12.046  -3.012
  287    H4*    C  27           H4*        C  27  11.339 -10.616  -1.801
  288    H3*    C  27           H3*        C  27  10.016 -12.697  -0.107
  289    H2*    C  27           H2*        C  27  11.029 -11.788   1.862
  290   2HO*    C  27          2HO*        C  27  12.912 -11.099   0.132
  291    H1*    C  27           H1*        C  27  10.615  -9.100   1.234
  292   1H4     C  27          1H4         C  27   5.567 -10.412   4.717
  293   2H4     C  27          2H4         C  27   4.696 -11.258   3.572
  294    H5     C  27           H5         C  27   5.985 -11.823   1.349
  295    H6     C  27           H6         C  27   8.024 -11.403   0.083
  296   1H5*    G  28          1H5*        G  28  13.798 -12.525   1.284
  297   2H5*    G  28          2H5*        G  28  14.585 -14.114   1.208
  298    H4*    G  28           H4*        G  28  14.946 -13.411   3.386
  299    H3*    G  28           H3*        G  28  12.669 -15.354   3.268
  300    H2*    G  28           H2*        G  28  12.313 -15.097   5.627
  301   2HO*    G  28          2HO*        G  28  14.901 -14.678   5.634
  302    H1*    G  28           H1*        G  28  12.660 -12.321   5.684
  303    H8     G  28           H8         G  28  10.767 -13.471   2.614
  304    H1     G  28           H1         G  28   7.132 -12.254   7.757
  305   1H2     G  28          1H2         G  28   8.384 -12.032   9.539
  306   2H2     G  28          2H2         G  28  10.128 -12.169   9.470
  307   1H5*    C  29          1H5*        C  29  14.566 -16.616   6.572
  308   2H5*    C  29          2H5*        C  29  15.125 -18.286   6.347
  309    H4*    C  29           H4*        C  29  13.999 -18.373   8.358
  310    H3*    C  29           H3*        C  29  12.264 -19.354   6.125
  311    H2*    C  29           H2*        C  29  10.424 -19.636   7.631
  312   2HO*    C  29          2HO*        C  29  12.426 -20.037   9.363
  313    H1*    C  29           H1*        C  29  10.875 -17.294   9.134
  314   1H4     C  29          1H4         C  29   6.459 -15.274   5.175
  315   2H4     C  29          2H4         C  29   7.398 -14.958   3.872
  316    H5     C  29           H5         C  29   9.977 -15.719   4.126
  317    H6     C  29           H6         C  29  11.566 -16.814   5.621
  318   1H5*    C  30          1H5*        C  30  11.664 -22.193   9.082
  319   2H5*    C  30          2H5*        C  30  12.281 -23.753   8.500
  320    H4*    C  30           H4*        C  30  10.186 -24.261   9.353
  321    H3*    C  30           H3*        C  30  10.123 -24.014   6.369
  322    H2*    C  30           H2*        C  30   7.776 -24.340   6.330
  323   2HO*    C  30          2HO*        C  30   8.257 -25.942   8.319
  324    H1*    C  30           H1*        C  30   7.176 -22.845   8.645
  325   1H4     C  30          1H4         C  30   5.925 -18.928   3.901
  326   2H4     C  30          2H4         C  30   7.448 -18.767   3.278
  327    H5     C  30           H5         C  30   9.322 -20.276   4.426
  328    H6     C  30           H6         C  30   9.760 -21.834   6.234
  329    H3T    C  30           H3T        C  30  11.099 -25.761   7.224
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -2.258 -21.880   2.423
    2   2H5*    G   1          2H5*        G   1  -3.376 -20.548   2.765
    3    H4*    G   1           H4*        G   1  -2.950 -21.489   4.834
    4    H3*    G   1           H3*        G   1  -1.349 -18.988   4.462
    5    H2*    G   1           H2*        G   1  -0.310 -19.322   6.612
    6   2HO*    G   1          2HO*        G   1  -2.562 -20.734   7.047
    7    H1*    G   1           H1*        G   1   0.286 -21.995   6.219
    8    H8     G   1           H8         G   1   0.308 -19.829   3.062
    9    H1     G   1           H1         G   1   5.931 -20.543   6.040
   10   1H2     G   1          1H2         G   1   5.795 -21.445   7.712
   11   2H2     G   1          2H2         G   1   4.487 -22.068   8.570
   12    H5T    G   1           H5T        G   1  -0.775 -20.503   1.836
   13   1H5*    G   2          1H5*        G   2  -2.562 -19.117   8.166
   14   2H5*    G   2          2H5*        G   2  -3.471 -17.698   8.723
   15    H4*    G   2           H4*        G   2  -1.839 -18.080  10.351
   16    H3*    G   2           H3*        G   2  -1.124 -15.778   8.570
   17    H2*    G   2           H2*        G   2   0.955 -15.506   9.743
   18   2HO*    G   2          2HO*        G   2   1.108 -16.088  11.780
   19    H1*    G   2           H1*        G   2   1.591 -18.221   9.850
   20    H8     G   2           H8         G   2  -0.148 -17.139   6.635
   21    H1     G   2           H1         G   2   6.241 -16.689   6.674
   22   1H2     G   2          1H2         G   2   7.008 -16.978   8.383
   23   2H2     G   2          2H2         G   2   6.344 -17.343   9.887
   24   1H5*    U   3          1H5*        U   3  -0.091 -14.801  12.205
   25   2H5*    U   3          2H5*        U   3  -0.809 -13.296  12.813
   26    H4*    U   3           H4*        U   3   1.454 -13.072  13.260
   27    H3*    U   3           H3*        U   3   0.666 -11.541  10.817
   28    H2*    U   3           H2*        U   3   2.938 -10.890  10.442
   29   2HO*    U   3          2HO*        U   3   4.034 -10.522  12.224
   30    H1*    U   3           H1*        U   3   4.065 -13.382  10.921
   31    H3     U   3           H3         U   3   4.315 -13.384   6.421
   32    H5     U   3           H5         U   3   0.226 -13.808   7.187
   33    H6     U   3           H6         U   3   0.688 -13.440   9.518
   34   1H5*    G   4          1H5*        G   4   3.115  -9.194  13.251
   35   2H5*    G   4          2H5*        G   4   2.469  -7.553  13.444
   36    H4*    G   4           H4*        G   4   4.727  -7.326  12.830
   37    H3*    G   4           H3*        G   4   2.868  -6.668  10.571
   38    H2*    G   4           H2*        G   4   4.755  -6.285   9.134
   39   2HO*    G   4          2HO*        G   4   6.500  -5.502  10.038
   40    H1*    G   4           H1*        G   4   6.187  -8.536   9.936
   41    H8     G   4           H8         G   4   2.464  -9.211   9.837
   42    H1     G   4           H1         G   4   5.579 -10.021   4.308
   43   1H2     G   4          1H2         G   4   7.364  -9.353   4.340
   44   2H2     G   4          2H2         G   4   8.266  -8.553   5.515
   45   1H5*    C   5          1H5*        C   5   5.789  -4.027  10.884
   46   2H5*    C   5          2H5*        C   5   5.464  -2.300  10.644
   47    H4*    C   5           H4*        C   5   7.199  -2.933   9.157
   48    H3*    C   5           H3*        C   5   4.578  -2.386   7.803
   49    H2*    C   5           H2*        C   5   5.542  -2.958   5.693
   50   2HO*    C   5          2HO*        C   5   7.780  -2.105   6.952
   51    H1*    C   5           H1*        C   5   7.094  -5.123   6.623
   52   1H4     C   5          1H4         C   5   2.050  -7.940   4.149
   53   2H4     C   5          2H4         C   5   1.015  -7.707   5.419
   54    H5     C   5           H5         C   5   1.945  -6.244   7.424
   55    H6     C   5           H6         C   5   3.842  -4.901   8.171
   56   1H5*    G   6          1H5*        G   6   7.224  -1.169   5.186
   57   2H5*    G   6          2H5*        G   6   6.616   0.197   4.231
   58    H4*    G   6           H4*        G   6   6.895  -1.941   2.980
   59    H3*    G   6           H3*        G   6   4.328  -0.415   2.973
   60    H2*    G   6           H2*        G   6   3.232  -2.152   1.729
   61   2HO*    G   6          2HO*        G   6   5.551  -2.456   0.645
   62    H1*    G   6           H1*        G   6   4.286  -4.313   3.122
   63    H8     G   6           H8         G   6   3.730  -1.548   5.535
   64    H1     G   6           H1         G   6  -1.612  -4.802   4.154
   65   1H2     G   6          1H2         G   6  -1.317  -6.027   2.347
   66   2H2     G   6          2H2         G   6   0.211  -6.060   1.504
   67   1H5*    A   7          1H5*        A   7   7.597  -0.331   0.301
   68   2H5*    A   7          2H5*        A   7   8.266   0.854  -0.838
   69    H4*    A   7           H4*        A   7   7.580  -0.712  -2.312
   70    H3*    A   7           H3*        A   7   5.109   0.979  -1.931
   71    H2*    A   7           H2*        A   7   4.015  -0.460  -3.499
   72   2HO*    A   7          2HO*        A   7   5.792  -0.527  -4.989
   73    H1*    A   7           H1*        A   7   5.321  -2.836  -2.573
   74    H8     A   7           H8         A   7   3.801  -0.905   0.298
   75   1H6     A   7          1H6         A   7  -1.426  -3.974  -1.001
   76   2H6     A   7          2H6         A   7  -0.651  -2.918   0.152
   77    H2     A   7           H2         A   7   1.464  -4.705  -4.325
   78   1H5*    A   8          1H5*        A   8   2.907   3.251  -5.053
   79   2H5*    A   8          2H5*        A   8   3.248   2.369  -3.551
   80    H4*    A   8           H4*        A   8   3.597   0.806  -6.011
   81    H3*    A   8           H3*        A   8   0.950   2.072  -5.488
   82    H2*    A   8           H2*        A   8  -0.196  -0.018  -5.667
   83   2HO*    A   8          2HO*        A   8   1.534  -0.516  -7.470
   84    H1*    A   8           H1*        A   8   1.682  -1.588  -4.318
   85    H8     A   8           H8         A   8   1.999   0.728  -1.844
   86   1H6     A   8          1H6         A   8  -3.911   0.021  -0.150
   87   2H6     A   8          2H6         A   8  -2.440   0.646   0.501
   88    H2     A   8           H2         A   8  -3.536  -1.497  -4.214
   89   1H5*    G   9          1H5*        G   9  -0.048   0.345  -7.779
   90   2H5*    G   9          2H5*        G   9  -0.456   0.256  -9.501
   91    H4*    G   9           H4*        G   9  -2.576  -0.016  -8.977
   92    H3*    G   9           H3*        G   9  -2.364   2.689  -7.665
   93    H2*    G   9           H2*        G   9  -4.602   2.317  -6.853
   94   2HO*    G   9          2HO*        G   9  -5.802   1.134  -8.169
   95    H1*    G   9           H1*        G   9  -4.014  -0.222  -5.914
   96    H8     G   9           H8         G   9  -0.943   1.830  -5.536
   97    H1     G   9           H1         G   9  -5.316   2.922  -0.997
   98   1H2     G   9          1H2         G   9  -7.028   2.196  -1.393
   99   2H2     G   9          2H2         G   9  -7.632   1.331  -2.701
  100   1H5*    G  10          1H5*        G  10  -7.151   0.861  -9.611
  101   2H5*    G  10          2H5*        G  10  -7.303   2.173 -10.795
  102    H4*    G  10           H4*        G  10  -9.078   2.243  -9.133
  103    H3*    G  10           H3*        G  10  -7.175   4.588  -9.026
  104    H2*    G  10           H2*        G  10  -8.683   5.520  -7.393
  105   2HO*    G  10          2HO*        G  10 -10.399   3.328  -8.025
  106    H1*    G  10           H1*        G  10  -9.077   3.052  -6.071
  107    H8     G  10           H8         G  10  -5.468   3.658  -6.963
  108    H1     G  10           H1         G  10  -7.368   6.354  -1.485
  109   1H2     G  10          1H2         G  10  -9.260   6.334  -1.241
  110   2H2     G  10          2H2         G  10 -10.525   5.756  -2.181
  111   1H5*    G  11          1H5*        G  11 -11.242   5.882  -9.713
  112   2H5*    G  11          2H5*        G  11 -11.276   7.182 -10.920
  113    H4*    G  11           H4*        G  11 -12.621   7.868  -9.110
  114    H3*    G  11           H3*        G  11 -10.030   9.344  -9.274
  115    H2*    G  11           H2*        G  11 -10.497  10.507  -7.241
  116   2HO*    G  11          2HO*        G  11 -12.498  10.778  -6.516
  117    H1*    G  11           H1*        G  11 -11.465   8.331  -5.832
  118    H8     G  11           H8         G  11  -8.665   7.148  -8.030
  119    H1     G  11           H1         G  11  -6.870   9.752  -2.478
  120   1H2     G  11          1H2         G  11  -8.304  10.688  -1.591
  121   2H2     G  11          2H2         G  11  -9.916  10.952  -2.017
  122   1H5*    C  12          1H5*        C  12 -12.776  11.784  -8.018
  123   2H5*    C  12          2H5*        C  12 -12.968  13.275  -8.958
  124    H4*    C  12           H4*        C  12 -12.858  13.984  -6.752
  125    H3*    C  12           H3*        C  12 -10.203  14.392  -8.091
  126    H2*    C  12           H2*        C  12  -9.334  15.283  -6.038
  127   2HO*    C  12          2HO*        C  12 -11.762  16.151  -5.747
  128    H1*    C  12           H1*        C  12 -10.631  13.419  -4.351
  129   1H4     C  12          1H4         C  12  -4.806  11.082  -4.959
  130   2H4     C  12          2H4         C  12  -5.023  10.288  -6.394
  131    H5     C  12           H5         C  12  -7.338  10.781  -7.616
  132    H6     C  12           H6         C  12  -9.482  11.907  -7.403
  133   1H5*    G  13          1H5*        G  13  -8.670  18.923  -8.590
  134   2H5*    G  13          2H5*        G  13  -8.095  17.317  -8.095
  135    H4*    G  13           H4*        G  13  -8.828  19.585  -6.245
  136    H3*    G  13           H3*        G  13  -6.117  18.690  -7.201
  137    H2*    G  13           H2*        G  13  -5.267  19.106  -4.987
  138   2HO*    G  13          2HO*        G  13  -7.191  20.910  -4.975
  139    H1*    G  13           H1*        G  13  -7.454  17.963  -3.639
  140    H8     G  13           H8         G  13  -6.412  16.071  -6.760
  141    H1     G  13           H1         G  13  -3.181  14.492  -1.489
  142   1H2     G  13          1H2         G  13  -3.762  15.804   0.200
  143   2H2     G  13          2H2         G  13  -4.932  17.088  -0.003
  144   1H5*    U  14          1H5*        U  14  -3.156  22.963  -6.342
  145   2H5*    U  14          2H5*        U  14  -3.620  22.989  -8.054
  146    H4*    U  14           H4*        U  14  -1.413  22.451  -8.231
  147    H3*    U  14           H3*        U  14  -2.849  20.463  -9.131
  148    H2*    U  14           H2*        U  14  -3.319  19.421  -6.994
  149   2HO*    U  14          2HO*        U  14  -0.904  18.056  -7.425
  150    H1*    U  14           H1*        U  14  -0.352  19.536  -6.242
  151    H3     U  14           H3         U  14  -1.514  20.687  -1.780
  152    H5     U  14           H5         U  14  -4.171  17.832  -3.313
  153    H6     U  14           H6         U  14  -3.262  18.239  -5.478
  154   1H5*    C  15          1H5*        C  15  -0.391  15.986 -10.105
  155   2H5*    C  15          2H5*        C  15  -1.469  16.974  -9.100
  156    H4*    C  15           H4*        C  15   1.062  17.309  -7.989
  157    H3*    C  15           H3*        C  15   0.711  14.419  -8.789
  158    H2*    C  15           H2*        C  15   1.769  13.855  -6.695
  159   2HO*    C  15          2HO*        C  15   2.919  15.306  -5.598
  160    H1*    C  15           H1*        C  15   0.083  15.495  -5.216
  161   1H4     C  15          1H4         C  15  -3.552  10.479  -7.470
  162   2H4     C  15          2H4         C  15  -2.830   9.831  -6.012
  163    H5     C  15           H5         C  15  -1.247  11.126  -4.660
  164    H6     C  15           H6         C  15   0.143  13.100  -4.635
  165   1H5*    G  16          1H5*        G  16   5.534  14.409 -12.062
  166   2H5*    G  16          2H5*        G  16   4.582  13.328 -11.026
  167    H4*    G  16           H4*        G  16   6.880  13.848 -10.208
  168    H3*    G  16           H3*        G  16   4.440  14.183  -8.541
  169    H2*    G  16           H2*        G  16   5.632  15.297  -6.790
  170   2HO*    G  16          2HO*        G  16   7.536  14.333  -6.498
  171    H1*    G  16           H1*        G  16   7.218  16.926  -8.391
  172    H8     G  16           H8         G  16   4.141  16.500  -6.706
  173    H1     G  16           H1         G  16   3.558  21.143 -11.089
  174   1H2     G  16          1H2         G  16   5.211  21.031 -12.545
  175   2H2     G  16          2H2         G  16   6.465  19.814 -12.426
  176   1H5*    U  17          1H5*        U  17   2.395  10.545  -6.443
  177   2H5*    U  17          2H5*        U  17   2.515  12.287  -6.730
  178    H4*    U  17           H4*        U  17   4.360  11.396  -4.710
  179    H3*    U  17           H3*        U  17   1.907  10.085  -4.399
  180    H2*    U  17           H2*        U  17   0.686  11.825  -3.484
  181   2HO*    U  17          2HO*        U  17   2.270  10.696  -1.581
  182    H1*    U  17           H1*        U  17   3.257  13.209  -2.549
  183    H3     U  17           H3         U  17   1.592  17.452  -3.760
  184    H5     U  17           H5         U  17  -1.537  15.053  -2.325
  185    H6     U  17           H6         U  17  -0.057  13.154  -2.549
  186   1H5*    C  18          1H5*        C  18   5.226  13.994  -2.077
  187   2H5*    C  18          2H5*        C  18   6.213  12.638  -1.495
  188    H4*    C  18           H4*        C  18   5.340  12.695   0.540
  189    H3*    C  18           H3*        C  18   2.878  12.326  -0.400
  190    H2*    C  18           H2*        C  18   2.343  14.610  -0.907
  191   2HO*    C  18          2HO*        C  18   1.964  15.186   1.765
  192    H1*    C  18           H1*        C  18   3.824  15.554   1.595
  193   1H4     C  18          1H4         C  18   4.474  20.975  -1.702
  194   2H4     C  18          2H4         C  18   2.960  20.609  -2.497
  195    H5     C  18           H5         C  18   1.821  18.473  -2.200
  196    H6     C  18           H6         C  18   1.910  16.316  -1.137
  197   1H5*    G  19          1H5*        G  19   1.764  13.602   2.345
  198   2H5*    G  19          2H5*        G  19   1.027  13.315   3.932
  199    H4*    G  19           H4*        G  19  -0.533  14.455   2.555
  200    H3*    G  19           H3*        G  19  -1.200  11.650   3.229
  201    H2*    G  19           H2*        G  19  -2.778  11.435   1.562
  202   2HO*    G  19          2HO*        G  19  -4.058  13.048   2.738
  203    H1*    G  19           H1*        G  19  -2.041  14.044   0.205
  204    H8     G  19           H8         G  19   0.165  11.326  -0.801
  205    H1     G  19           H1         G  19  -5.545  11.279  -3.756
  206   1H2     G  19          1H2         G  19  -6.812  12.449  -2.978
  207   2H2     G  19          2H2         G  19  -6.756  13.448  -1.623
  208   1H5*    C  20          1H5*        C  20  -4.621  14.308   4.184
  209   2H5*    C  20          2H5*        C  20  -5.236  13.814   5.772
  210    H4*    C  20           H4*        C  20  -7.142  13.974   4.513
  211    H3*    C  20           H3*        C  20  -6.318  11.077   4.447
  212    H2*    C  20           H2*        C  20  -8.276  10.654   3.128
  213   2HO*    C  20          2HO*        C  20  -9.199  12.725   4.533
  214    H1*    C  20           H1*        C  20  -8.051  13.055   1.614
  215   1H4     C  20          1H4         C  20  -5.831   8.766  -2.351
  216   2H4     C  20          2H4         C  20  -4.318   8.573  -1.713
  217    H5     C  20           H5         C  20  -3.926   9.789   0.641
  218    H6     C  20           H6         C  20  -4.938  11.295   2.272
  219   1H5*    C  21          1H5*        C  21 -10.148  11.182   4.964
  220   2H5*    C  21          2H5*        C  21 -10.762  10.215   6.320
  221    H4*    C  21           H4*        C  21 -12.064   9.585   4.494
  222    H3*    C  21           H3*        C  21  -9.934   7.515   4.986
  223    H2*    C  21           H2*        C  21 -10.784   6.268   3.122
  224   2HO*    C  21          2HO*        C  21 -12.806   7.061   2.115
  225    H1*    C  21           H1*        C  21 -11.358   8.548   1.518
  226   1H4     C  21          1H4         C  21  -6.048   6.313  -0.963
  227   2H4     C  21          2H4         C  21  -4.978   6.967   0.117
  228    H5     C  21           H5         C  21  -6.073   8.181   2.212
  229    H6     C  21           H6         C  21  -8.191   8.785   3.255
  230   1H5*    C  22          1H5*        C  22  -9.876   3.818   5.605
  231   2H5*    C  22          2H5*        C  22  -9.926   5.158   4.445
  232    H4*    C  22           H4*        C  22 -12.013   3.233   3.916
  233    H3*    C  22           H3*        C  22  -9.283   2.086   4.308
  234    H2*    C  22           H2*        C  22  -9.370   0.948   2.222
  235   2HO*    C  22          2HO*        C  22 -12.045   1.065   2.729
  236    H1*    C  22           H1*        C  22 -10.558   2.980   0.730
  237   1H4     C  22          1H4         C  22  -4.345   3.525  -0.156
  238   2H4     C  22          2H4         C  22  -3.968   4.269   1.274
  239    H5     C  22           H5         C  22  -5.967   4.509   3.001
  240    H6     C  22           H6         C  22  -8.341   4.157   3.326
  241   1H5*    C  23          1H5*        C  23 -11.299  -0.871   2.606
  242   2H5*    C  23          2H5*        C  23 -10.824  -2.453   3.254
  243    H4*    C  23           H4*        C  23 -10.295  -2.172   0.871
  244    H3*    C  23           H3*        C  23  -8.024  -2.649   2.779
  245    H2*    C  23           H2*        C  23  -6.514  -2.677   0.912
  246   2HO*    C  23          2HO*        C  23  -7.629  -3.677  -0.727
  247    H1*    C  23           H1*        C  23  -7.607  -0.402  -0.280
  248   1H4     C  23          1H4         C  23  -2.893   1.777   3.382
  249   2H4     C  23          2H4         C  23  -4.035   2.003   4.693
  250    H5     C  23           H5         C  23  -6.323   1.234   4.595
  251    H6     C  23           H6         C  23  -7.997   0.127   3.207
  252   1H5*    G  24          1H5*        G  24  -7.394  -6.962   0.174
  253   2H5*    G  24          2H5*        G  24  -7.018  -5.546   1.175
  254    H4*    G  24           H4*        G  24  -6.169  -5.704  -1.694
  255    H3*    G  24           H3*        G  24  -5.228  -7.672  -0.152
  256    H2*    G  24           H2*        G  24  -4.376  -6.391   1.680
  257   2HO*    G  24          2HO*        G  24  -2.518  -6.861  -0.297
  258    H1*    G  24           H1*        G  24  -3.320  -4.213  -0.178
  259    H8     G  24           H8         G  24  -6.107  -4.266   2.474
  260    H1     G  24           H1         G  24  -0.935  -0.780   3.963
  261   1H2     G  24          1H2         G  24   0.610  -1.006   2.435
  262   2H2     G  24          2H2         G  24   0.403  -2.017   1.029
  263   1H5*    A  25          1H5*        A  25  -2.488  -9.949  -2.039
  264   2H5*    A  25          2H5*        A  25  -2.335  -8.187  -1.898
  265    H4*    A  25           H4*        A  25  -1.805  -9.339  -4.562
  266    H3*    A  25           H3*        A  25  -0.174 -10.210  -2.241
  267    H2*    A  25           H2*        A  25   1.886  -9.500  -3.225
  268   2HO*    A  25          2HO*        A  25   1.843 -10.132  -5.291
  269    H1*    A  25           H1*        A  25   0.993  -7.130  -4.387
  270    H8     A  25           H8         A  25  -0.771  -7.193  -1.138
  271   1H6     A  25          1H6         A  25   4.287  -4.607   1.292
  272   2H6     A  25          2H6         A  25   2.596  -4.985   1.565
  273    H2     A  25           H2         A  25   5.387  -6.290  -2.696
  274   1H5*    G  26          1H5*        G  26   2.793 -12.340  -4.918
  275   2H5*    G  26          2H5*        G  26   3.272 -13.405  -3.582
  276    H4*    G  26           H4*        G  26   4.841 -11.482  -4.380
  277    H3*    G  26           H3*        G  26   4.324 -12.325  -1.556
  278    H2*    G  26           H2*        G  26   5.677 -10.530  -0.725
  279   2HO*    G  26          2HO*        G  26   7.353 -10.386  -2.222
  280    H1*    G  26           H1*        G  26   4.547  -8.590  -2.323
  281    H8     G  26           H8         G  26   1.678 -10.773  -1.811
  282    H1     G  26           H1         G  26   3.184  -7.467   3.450
  283   1H2     G  26          1H2         G  26   4.948  -6.725   3.405
  284   2H2     G  26          2H2         G  26   6.169  -6.748   2.248
  285   1H5*    C  27          1H5*        C  27   9.009 -10.023  -3.236
  286   2H5*    C  27          2H5*        C  27   9.989 -11.494  -3.391
  287    H4*    C  27           H4*        C  27  11.095 -10.068  -1.868
  288    H3*    C  27           H3*        C  27   9.788 -12.411  -0.521
  289    H2*    C  27           H2*        C  27  10.563 -11.596   1.603
  290   2HO*    C  27          2HO*        C  27  12.492 -10.570   0.105
  291    H1*    C  27           H1*        C  27   9.892  -8.926   1.147
  292   1H4     C  27          1H4         C  27   4.797 -11.197   4.050
  293   2H4     C  27          2H4         C  27   4.131 -12.011   2.764
  294    H5     C  27           H5         C  27   5.621 -12.133   0.584
  295    H6     C  27           H6         C  27   7.706 -11.382  -0.430
  296   1H5*    G  28          1H5*        G  28  13.236 -11.815   1.185
  297   2H5*    G  28          2H5*        G  28  14.287 -13.240   1.305
  298    H4*    G  28           H4*        G  28  14.202 -12.334   3.459
  299    H3*    G  28           H3*        G  28  12.442 -14.758   3.243
  300    H2*    G  28           H2*        G  28  11.776 -14.451   5.528
  301   2HO*    G  28          2HO*        G  28  14.204 -13.393   5.705
  302    H1*    G  28           H1*        G  28  11.543 -11.658   5.394
  303    H8     G  28           H8         G  28  10.134 -13.254   2.287
  304    H1     G  28           H1         G  28   6.082 -12.982   7.251
  305   1H2     G  28          1H2         G  28   7.138 -12.454   9.072
  306   2H2     G  28          2H2         G  28   8.863 -12.158   9.093
  307   1H5*    C  29          1H5*        C  29  14.419 -15.065   6.851
  308   2H5*    C  29          2H5*        C  29  15.353 -16.574   6.889
  309    H4*    C  29           H4*        C  29  14.255 -16.545   8.926
  310    H3*    C  29           H3*        C  29  12.853 -18.340   6.984
  311    H2*    C  29           H2*        C  29  11.122 -18.773   8.579
  312   2HO*    C  29          2HO*        C  29  11.863 -18.978  10.566
  313    H1*    C  29           H1*        C  29  10.926 -16.146   9.567
  314   1H4     C  29          1H4         C  29   6.287 -16.271   5.335
  315   2H4     C  29          2H4         C  29   7.184 -15.919   4.001
  316    H5     C  29           H5         C  29   9.824 -15.806   4.383
  317    H6     C  29           H6         C  29  11.590 -16.139   6.035
  318   1H5*    C  30          1H5*        C  30  12.909 -20.497  10.489
  319   2H5*    C  30          2H5*        C  30  13.889 -21.959  10.257
  320    H4*    C  30           H4*        C  30  11.965 -22.716  11.316
  321    H3*    C  30           H3*        C  30  11.885 -23.251   8.369
  322    H2*    C  30           H2*        C  30   9.692 -24.135   8.534
  323   2HO*    C  30          2HO*        C  30   8.775 -24.597  10.626
  324    H1*    C  30           H1*        C  30   8.712 -22.285  10.422
  325   1H4     C  30          1H4         C  30   6.638 -20.241   4.856
  326   2H4     C  30          2H4         C  30   8.084 -19.819   4.175
  327    H5     C  30           H5         C  30  10.243 -20.404   5.621
  328    H6     C  30           H6         C  30  11.010 -21.266   7.753
  329    H3T    C  30           H3T        C  30  11.800 -25.093  10.433
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  -5.191 -17.925  -0.735
    2   2H5*    G   1          2H5*        G   1  -5.780 -16.391  -0.070
    3    H4*    G   1           H4*        G   1  -6.160 -17.933   1.613
    4    H3*    G   1           H3*        G   1  -3.702 -16.323   2.192
    5    H2*    G   1           H2*        G   1  -3.321 -17.608   4.193
    6   2HO*    G   1          2HO*        G   1  -5.984 -17.984   3.980
    7    H1*    G   1           H1*        G   1  -3.777 -20.090   3.031
    8    H8     G   1           H8         G   1  -2.132 -17.404   0.835
    9    H1     G   1           H1         G   1   1.815 -21.439   3.859
   10   1H2     G   1          1H2         G   1   0.924 -22.604   5.074
   11   2H2     G   1          2H2         G   1  -0.690 -22.767   5.523
   12    H5T    G   1           H5T        G   1  -3.803 -15.947  -0.913
   13   1H5*    G   2          1H5*        G   2  -5.553 -16.909   5.576
   14   2H5*    G   2          2H5*        G   2  -6.047 -15.421   6.408
   15    H4*    G   2           H4*        G   2  -5.043 -16.693   8.063
   16    H3*    G   2           H3*        G   2  -3.135 -14.616   7.040
   17    H2*    G   2           H2*        G   2  -1.465 -15.426   8.571
   18   2HO*    G   2          2HO*        G   2  -3.613 -16.154   9.960
   19    H1*    G   2           H1*        G   2  -1.915 -18.134   8.054
   20    H8     G   2           H8         G   2  -2.212 -15.690   5.113
   21    H1     G   2           H1         G   2   3.503 -18.452   5.961
   22   1H2     G   2          1H2         G   2   3.624 -19.472   7.557
   23   2H2     G   2          2H2         G   2   2.525 -19.812   8.784
   24   1H5*    U   3          1H5*        U   3  -2.683 -14.633  10.891
   25   2H5*    U   3          2H5*        U   3  -2.924 -13.059  11.675
   26    H4*    U   3           H4*        U   3  -0.878 -13.792  12.480
   27    H3*    U   3           H3*        U   3  -0.504 -11.796  10.276
   28    H2*    U   3           H2*        U   3   1.882 -12.038  10.463
   29   2HO*    U   3          2HO*        U   3   1.213 -12.783  12.960
   30    H1*    U   3           H1*        U   3   1.872 -14.816  10.575
   31    H3     U   3           H3         U   3   3.132 -14.389   6.284
   32    H5     U   3           H5         U   3  -0.822 -13.012   6.273
   33    H6     U   3           H6         U   3  -0.835 -13.231   8.669
   34   1H5*    G   4          1H5*        G   4   2.018 -10.880  13.436
   35   2H5*    G   4          2H5*        G   4   1.983  -9.150  13.831
   36    H4*    G   4           H4*        G   4   4.246  -9.743  13.621
   37    H3*    G   4           H3*        G   4   3.283  -8.214  11.217
   38    H2*    G   4           H2*        G   4   5.496  -8.408  10.272
   39   2HO*    G   4          2HO*        G   4   6.171  -8.580  12.849
   40    H1*    G   4           H1*        G   4   5.792 -11.118  10.888
   41    H8     G   4           H8         G   4   2.224 -10.249   9.947
   42    H1     G   4           H1         G   4   6.134 -11.574   5.054
   43   1H2     G   4          1H2         G   4   7.959 -11.715   5.562
   44   2H2     G   4          2H2         G   4   8.756 -11.532   7.034
   45   1H5*    C   5          1H5*        C   5   6.825  -6.696  12.505
   46   2H5*    C   5          2H5*        C   5   6.966  -4.927  12.514
   47    H4*    C   5           H4*        C   5   8.798  -5.865  11.293
   48    H3*    C   5           H3*        C   5   6.815  -4.305   9.681
   49    H2*    C   5           H2*        C   5   7.951  -4.851   7.663
   50   2HO*    C   5          2HO*        C   5  10.062  -4.911   9.363
   51    H1*    C   5           H1*        C   5   8.689  -7.491   8.372
   52   1H4     C   5          1H4         C   5   3.791  -8.243   4.509
   53   2H4     C   5          2H4         C   5   2.587  -8.024   5.627
   54    H5     C   5           H5         C   5   3.380  -7.242   8.039
   55    H6     C   5           H6         C   5   5.338  -6.633   9.370
   56   1H5*    G   6          1H5*        G   6  10.136  -3.700   7.493
   57   2H5*    G   6          2H5*        G   6  10.107  -2.007   6.963
   58    H4*    G   6           H4*        G   6   9.869  -3.642   5.125
   59    H3*    G   6           H3*        G   6   7.801  -1.535   5.589
   60    H2*    G   6           H2*        G   6   6.424  -2.424   3.839
   61   2HO*    G   6          2HO*        G   6   8.492  -2.953   2.582
   62    H1*    G   6           H1*        G   6   6.696  -5.102   4.530
   63    H8     G   6           H8         G   6   6.711  -2.702   7.445
   64    H1     G   6           H1         G   6   0.879  -4.671   5.686
   65   1H2     G   6          1H2         G   6   0.981  -5.710   3.733
   66   2H2     G   6          2H2         G   6   2.500  -5.931   2.906
   67   1H5*    A   7          1H5*        A   7  10.498  -1.560   2.433
   68   2H5*    A   7          2H5*        A   7  11.255  -0.261   1.490
   69    H4*    A   7           H4*        A   7  10.599  -1.706  -0.155
   70    H3*    A   7           H3*        A   7   8.401   0.324   0.164
   71    H2*    A   7           H2*        A   7   7.122  -0.834  -1.481
   72   2HO*    A   7          2HO*        A   7   9.430  -1.205  -2.577
   73    H1*    A   7           H1*        A   7   7.985  -3.456  -0.733
   74    H8     A   7           H8         A   7   6.775  -1.543   2.283
   75   1H6     A   7          1H6         A   7   1.125  -3.594   0.772
   76   2H6     A   7          2H6         A   7   2.069  -2.790   2.004
   77    H2     A   7           H2         A   7   3.882  -4.507  -2.626
   78   1H5*    A   8          1H5*        A   8   7.409   2.495  -3.738
   79   2H5*    A   8          2H5*        A   8   6.025   2.545  -2.629
   80    H4*    A   8           H4*        A   8   6.962   0.366  -4.429
   81    H3*    A   8           H3*        A   8   4.395   1.800  -3.991
   82    H2*    A   8           H2*        A   8   3.090  -0.193  -4.200
   83   2HO*    A   8          2HO*        A   8   3.763  -1.692  -5.544
   84    H1*    A   8           H1*        A   8   4.757  -1.902  -2.769
   85    H8     A   8           H8         A   8   5.275   0.699  -0.493
   86   1H6     A   8          1H6         A   8  -0.593   0.282   1.417
   87   2H6     A   8          2H6         A   8   0.907   0.954   1.946
   88    H2     A   8           H2         A   8  -0.329  -1.787  -2.404
   89   1H5*    G   9          1H5*        G   9   2.764  -0.702  -6.618
   90   2H5*    G   9          2H5*        G   9   2.138   0.337  -7.913
   91    H4*    G   9           H4*        G   9   0.329  -0.923  -6.995
   92    H3*    G   9           H3*        G   9   0.280   1.994  -6.287
   93    H2*    G   9           H2*        G   9  -1.804   1.625  -5.133
   94   2HO*    G   9          2HO*        G   9  -2.986   0.075  -6.014
   95    H1*    G   9           H1*        G   9  -0.882  -0.586  -3.752
   96    H8     G   9           H8         G   9   2.127   1.481  -4.101
   97    H1     G   9           H1         G   9  -1.873   3.671   0.377
   98   1H2     G   9          1H2         G   9  -3.636   2.957   0.245
   99   2H2     G   9          2H2         G   9  -4.348   1.847  -0.793
  100   1H5*    G  10          1H5*        G  10  -4.382  -0.554  -6.981
  101   2H5*    G  10          2H5*        G  10  -4.918   0.462  -8.333
  102    H4*    G  10           H4*        G  10  -6.308   0.711  -6.321
  103    H3*    G  10           H3*        G  10  -4.830   3.195  -7.207
  104    H2*    G  10           H2*        G  10  -6.091   4.341  -5.519
  105   2HO*    G  10          2HO*        G  10  -8.114   3.659  -5.388
  106    H1*    G  10           H1*        G  10  -5.883   2.199  -3.647
  107    H8     G  10           H8         G  10  -2.597   3.071  -5.268
  108    H1     G  10           H1         G  10  -4.252   6.847  -0.371
  109   1H2     G  10          1H2         G  10  -6.072   6.629   0.175
  110   2H2     G  10          2H2         G  10  -7.306   5.617  -0.351
  111   1H5*    G  11          1H5*        G  11  -9.222   3.504  -7.259
  112   2H5*    G  11          2H5*        G  11  -9.744   4.493  -8.636
  113    H4*    G  11           H4*        G  11 -10.973   5.187  -6.732
  114    H3*    G  11           H3*        G  11  -8.903   7.189  -7.569
  115    H2*    G  11           H2*        G  11  -9.504   8.582  -5.710
  116   2HO*    G  11          2HO*        G  11 -11.446   8.468  -4.843
  117    H1*    G  11           H1*        G  11  -9.554   6.551  -3.837
  118    H8     G  11           H8         G  11  -6.860   5.689  -6.278
  119    H1     G  11           H1         G  11  -5.180  10.039  -1.905
  120   1H2     G  11          1H2         G  11  -6.695  10.795  -0.975
  121   2H2     G  11          2H2         G  11  -8.350  10.492  -1.075
  122   1H5*    C  12          1H5*        C  12 -12.261   9.174  -6.500
  123   2H5*    C  12          2H5*        C  12 -12.758  10.397  -7.686
  124    H4*    C  12           H4*        C  12 -12.751  11.435  -5.566
  125    H3*    C  12           H3*        C  12 -10.398  12.311  -7.229
  126    H2*    C  12           H2*        C  12  -9.767  13.773  -5.411
  127   2HO*    C  12          2HO*        C  12 -12.317  13.855  -4.965
  128    H1*    C  12           H1*        C  12 -10.181  11.859  -3.410
  129   1H4     C  12          1H4         C  12  -4.027  11.325  -4.832
  130   2H4     C  12          2H4         C  12  -4.234  10.201  -6.026
  131    H5     C  12           H5         C  12  -6.710   9.626  -6.724
  132    H6     C  12           H6         C  12  -9.051  10.097  -6.274
  133   1H5*    G  13          1H5*        G  13 -11.025  17.396  -6.536
  134   2H5*    G  13          2H5*        G  13 -11.763  17.104  -8.121
  135    H4*    G  13           H4*        G  13  -9.762  18.511  -8.259
  136    H3*    G  13           H3*        G  13  -9.807  15.890  -9.700
  137    H2*    G  13           H2*        G  13  -7.537  16.121 -10.355
  138   2HO*    G  13          2HO*        G  13  -7.972  18.504 -10.760
  139    H1*    G  13           H1*        G  13  -6.571  17.198  -7.976
  140    H8     G  13           H8         G  13  -8.927  14.575  -6.965
  141    H1     G  13           H1         G  13  -3.341  12.187  -8.925
  142   1H2     G  13          1H2         G  13  -2.148  13.767  -9.981
  143   2H2     G  13          2H2         G  13  -2.760  15.391 -10.172
  144   1H5*    U  14          1H5*        U  14 -10.614  21.448  -8.283
  145   2H5*    U  14          2H5*        U  14 -10.737  21.664 -10.039
  146    H4*    U  14           H4*        U  14  -8.959  22.976  -9.797
  147    H3*    U  14           H3*        U  14  -7.961  20.714 -10.727
  148    H2*    U  14           H2*        U  14  -7.615  19.568  -8.643
  149   2HO*    U  14          2HO*        U  14  -5.365  19.809  -8.126
  150    H1*    U  14           H1*        U  14  -6.428  22.086  -7.382
  151    H3     U  14           H3         U  14  -8.387  21.321  -3.223
  152    H5     U  14           H5         U  14  -7.507  17.637  -5.026
  153    H6     U  14           H6         U  14  -7.247  18.772  -7.088
  154   1H5*    C  15          1H5*        C  15  -4.383  19.203 -11.938
  155   2H5*    C  15          2H5*        C  15  -5.290  19.164 -10.414
  156    H4*    C  15           H4*        C  15  -2.337  19.734 -10.538
  157    H3*    C  15           H3*        C  15  -3.660  17.028 -10.442
  158    H2*    C  15           H2*        C  15  -1.887  16.329  -8.957
  159   2HO*    C  15          2HO*        C  15  -0.131  17.787  -8.544
  160    H1*    C  15           H1*        C  15  -1.944  18.680  -7.406
  161   1H4     C  15          1H4         C  15  -7.116  15.715  -4.813
  162   2H4     C  15          2H4         C  15  -6.106  14.290  -4.913
  163    H5     C  15           H5         C  15  -3.946  14.294  -6.016
  164    H6     C  15           H6         C  15  -2.343  15.659  -7.231
  165   1H5*    G  16          1H5*        G  16  -0.899  15.255 -15.306
  166   2H5*    G  16          2H5*        G  16  -1.389  14.576 -13.743
  167    H4*    G  16           H4*        G  16   1.091  14.733 -14.201
  168    H3*    G  16           H3*        G  16  -0.105  15.846 -11.670
  169    H2*    G  16           H2*        G  16   2.094  16.521 -10.994
  170   2HO*    G  16          2HO*        G  16   2.762  14.423 -12.627
  171    H1*    G  16           H1*        G  16   2.963  17.252 -13.616
  172    H8     G  16           H8         G  16  -0.223  18.262 -11.639
  173    H1     G  16           H1         G  16   4.153  22.855 -12.604
  174   1H2     G  16          1H2         G  16   5.886  22.046 -13.696
  175   2H2     G  16          2H2         G  16   5.960  20.369 -14.189
  176   1H5*    U  17          1H5*        U  17   0.286  13.381  -7.683
  177   2H5*    U  17          2H5*        U  17  -1.258  14.252  -7.724
  178    H4*    U  17           H4*        U  17   1.090  15.840  -8.465
  179    H3*    U  17           H3*        U  17   1.517  14.290  -6.202
  180    H2*    U  17           H2*        U  17   0.019  15.346  -4.768
  181   2HO*    U  17          2HO*        U  17   2.421  16.316  -4.568
  182    H1*    U  17           H1*        U  17   0.379  17.974  -6.300
  183    H3     U  17           H3         U  17  -3.078  20.176  -4.580
  184    H5     U  17           H5         U  17  -3.895  16.240  -3.487
  185    H6     U  17           H6         U  17  -1.935  15.561  -4.721
  186   1H5*    C  18          1H5*        C  18   1.344  18.303  -5.022
  187   2H5*    C  18          2H5*        C  18   1.771  19.713  -6.007
  188    H4*    C  18           H4*        C  18   3.700  19.487  -3.983
  189    H3*    C  18           H3*        C  18   1.672  18.130  -2.901
  190    H2*    C  18           H2*        C  18  -0.076  19.707  -3.109
  191   2HO*    C  18          2HO*        C  18   1.300  20.907  -0.921
  192    H1*    C  18           H1*        C  18   1.759  22.063  -2.508
  193   1H4     C  18          1H4         C  18  -2.260  25.380  -6.147
  194   2H4     C  18          2H4         C  18  -3.429  24.082  -6.050
  195    H5     C  18           H5         C  18  -2.933  21.939  -5.010
  196    H6     C  18           H6         C  18  -1.249  20.667  -3.829
  197   1H5*    G  19          1H5*        G  19   1.281  19.327  -0.581
  198   2H5*    G  19          2H5*        G  19   1.153  19.061   1.161
  199    H4*    G  19           H4*        G  19  -0.978  18.788   0.098
  200    H3*    G  19           H3*        G  19   0.170  16.352   1.353
  201    H2*    G  19           H2*        G  19  -1.274  14.928   0.255
  202   2HO*    G  19          2HO*        G  19  -3.037  15.869   1.480
  203    H1*    G  19           H1*        G  19  -2.317  17.084  -1.618
  204    H8     G  19           H8         G  19   0.848  15.266  -2.502
  205    H1     G  19           H1         G  19  -4.613  12.522  -4.421
  206   1H2     G  19          1H2         G  19  -6.162  13.237  -3.481
  207   2H2     G  19          2H2         G  19  -6.308  14.491  -2.349
  208   1H5*    C  20          1H5*        C  20  -3.944  17.330   2.619
  209   2H5*    C  20          2H5*        C  20  -4.082  17.040   4.361
  210    H4*    C  20           H4*        C  20  -6.011  16.137   3.496
  211    H3*    C  20           H3*        C  20  -4.092  13.835   3.832
  212    H2*    C  20           H2*        C  20  -5.868  12.413   3.063
  213   2HO*    C  20          2HO*        C  20  -7.355  14.251   4.256
  214    H1*    C  20           H1*        C  20  -6.825  14.294   1.134
  215   1H4     C  20          1H4         C  20  -3.857  10.144  -2.442
  216   2H4     C  20          2H4         C  20  -2.289  10.583  -2.123
  217    H5     C  20           H5         C  20  -1.997  12.434  -0.221
  218    H6     C  20           H6         C  20  -3.217  13.915   1.289
  219   1H5*    C  21          1H5*        C  21  -7.608  12.840   5.130
  220   2H5*    C  21          2H5*        C  21  -7.653  12.051   6.717
  221    H4*    C  21           H4*        C  21  -8.915  10.719   5.239
  222    H3*    C  21           H3*        C  21  -6.242   9.440   5.801
  223    H2*    C  21           H2*        C  21  -6.938   7.605   4.416
  224   2HO*    C  21          2HO*        C  21  -9.304   8.269   5.385
  225    H1*    C  21           H1*        C  21  -8.321   9.247   2.528
  226   1H4     C  21          1H4         C  21  -3.051   7.600  -0.481
  227   2H4     C  21          2H4         C  21  -2.044   8.737   0.177
  228    H5     C  21           H5         C  21  -3.101  10.243   2.096
  229    H6     C  21           H6         C  21  -5.126  10.656   3.390
  230   1H5*    C  22          1H5*        C  22  -5.679   5.497   7.064
  231   2H5*    C  22          2H5*        C  22  -5.868   6.759   5.833
  232    H4*    C  22           H4*        C  22  -8.037   4.850   5.732
  233    H3*    C  22           H3*        C  22  -5.306   3.662   5.844
  234    H2*    C  22           H2*        C  22  -5.609   2.459   3.826
  235   2HO*    C  22          2HO*        C  22  -8.217   2.583   4.628
  236    H1*    C  22           H1*        C  22  -7.021   4.382   2.390
  237   1H4     C  22          1H4         C  22  -0.949   4.696   0.748
  238   2H4     C  22          2H4         C  22  -0.434   5.698   1.963
  239    H5     C  22           H5         C  22  -2.264   6.253   3.813
  240    H6     C  22           H6         C  22  -4.586   5.974   4.428
  241   1H5*    C  23          1H5*        C  23  -7.832   0.706   4.437
  242   2H5*    C  23          2H5*        C  23  -7.472  -0.831   5.247
  243    H4*    C  23           H4*        C  23  -7.316  -0.911   2.778
  244    H3*    C  23           H3*        C  23  -5.067  -1.760   4.531
  245    H2*    C  23           H2*        C  23  -3.565  -2.004   2.682
  246   2HO*    C  23          2HO*        C  23  -5.986  -2.174   1.305
  247    H1*    C  23           H1*        C  23  -4.331   0.260   1.253
  248   1H4     C  23          1H4         C  23   0.586   2.308   4.680
  249   2H4     C  23          2H4         C  23  -0.506   2.771   5.970
  250    H5     C  23           H5         C  23  -2.864   2.229   5.949
  251    H6     C  23           H6         C  23  -4.652   1.160   4.681
  252   1H5*    G  24          1H5*        G  24  -5.013  -3.891   1.354
  253   2H5*    G  24          2H5*        G  24  -4.988  -5.659   1.503
  254    H4*    G  24           H4*        G  24  -3.219  -4.791   0.052
  255    H3*    G  24           H3*        G  24  -2.894  -6.855   1.730
  256    H2*    G  24           H2*        G  24  -1.947  -5.739   3.607
  257   2HO*    G  24          2HO*        G  24   0.034  -6.407   1.739
  258    H1*    G  24           H1*        G  24  -0.329  -3.842   1.854
  259    H8     G  24           H8         G  24  -3.257  -3.515   4.342
  260    H1     G  24           H1         G  24   2.197  -0.631   6.072
  261   1H2     G  24          1H2         G  24   3.755  -0.960   4.553
  262   2H2     G  24          2H2         G  24   3.444  -1.899   3.112
  263   1H5*    A  25          1H5*        A  25  -1.028  -9.643  -2.852
  264   2H5*    A  25          2H5*        A  25  -0.029  -9.792  -1.393
  265    H4*    A  25           H4*        A  25   0.520  -8.454  -3.958
  266    H3*    A  25           H3*        A  25   2.150  -9.949  -1.931
  267    H2*    A  25           H2*        A  25   4.097  -8.702  -2.561
  268   2HO*    A  25          2HO*        A  25   2.821  -8.701  -4.917
  269    H1*    A  25           H1*        A  25   2.759  -6.240  -3.000
  270    H8     A  25           H8         A  25   1.289  -6.624   0.117
  271   1H6     A  25          1H6         A  25   6.707  -5.522   2.893
  272   2H6     A  25          2H6         A  25   4.968  -5.553   3.112
  273    H2     A  25           H2         A  25   7.550  -6.842  -1.286
  274   1H5*    G  26          1H5*        G  26   5.021 -10.361  -4.820
  275   2H5*    G  26          2H5*        G  26   5.482 -12.073  -4.732
  276    H4*    G  26           H4*        G  26   7.362 -10.684  -4.192
  277    H3*    G  26           H3*        G  26   6.300 -12.474  -2.075
  278    H2*    G  26           H2*        G  26   7.632 -11.480  -0.362
  279   2HO*    G  26          2HO*        G  26   9.607 -11.274  -1.227
  280    H1*    G  26           H1*        G  26   7.432  -8.829  -1.152
  281    H8     G  26           H8         G  26   4.092 -10.396  -1.710
  282    H1     G  26           H1         G  26   5.172  -8.536   4.312
  283   1H2     G  26          1H2         G  26   7.021  -8.128   4.659
  284   2H2     G  26          2H2         G  26   8.401  -8.178   3.699
  285   1H5*    C  27          1H5*        C  27  11.128 -11.995  -1.476
  286   2H5*    C  27          2H5*        C  27  11.354 -13.724  -1.808
  287    H4*    C  27           H4*        C  27  12.614 -13.211   0.121
  288    H3*    C  27           H3*        C  27  10.143 -14.808   0.666
  289    H2*    C  27           H2*        C  27  10.570 -14.738   3.022
  290   2HO*    C  27          2HO*        C  27  13.084 -14.586   2.212
  291    H1*    C  27           H1*        C  27  11.256 -12.042   3.140
  292   1H4     C  27          1H4         C  27   5.055 -12.034   4.259
  293   2H4     C  27          2H4         C  27   4.533 -12.255   2.705
  294    H5     C  27           H5         C  27   6.417 -12.720   0.906
  295    H6     C  27           H6         C  27   8.823 -12.893   0.563
  296   1H5*    G  28          1H5*        G  28  12.920 -16.182   3.025
  297   2H5*    G  28          2H5*        G  28  13.241 -17.922   2.886
  298    H4*    G  28           H4*        G  28  12.966 -17.522   5.170
  299    H3*    G  28           H3*        G  28  10.501 -18.762   3.986
  300    H2*    G  28           H2*        G  28   9.427 -18.645   6.124
  301   2HO*    G  28          2HO*        G  28  10.816 -19.167   7.678
  302    H1*    G  28           H1*        G  28  10.426 -16.105   6.817
  303    H8     G  28           H8         G  28   9.320 -16.209   3.214
  304    H1     G  28           H1         G  28   4.654 -14.971   7.442
  305   1H2     G  28          1H2         G  28   5.334 -15.356   9.463
  306   2H2     G  28          2H2         G  28   6.958 -15.913   9.810
  307   1H5*    C  29          1H5*        C  29  11.263 -20.900   7.518
  308   2H5*    C  29          2H5*        C  29  11.498 -22.607   7.094
  309    H4*    C  29           H4*        C  29  10.045 -22.691   8.883
  310    H3*    C  29           H3*        C  29   8.566 -22.987   6.300
  311    H2*    C  29           H2*        C  29   6.470 -23.034   7.462
  312   2HO*    C  29          2HO*        C  29   7.973 -24.112   9.358
  313    H1*    C  29           H1*        C  29   7.078 -21.014   9.315
  314   1H4     C  29          1H4         C  29   4.077 -17.708   4.908
  315   2H4     C  29          2H4         C  29   5.330 -17.518   3.855
  316    H5     C  29           H5         C  29   7.570 -18.822   4.484
  317    H6     C  29           H6         C  29   8.570 -20.357   6.097
  318   1H5*    C  30          1H5*        C  30   6.867 -25.874   8.692
  319   2H5*    C  30          2H5*        C  30   7.243 -27.473   8.020
  320    H4*    C  30           H4*        C  30   4.971 -27.566   8.489
  321    H3*    C  30           H3*        C  30   5.469 -27.085   5.574
  322    H2*    C  30           H2*        C  30   3.141 -26.903   5.156
  323   2HO*    C  30          2HO*        C  30   1.604 -27.640   6.639
  324    H1*    C  30           H1*        C  30   2.482 -25.477   7.497
  325   1H4     C  30          1H4         C  30   2.867 -21.135   2.971
  326   2H4     C  30          2H4         C  30   4.483 -21.250   2.637
  327    H5     C  30           H5         C  30   5.796 -23.154   3.948
  328    H6     C  30           H6         C  30   5.598 -24.862   5.659
  329    H3T    C  30           H3T        C  30   4.143 -29.226   6.709
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  -4.786 -21.215   5.239
    2   2H5*    G   1          2H5*        G   1  -5.696 -19.696   5.149
    3    H4*    G   1           H4*        G   1  -5.607 -20.178   7.410
    4    H3*    G   1           H3*        G   1  -3.593 -18.088   6.685
    5    H2*    G   1           H2*        G   1  -2.787 -18.047   8.951
    6   2HO*    G   1          2HO*        G   1  -4.121 -18.544  10.520
    7    H1*    G   1           H1*        G   1  -2.644 -20.798   9.257
    8    H8     G   1           H8         G   1  -1.953 -19.468   5.733
    9    H1     G   1           H1         G   1   3.161 -20.305   9.495
   10   1H2     G   1          1H2         G   1   2.714 -20.767  11.293
   11   2H2     G   1          2H2         G   1   1.246 -20.973  12.087
   12    H5T    G   1           H5T        G   1  -3.683 -18.597   5.001
   13   1H5*    G   2          1H5*        G   2  -5.152 -17.161  10.144
   14   2H5*    G   2          2H5*        G   2  -5.835 -15.528  10.262
   15    H4*    G   2           H4*        G   2  -4.450 -15.742  12.122
   16    H3*    G   2           H3*        G   2  -3.088 -14.141   9.975
   17    H2*    G   2           H2*        G   2  -1.166 -13.924  11.422
   18   2HO*    G   2          2HO*        G   2  -2.980 -14.171  13.311
   19    H1*    G   2           H1*        G   2  -1.103 -16.606  12.167
   20    H8     G   2           H8         G   2  -2.253 -16.048   8.586
   21    H1     G   2           H1         G   2   4.085 -16.514   9.397
   22   1H2     G   2          1H2         G   2   4.613 -16.533  11.230
   23   2H2     G   2          2H2         G   2   3.751 -16.461  12.672
   24   1H5*    U   3          1H5*        U   3  -2.376 -12.281  13.452
   25   2H5*    U   3          2H5*        U   3  -2.636 -10.527  13.377
   26    H4*    U   3           H4*        U   3  -0.454 -10.900  14.217
   27    H3*    U   3           H3*        U   3  -0.486  -9.845  11.414
   28    H2*    U   3           H2*        U   3   1.914  -9.989  11.314
   29   2HO*    U   3          2HO*        U   3   1.626  -9.816  14.004
   30    H1*    U   3           H1*        U   3   2.096 -12.527  12.437
   31    H3     U   3           H3         U   3   2.831 -13.251   8.016
   32    H5     U   3           H5         U   3  -1.320 -12.932   8.358
   33    H6     U   3           H6         U   3  -1.014 -12.210  10.631
   34   1H5*    G   4          1H5*        G   4   2.470  -8.276  13.324
   35   2H5*    G   4          2H5*        G   4   2.591  -6.507  13.279
   36    H4*    G   4           H4*        G   4   4.710  -7.395  12.707
   37    H3*    G   4           H3*        G   4   3.273  -6.177  10.373
   38    H2*    G   4           H2*        G   4   5.045  -6.855   8.913
   39   2HO*    G   4          2HO*        G   4   6.823  -6.264  10.117
   40    H1*    G   4           H1*        G   4   5.558  -9.334  10.161
   41    H8     G   4           H8         G   4   1.862  -8.906   9.721
   42    H1     G   4           H1         G   4   5.012 -11.177   4.624
   43   1H2     G   4          1H2         G   4   6.906 -10.956   4.750
   44   2H2     G   4          2H2         G   4   7.893 -10.303   5.948
   45   1H5*    C   5          1H5*        C   5   4.982  -3.555   7.710
   46   2H5*    C   5          2H5*        C   5   4.750  -5.223   8.263
   47    H4*    C   5           H4*        C   5   7.555  -4.482   8.114
   48    H3*    C   5           H3*        C   5   5.897  -3.793   5.766
   49    H2*    C   5           H2*        C   5   7.095  -5.148   4.258
   50   2HO*    C   5          2HO*        C   5   9.131  -4.503   5.930
   51    H1*    C   5           H1*        C   5   7.737  -7.295   5.929
   52   1H4     C   5          1H4         C   5   2.700  -9.316   2.719
   53   2H4     C   5          2H4         C   5   1.573  -8.850   3.835
   54    H5     C   5           H5         C   5   2.509  -7.452   5.910
   55    H6     C   5           H6         C   5   4.489  -6.314   6.769
   56   1H5*    G   6          1H5*        G   6   8.607  -1.918   2.082
   57   2H5*    G   6          2H5*        G   6   6.892  -1.690   2.476
   58    H4*    G   6           H4*        G   6   8.243  -3.834   0.983
   59    H3*    G   6           H3*        G   6   5.599  -2.429   0.832
   60    H2*    G   6           H2*        G   6   4.627  -4.374  -0.209
   61   2HO*    G   6          2HO*        G   6   6.899  -4.717  -1.273
   62    H1*    G   6           H1*        G   6   5.734  -6.226   1.535
   63    H8     G   6           H8         G   6   5.149  -3.339   3.680
   64    H1     G   6           H1         G   6  -0.318  -6.324   2.174
   65   1H2     G   6          1H2         G   6  -0.024  -7.609   0.432
   66   2H2     G   6          2H2         G   6   1.532  -7.780  -0.337
   67   1H5*    A   7          1H5*        A   7   9.131  -2.484  -1.671
   68   2H5*    A   7          2H5*        A   7   9.788  -1.397  -2.910
   69    H4*    A   7           H4*        A   7   9.099  -3.151  -4.192
   70    H3*    A   7           H3*        A   7   6.745  -1.266  -4.108
   71    H2*    A   7           H2*        A   7   5.563  -2.815  -5.488
   72   2HO*    A   7          2HO*        A   7   7.928  -3.204  -6.531
   73    H1*    A   7           H1*        A   7   6.726  -5.148  -4.290
   74    H8     A   7           H8         A   7   5.267  -2.951  -1.615
   75   1H6     A   7          1H6         A   7  -0.147  -5.684  -2.897
   76   2H6     A   7          2H6         A   7   0.683  -4.631  -1.773
   77    H2     A   7           H2         A   7   2.752  -6.803  -6.099
   78   1H5*    A   8          1H5*        A   8   5.308   1.005  -7.503
   79   2H5*    A   8          2H5*        A   8   4.132   0.857  -6.184
   80    H4*    A   8           H4*        A   8   5.008  -1.187  -8.190
   81    H3*    A   8           H3*        A   8   2.397   0.067  -7.462
   82    H2*    A   8           H2*        A   8   1.236  -2.007  -7.787
   83   2HO*    A   8          2HO*        A   8   3.137  -2.406  -9.547
   84    H1*    A   8           H1*        A   8   3.087  -3.630  -6.490
   85    H8     A   8           H8         A   8   3.552  -1.357  -4.003
   86   1H6     A   8          1H6         A   8  -2.379  -1.655  -2.261
   87   2H6     A   8          2H6         A   8  -0.868  -1.112  -1.626
   88    H2     A   8           H2         A   8  -2.126  -3.280  -6.292
   89   1H5*    G   9          1H5*        G   9   0.966  -1.024 -10.943
   90   2H5*    G   9          2H5*        G   9   0.204   0.325 -11.808
   91    H4*    G   9           H4*        G   9  -1.470  -1.282 -11.259
   92    H3*    G   9           H3*        G   9  -1.657   1.263  -9.672
   93    H2*    G   9           H2*        G   9  -3.634   0.368  -8.592
   94   2HO*    G   9          2HO*        G   9  -3.957  -2.042  -9.388
   95    H1*    G   9           H1*        G   9  -2.488  -2.093  -8.034
   96    H8     G   9           H8         G   9   0.514  -0.245  -7.611
   97    H1     G   9           H1         G   9  -3.725   1.312  -3.081
   98   1H2     G   9          1H2         G   9  -5.524   0.821  -3.508
   99   2H2     G   9          2H2         G   9  -6.209   0.039  -4.827
  100   1H5*    G  10          1H5*        G  10  -4.853   0.677 -11.459
  101   2H5*    G  10          2H5*        G  10  -5.918   1.634 -12.506
  102    H4*    G  10           H4*        G  10  -7.314   1.266 -10.759
  103    H3*    G  10           H3*        G  10  -5.870   3.813 -10.047
  104    H2*    G  10           H2*        G  10  -7.207   3.866  -8.024
  105   2HO*    G  10          2HO*        G  10  -9.183   3.102  -8.589
  106    H1*    G  10           H1*        G  10  -6.729   1.197  -7.401
  107    H8     G  10           H8         G  10  -3.537   2.075  -8.876
  108    H1     G  10           H1         G  10  -4.365   4.869  -3.186
  109   1H2     G  10          1H2         G  10  -6.190   4.874  -2.595
  110   2H2     G  10          2H2         G  10  -7.602   4.251  -3.259
  111   1H5*    G  11          1H5*        G  11  -9.994   4.479  -9.654
  112   2H5*    G  11          2H5*        G  11 -10.471   6.024 -10.385
  113    H4*    G  11           H4*        G  11 -11.373   5.909  -8.182
  114    H3*    G  11           H3*        G  11  -9.141   7.896  -8.456
  115    H2*    G  11           H2*        G  11  -9.289   8.371  -6.103
  116   2HO*    G  11          2HO*        G  11 -11.799   7.513  -6.476
  117    H1*    G  11           H1*        G  11  -9.398   5.744  -5.285
  118    H8     G  11           H8         G  11  -7.155   5.549  -8.206
  119    H1     G  11           H1         G  11  -4.453   8.277  -3.094
  120   1H2     G  11          1H2         G  11  -5.745   8.856  -1.776
  121   2H2     G  11          2H2         G  11  -7.424   8.725  -1.721
  122   1H5*    C  12          1H5*        C  12 -12.222   9.632  -6.219
  123   2H5*    C  12          2H5*        C  12 -12.576  11.286  -6.753
  124    H4*    C  12           H4*        C  12 -12.309  11.278  -4.379
  125    H3*    C  12           H3*        C  12 -10.007  12.643  -5.766
  126    H2*    C  12           H2*        C  12  -9.016  13.002  -3.577
  127   2HO*    C  12          2HO*        C  12 -10.446  11.872  -1.814
  128    H1*    C  12           H1*        C  12  -9.368  10.419  -2.718
  129   1H4     C  12          1H4         C  12  -3.780  10.767  -5.735
  130   2H4     C  12          2H4         C  12  -4.325  10.114  -7.146
  131    H5     C  12           H5         C  12  -6.934   9.702  -7.335
  132    H6     C  12           H6         C  12  -9.064   9.989  -6.183
  133   1H5*    G  13          1H5*        G  13  -8.709  14.260  -4.623
  134   2H5*    G  13          2H5*        G  13  -9.186  14.733  -2.986
  135    H4*    G  13           H4*        G  13  -7.924  16.637  -3.001
  136    H3*    G  13           H3*        G  13  -8.362  16.899  -5.865
  137    H2*    G  13           H2*        G  13  -6.110  17.126  -6.561
  138   2HO*    G  13          2HO*        G  13  -4.935  17.401  -4.077
  139    H1*    G  13           H1*        G  13  -4.763  15.496  -4.775
  140    H8     G  13           H8         G  13  -8.212  14.720  -6.138
  141    H1     G  13           H1         G  13  -3.408  11.571  -8.968
  142   1H2     G  13          1H2         G  13  -1.487  12.263  -8.192
  143   2H2     G  13          2H2         G  13  -1.375  13.484  -6.954
  144   1H5*    U  14          1H5*        U  14 -10.281  21.885  -3.108
  145   2H5*    U  14          2H5*        U  14  -9.513  21.798  -4.703
  146    H4*    U  14           H4*        U  14  -8.291  22.909  -2.721
  147    H3*    U  14           H3*        U  14  -7.279  21.903  -5.069
  148    H2*    U  14           H2*        U  14  -6.377  19.858  -4.218
  149   2HO*    U  14          2HO*        U  14  -4.557  21.498  -4.570
  150    H1*    U  14           H1*        U  14  -5.824  21.268  -1.555
  151    H3     U  14           H3         U  14  -5.641  17.792   1.237
  152    H5     U  14           H5         U  14  -5.969  16.021  -2.549
  153    H6     U  14           H6         U  14  -6.494  18.171  -3.448
  154   1H5*    C  15          1H5*        C  15  -2.703  24.132  -6.208
  155   2H5*    C  15          2H5*        C  15  -3.495  22.713  -6.921
  156    H4*    C  15           H4*        C  15  -1.119  22.887  -5.133
  157    H3*    C  15           H3*        C  15  -1.760  21.336  -7.645
  158    H2*    C  15           H2*        C  15  -0.073  19.757  -6.983
  159   2HO*    C  15          2HO*        C  15   0.857  21.831  -5.597
  160    H1*    C  15           H1*        C  15  -1.081  19.475  -4.427
  161   1H4     C  15          1H4         C  15  -5.329  16.748  -8.687
  162   2H4     C  15          2H4         C  15  -4.436  15.406  -8.003
  163    H5     C  15           H5         C  15  -2.643  15.733  -6.381
  164    H6     C  15           H6         C  15  -1.277  17.360  -5.259
  165   1H5*    G  16          1H5*        G  16   1.271  24.518 -10.126
  166   2H5*    G  16          2H5*        G  16   0.847  23.679 -11.630
  167    H4*    G  16           H4*        G  16   2.446  22.208 -11.313
  168    H3*    G  16           H3*        G  16   0.999  21.571  -8.770
  169    H2*    G  16           H2*        G  16   2.942  20.450  -7.912
  170   2HO*    G  16          2HO*        G  16   3.413  20.095 -10.522
  171    H1*    G  16           H1*        G  16   4.791  22.374  -8.723
  172    H8     G  16           H8         G  16   2.529  21.266  -6.238
  173    H1     G  16           H1         G  16   3.926  27.451  -5.295
  174   1H2     G  16          1H2         G  16   4.855  28.308  -7.103
  175   2H2     G  16          2H2         G  16   5.120  27.344  -8.541
  176   1H5*    U  17          1H5*        U  17   0.365  17.002  -8.804
  177   2H5*    U  17          2H5*        U  17  -0.745  17.484  -7.516
  178    H4*    U  17           H4*        U  17   2.101  18.027  -7.038
  179    H3*    U  17           H3*        U  17   1.627  15.583  -8.063
  180    H2*    U  17           H2*        U  17   0.315  14.610  -6.461
  181   2HO*    U  17          2HO*        U  17   2.621  14.576  -4.810
  182    H1*    U  17           H1*        U  17   1.597  16.196  -4.197
  183    H3     U  17           H3         U  17  -2.220  16.897  -1.771
  184    H5     U  17           H5         U  17  -3.217  13.978  -4.604
  185    H6     U  17           H6         U  17  -1.019  14.254  -5.533
  186   1H5*    C  18          1H5*        C  18   1.934  17.990  -4.421
  187   2H5*    C  18          2H5*        C  18   2.736  19.562  -4.548
  188    H4*    C  18           H4*        C  18   4.736  17.872  -3.656
  189    H3*    C  18           H3*        C  18   2.819  16.226  -2.996
  190    H2*    C  18           H2*        C  18   1.217  17.724  -2.109
  191   2HO*    C  18          2HO*        C  18   1.251  16.823  -0.186
  192    H1*    C  18           H1*        C  18   3.143  19.420  -0.528
  193   1H4     C  18          1H4         C  18  -0.787  23.929  -2.940
  194   2H4     C  18          2H4         C  18  -2.076  22.760  -2.728
  195    H5     C  18           H5         C  18  -1.659  20.449  -2.104
  196    H6     C  18           H6         C  18   0.055  18.847  -1.505
  197   1H5*    G  19          1H5*        G  19   3.120  16.209   0.016
  198   2H5*    G  19          2H5*        G  19   3.343  15.191   1.446
  199    H4*    G  19           H4*        G  19   1.010  15.519   0.969
  200    H3*    G  19           H3*        G  19   1.980  12.722   0.752
  201    H2*    G  19           H2*        G  19   0.165  12.016  -0.485
  202   2HO*    G  19          2HO*        G  19  -1.955  13.180   0.064
  203    H1*    G  19           H1*        G  19  -0.917  14.783  -0.988
  204    H8     G  19           H8         G  19   1.759  13.554  -3.274
  205    H1     G  19           H1         G  19  -4.084  11.208  -4.450
  206   1H2     G  19          1H2         G  19  -5.340  11.628  -3.036
  207   2H2     G  19          2H2         G  19  -5.142  12.456  -1.573
  208   1H5*    C  20          1H5*        C  20  -1.576  13.403   3.281
  209   2H5*    C  20          2H5*        C  20  -1.508  12.341   4.696
  210    H4*    C  20           H4*        C  20  -3.711  12.279   3.996
  211    H3*    C  20           H3*        C  20  -2.461   9.764   2.882
  212    H2*    C  20           H2*        C  20  -4.708   9.225   2.139
  213   2HO*    C  20          2HO*        C  20  -5.706  11.646   3.174
  214    H1*    C  20           H1*        C  20  -5.175  11.807   1.139
  215   1H4     C  20          1H4         C  20  -3.233   8.467  -3.800
  216   2H4     C  20          2H4         C  20  -1.602   8.700  -3.619
  217    H5     C  20           H5         C  20  -0.873   9.972  -1.393
  218    H6     C  20           H6         C  20  -1.720  11.052   0.629
  219   1H5*    C  21          1H5*        C  21  -5.925   9.043   4.349
  220   2H5*    C  21          2H5*        C  21  -6.076   7.614   5.387
  221    H4*    C  21           H4*        C  21  -7.810   7.555   3.759
  222    H3*    C  21           H3*        C  21  -5.694   5.484   3.177
  223    H2*    C  21           H2*        C  21  -7.060   4.773   1.323
  224   2HO*    C  21          2HO*        C  21  -9.176   5.160   1.265
  225    H1*    C  21           H1*        C  21  -7.716   7.397   0.508
  226   1H4     C  21          1H4         C  21  -3.069   5.458  -3.262
  227   2H4     C  21          2H4         C  21  -1.815   6.131  -2.408
  228    H5     C  21           H5         C  21  -2.477   7.203  -0.068
  229    H6     C  21           H6         C  21  -4.340   7.624   1.449
  230   1H5*    C  22          1H5*        C  22  -9.104   4.093   2.606
  231   2H5*    C  22          2H5*        C  22  -9.685   2.817   3.691
  232    H4*    C  22           H4*        C  22 -10.447   2.053   1.687
  233    H3*    C  22           H3*        C  22  -7.770   0.793   2.163
  234    H2*    C  22           H2*        C  22  -7.829  -0.224   0.017
  235   2HO*    C  22          2HO*        C  22  -9.677  -0.728  -0.944
  236    H1*    C  22           H1*        C  22  -8.964   1.946  -1.365
  237   1H4     C  22          1H4         C  22  -2.771   2.147  -2.430
  238   2H4     C  22          2H4         C  22  -2.303   2.812  -0.982
  239    H5     C  22           H5         C  22  -4.235   3.122   0.808
  240    H6     C  22           H6         C  22  -6.617   2.895   1.192
  241   1H5*    C  23          1H5*        C  23  -9.848  -1.994   0.369
  242   2H5*    C  23          2H5*        C  23  -9.494  -3.630   0.957
  243    H4*    C  23           H4*        C  23  -8.891  -3.315  -1.396
  244    H3*    C  23           H3*        C  23  -6.707  -4.006   0.549
  245    H2*    C  23           H2*        C  23  -5.132  -3.987  -1.270
  246   2HO*    C  23          2HO*        C  23  -5.771  -4.055  -3.373
  247    H1*    C  23           H1*        C  23  -6.131  -1.661  -2.474
  248   1H4     C  23          1H4         C  23  -1.295   0.198   1.206
  249   2H4     C  23          2H4         C  23  -2.428   0.523   2.503
  250    H5     C  23           H5         C  23  -4.770  -0.066   2.381
  251    H6     C  23           H6         C  23  -6.501  -1.079   0.994
  252   1H5*    G  24          1H5*        G  24  -6.127  -5.918  -2.703
  253   2H5*    G  24          2H5*        G  24  -5.895  -7.674  -2.599
  254    H4*    G  24           H4*        G  24  -4.158  -6.553  -3.907
  255    H3*    G  24           H3*        G  24  -3.667  -8.625  -2.282
  256    H2*    G  24           H2*        G  24  -3.041  -7.422  -0.298
  257   2HO*    G  24          2HO*        G  24  -0.902  -7.992  -1.969
  258    H1*    G  24           H1*        G  24  -1.516  -5.371  -1.973
  259    H8     G  24           H8         G  24  -4.538  -5.176   0.423
  260    H1     G  24           H1         G  24   0.747  -2.029   2.243
  261   1H2     G  24          1H2         G  24   2.379  -2.381   0.808
  262   2H2     G  24          2H2         G  24   2.161  -3.409  -0.588
  263   1H5*    A  25          1H5*        A  25  -2.024 -11.259  -6.001
  264   2H5*    A  25          2H5*        A  25  -1.364 -12.273  -4.706
  265    H4*    A  25           H4*        A  25   0.040 -11.303  -6.828
  266    H3*    A  25           H3*        A  25   0.998 -12.268  -4.145
  267    H2*    A  25           H2*        A  25   3.215 -11.570  -4.735
  268   2HO*    A  25          2HO*        A  25   2.687 -12.406  -7.037
  269    H1*    A  25           H1*        A  25   2.389  -9.226  -6.137
  270    H8     A  25           H8         A  25   0.541  -9.050  -2.979
  271   1H6     A  25          1H6         A  25   5.634  -6.679  -0.413
  272   2H6     A  25          2H6         A  25   3.912  -6.945  -0.207
  273    H2     A  25           H2         A  25   6.813  -8.605  -4.260
  274   1H5*    G  26          1H5*        G  26   4.665 -15.830  -4.607
  275   2H5*    G  26          2H5*        G  26   3.707 -15.019  -3.352
  276    H4*    G  26           H4*        G  26   6.097 -14.049  -4.859
  277    H3*    G  26           H3*        G  26   5.409 -14.357  -1.969
  278    H2*    G  26           H2*        G  26   6.567 -12.325  -1.412
  279   2HO*    G  26          2HO*        G  26   8.081 -13.015  -3.401
  280    H1*    G  26           H1*        G  26   5.611 -10.806  -3.523
  281    H8     G  26           H8         G  26   2.540 -12.459  -3.081
  282    H1     G  26           H1         G  26   3.928  -8.984   2.098
  283   1H2     G  26          1H2         G  26   5.789  -8.553   2.248
  284   2H2     G  26          2H2         G  26   7.126  -8.863   1.275
  285   1H5*    C  27          1H5*        C  27   9.429 -14.280  -2.006
  286   2H5*    C  27          2H5*        C  27  10.342 -15.647  -1.335
  287    H4*    C  27           H4*        C  27  11.188 -13.780  -0.231
  288    H3*    C  27           H3*        C  27   9.216 -15.239   1.503
  289    H2*    C  27           H2*        C  27   9.481 -13.593   3.199
  290   2HO*    C  27          2HO*        C  27  11.945 -13.490   2.227
  291    H1*    C  27           H1*        C  27   9.653 -11.366   1.472
  292   1H4     C  27          1H4         C  27   3.847 -11.644   3.996
  293   2H4     C  27          2H4         C  27   3.133 -12.406   2.717
  294    H5     C  27           H5         C  27   4.795 -13.261   0.818
  295    H6     C  27           H6         C  27   7.115 -13.298   0.092
  296   1H5*    G  28          1H5*        G  28  12.349 -14.184   3.845
  297   2H5*    G  28          2H5*        G  28  13.151 -15.617   4.516
  298    H4*    G  28           H4*        G  28  12.981 -14.147   6.305
  299    H3*    G  28           H3*        G  28  10.832 -16.238   6.463
  300    H2*    G  28           H2*        G  28   9.994 -15.199   8.456
  301   2HO*    G  28          2HO*        G  28  11.472 -14.375   9.744
  302    H1*    G  28           H1*        G  28  10.294 -12.558   7.555
  303    H8     G  28           H8         G  28   8.988 -14.516   4.685
  304    H1     G  28           H1         G  28   4.503 -12.904   8.967
  305   1H2     G  28          1H2         G  28   5.408 -12.223  10.808
  306   2H2     G  28          2H2         G  28   7.143 -12.142  11.025
  307   1H5*    C  29          1H5*        C  29  12.370 -15.993  10.299
  308   2H5*    C  29          2H5*        C  29  13.026 -17.577  10.758
  309    H4*    C  29           H4*        C  29  11.764 -16.939  12.590
  310    H3*    C  29           H3*        C  29  10.266 -18.899  10.894
  311    H2*    C  29           H2*        C  29   8.350 -18.713  12.326
  312   2HO*    C  29          2HO*        C  29  10.241 -18.197  14.126
  313    H1*    C  29           H1*        C  29   8.493 -15.932  12.694
  314   1H4     C  29          1H4         C  29   4.347 -16.423   8.006
  315   2H4     C  29          2H4         C  29   5.421 -16.456   6.748
  316    H5     C  29           H5         C  29   7.997 -16.558   7.449
  317    H6     C  29           H6         C  29   9.513 -16.724   9.356
  318   1H5*    C  30          1H5*        C  30   9.586 -20.231  14.721
  319   2H5*    C  30          2H5*        C  30  10.344 -21.823  14.925
  320    H4*    C  30           H4*        C  30   8.221 -22.078  15.832
  321    H3*    C  30           H3*        C  30   8.371 -23.215  13.063
  322    H2*    C  30           H2*        C  30   6.061 -23.758  13.112
  323   2HO*    C  30          2HO*        C  30   6.507 -24.242  15.612
  324    H1*    C  30           H1*        C  30   5.193 -21.433  14.451
  325   1H4     C  30          1H4         C  30   4.020 -20.371   8.373
  326   2H4     C  30          2H4         C  30   5.575 -20.322   7.807
  327    H5     C  30           H5         C  30   7.461 -20.874   9.603
  328    H6     C  30           H6         C  30   7.871 -21.346  11.946
  329    H3T    C  30           H3T        C  30   9.398 -24.197  14.802
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -5.230 -12.622  -1.058
    2   2H5*    G   1          2H5*        G   1  -5.736 -11.477   0.198
    3    H4*    G   1           H4*        G   1  -5.958 -13.559   1.192
    4    H3*    G   1           H3*        G   1  -3.438 -12.213   2.093
    5    H2*    G   1           H2*        G   1  -2.843 -14.142   3.384
    6   2HO*    G   1          2HO*        G   1  -4.493 -15.940   3.379
    7    H1*    G   1           H1*        G   1  -3.612 -16.046   1.472
    8    H8     G   1           H8         G   1  -2.028 -13.274  -0.418
    9    H1     G   1           H1         G   1   2.140 -17.214   2.430
   10   1H2     G   1          1H2         G   1   1.334 -18.387   3.692
   11   2H2     G   1          2H2         G   1  -0.252 -18.584   4.222
   12    H5T    G   1           H5T        G   1  -3.632 -10.930   0.562
   13   1H5*    G   2          1H5*        G   2  -4.827 -13.963   5.344
   14   2H5*    G   2          2H5*        G   2  -5.249 -12.780   6.599
   15    H4*    G   2           H4*        G   2  -4.009 -14.388   7.718
   16    H3*    G   2           H3*        G   2  -2.257 -12.028   7.072
   17    H2*    G   2           H2*        G   2  -0.442 -13.152   8.187
   18   2HO*    G   2          2HO*        G   2  -2.471 -14.264   9.523
   19    H1*    G   2           H1*        G   2  -0.994 -15.677   7.080
   20    H8     G   2           H8         G   2  -1.451 -12.847   4.598
   21    H1     G   2           H1         G   2   4.488 -15.196   5.079
   22   1H2     G   2          1H2         G   2   4.704 -16.391   6.561
   23   2H2     G   2          2H2         G   2   3.637 -16.943   7.742
   24   1H5*    U   3          1H5*        U   3  -1.439 -12.983  10.798
   25   2H5*    U   3          2H5*        U   3  -1.579 -11.630  11.938
   26    H4*    U   3           H4*        U   3   0.524 -12.523  12.346
   27    H3*    U   3           H3*        U   3   0.722 -10.049  10.673
   28    H2*    U   3           H2*        U   3   3.098 -10.324  10.506
   29   2HO*    U   3          2HO*        U   3   4.073 -11.178  12.174
   30    H1*    U   3           H1*        U   3   3.050 -13.057   9.983
   31    H3     U   3           H3         U   3   3.909 -11.571   5.829
   32    H5     U   3           H5         U   3  -0.080 -10.455   6.478
   33    H6     U   3           H6         U   3   0.164 -11.176   8.759
   34   1H5*    G   4          1H5*        G   4   3.682  -9.939  13.457
   35   2H5*    G   4          2H5*        G   4   3.797  -8.367  14.271
   36    H4*    G   4           H4*        G   4   5.952  -8.869  13.483
   37    H3*    G   4           H3*        G   4   4.624  -6.778  11.782
   38    H2*    G   4           H2*        G   4   6.538  -6.747  10.344
   39   2HO*    G   4          2HO*        G   4   7.839  -7.101  12.520
   40    H1*    G   4           H1*        G   4   7.052  -9.535  10.485
   41    H8     G   4           H8         G   4   3.414  -8.672   9.873
   42    H1     G   4           H1         G   4   7.082  -9.299   4.670
   43   1H2     G   4          1H2         G   4   8.941  -9.364   5.056
   44   2H2     G   4          2H2         G   4   9.815  -9.260   6.492
   45   1H5*    C   5          1H5*        C   5   6.635  -2.572  11.288
   46   2H5*    C   5          2H5*        C   5   5.883  -3.940  10.449
   47    H4*    C   5           H4*        C   5   8.855  -3.437  10.578
   48    H3*    C   5           H3*        C   5   6.849  -2.356   8.669
   49    H2*    C   5           H2*        C   5   8.060  -3.057   6.765
   50   2HO*    C   5          2HO*        C   5  10.149  -2.681   8.464
   51    H1*    C   5           H1*        C   5   9.049  -5.490   7.737
   52   1H4     C   5          1H4         C   5   3.982  -6.833   4.209
   53   2H4     C   5          2H4         C   5   2.882  -6.828   5.447
   54    H5     C   5           H5         C   5   3.814  -6.050   7.808
   55    H6     C   5           H6         C   5   5.776  -5.140   8.942
   56   1H5*    G   6          1H5*        G   6   9.980  -1.478   6.343
   57   2H5*    G   6          2H5*        G   6   9.674   0.166   5.747
   58    H4*    G   6           H4*        G   6   9.583  -1.506   3.965
   59    H3*    G   6           H3*        G   6   7.131   0.096   4.590
   60    H2*    G   6           H2*        G   6   5.857  -1.104   2.970
   61   2HO*    G   6          2HO*        G   6   7.802  -1.216   1.487
   62    H1*    G   6           H1*        G   6   6.761  -3.629   3.669
   63    H8     G   6           H8         G   6   6.575  -1.431   6.692
   64    H1     G   6           H1         G   6   0.958  -4.024   5.049
   65   1H2     G   6          1H2         G   6   1.068  -4.834   2.991
   66   2H2     G   6          2H2         G   6   2.559  -4.787   2.085
   67   1H5*    A   7          1H5*        A   7   9.023   3.012   0.417
   68   2H5*    A   7          2H5*        A   7   8.003   2.101   1.548
   69    H4*    A   7           H4*        A   7   9.001   1.013  -1.080
   70    H3*    A   7           H3*        A   7   6.431   2.483  -0.518
   71    H2*    A   7           H2*        A   7   5.310   0.965  -1.975
   72   2HO*    A   7          2HO*        A   7   6.707   0.912  -3.708
   73    H1*    A   7           H1*        A   7   6.858  -1.319  -1.227
   74    H8     A   7           H8         A   7   5.605   0.355   1.864
   75   1H6     A   7          1H6         A   7   0.279  -2.679   0.961
   76   2H6     A   7          2H6         A   7   1.217  -1.708   2.071
   77    H2     A   7           H2         A   7   2.766  -3.095  -2.745
   78   1H5*    A   8          1H5*        A   8   4.018   3.605  -4.432
   79   2H5*    A   8          2H5*        A   8   3.952   2.839  -2.832
   80    H4*    A   8           H4*        A   8   4.424   1.185  -5.278
   81    H3*    A   8           H3*        A   8   1.787   2.393  -4.536
   82    H2*    A   8           H2*        A   8   0.692   0.278  -4.861
   83   2HO*    A   8          2HO*        A   8   1.612  -1.344  -6.005
   84    H1*    A   8           H1*        A   8   2.627  -1.271  -3.589
   85    H8     A   8           H8         A   8   2.891   1.252  -1.184
   86   1H6     A   8          1H6         A   8  -2.771  -0.108   0.932
   87   2H6     A   8          2H6         A   8  -1.363   0.740   1.447
   88    H2     A   8           H2         A   8  -2.417  -1.840  -3.053
   89   1H5*    G   9          1H5*        G   9   0.421  -0.047  -7.213
   90   2H5*    G   9          2H5*        G   9  -0.320   0.908  -8.512
   91    H4*    G   9           H4*        G   9  -1.962  -0.606  -7.800
   92    H3*    G   9           H3*        G   9  -2.459   2.176  -6.806
   93    H2*    G   9           H2*        G   9  -4.404   1.408  -5.616
   94   2HO*    G   9          2HO*        G   9  -5.484  -0.239  -6.403
   95    H1*    G   9           H1*        G   9  -3.224  -0.837  -4.527
   96    H8     G   9           H8         G   9  -0.491   1.634  -4.635
   97    H1     G   9           H1         G   9  -4.629   2.676   0.126
   98   1H2     G   9          1H2         G   9  -6.285   1.733  -0.073
   99   2H2     G   9          2H2         G   9  -6.863   0.677  -1.241
  100   1H5*    G  10          1H5*        G  10  -5.494   0.778  -7.854
  101   2H5*    G  10          2H5*        G  10  -6.403   0.624  -9.369
  102    H4*    G  10           H4*        G  10  -8.253   1.027  -8.254
  103    H3*    G  10           H3*        G  10  -7.045   3.754  -7.892
  104    H2*    G  10           H2*        G  10  -8.777   4.255  -6.293
  105   2HO*    G  10          2HO*        G  10 -10.157   2.567  -7.737
  106    H1*    G  10           H1*        G  10  -8.608   1.837  -4.941
  107    H8     G  10           H8         G  10  -5.165   2.821  -6.010
  108    H1     G  10           H1         G  10  -7.144   5.665  -0.632
  109   1H2     G  10          1H2         G  10  -9.014   5.462  -0.305
  110   2H2     G  10          2H2         G  10 -10.247   4.694  -1.147
  111   1H5*    G  11          1H5*        G  11 -11.159   4.499  -9.108
  112   2H5*    G  11          2H5*        G  11 -11.137   5.617 -10.487
  113    H4*    G  11           H4*        G  11 -12.687   6.537  -9.031
  114    H3*    G  11           H3*        G  11 -10.067   7.952  -8.858
  115    H2*    G  11           H2*        G  11 -10.842   9.306  -7.035
  116   2HO*    G  11          2HO*        G  11 -13.213   8.797  -8.162
  117    H1*    G  11           H1*        G  11 -11.990   7.261  -5.586
  118    H8     G  11           H8         G  11  -9.117   5.707  -7.368
  119    H1     G  11           H1         G  11  -7.436   8.917  -2.111
  120   1H2     G  11          1H2         G  11  -8.869   9.985  -1.381
  121   2H2     G  11          2H2         G  11 -10.455  10.259  -1.866
  122   1H5*    C  12          1H5*        C  12 -12.723  10.947  -8.598
  123   2H5*    C  12          2H5*        C  12 -12.389  12.247  -9.758
  124    H4*    C  12           H4*        C  12 -12.556  13.225  -7.613
  125    H3*    C  12           H3*        C  12  -9.727  13.153  -8.616
  126    H2*    C  12           H2*        C  12  -8.980  14.109  -6.540
  127   2HO*    C  12          2HO*        C  12 -11.434  15.159  -6.593
  128    H1*    C  12           H1*        C  12 -10.645  12.577  -4.889
  129   1H4     C  12          1H4         C  12  -5.109   9.444  -4.810
  130   2H4     C  12          2H4         C  12  -5.511   8.439  -6.050
  131    H5     C  12           H5         C  12  -7.733   8.921  -7.372
  132    H6     C  12           H6         C  12  -9.663  10.407  -7.531
  133   1H5*    G  13          1H5*        G  13  -8.047  15.051  -7.676
  134   2H5*    G  13          2H5*        G  13  -8.111  16.544  -6.738
  135    H4*    G  13           H4*        G  13  -6.627  17.655  -8.177
  136    H3*    G  13           H3*        G  13  -7.323  15.654 -10.216
  137    H2*    G  13           H2*        G  13  -5.131  15.123 -10.873
  138   2HO*    G  13          2HO*        G  13  -3.354  16.488  -9.946
  139    H1*    G  13           H1*        G  13  -3.885  15.135  -8.415
  140    H8     G  13           H8         G  13  -7.502  14.001  -8.824
  141    H1     G  13           H1         G  13  -3.290   9.302  -8.010
  142   1H2     G  13          1H2         G  13  -1.196  10.117  -8.186
  143   2H2     G  13          2H2         G  13  -0.899  11.823  -8.403
  144   1H5*    U  14          1H5*        U  14  -4.517  20.491 -10.661
  145   2H5*    U  14          2H5*        U  14  -3.951  18.816 -10.789
  146    H4*    U  14           H4*        U  14  -2.634  20.837  -9.557
  147    H3*    U  14           H3*        U  14  -2.050  18.210 -10.029
  148    H2*    U  14           H2*        U  14  -2.803  17.244  -8.006
  149   2HO*    U  14          2HO*        U  14  -0.959  16.860  -7.067
  150    H1*    U  14           H1*        U  14  -2.115  19.777  -6.440
  151    H3     U  14           H3         U  14  -4.918  19.189  -3.018
  152    H5     U  14           H5         U  14  -5.614  15.849  -5.462
  153    H6     U  14           H6         U  14  -4.303  16.877  -7.147
  154   1H5*    C  15          1H5*        C  15   0.300  15.780 -10.169
  155   2H5*    C  15          2H5*        C  15  -0.929  16.224  -8.968
  156    H4*    C  15           H4*        C  15   1.785  15.231  -8.152
  157    H3*    C  15           H3*        C  15  -0.529  13.503  -9.006
  158    H2*    C  15           H2*        C  15   0.035  11.994  -7.201
  159   2HO*    C  15          2HO*        C  15   2.284  13.713  -6.779
  160    H1*    C  15           H1*        C  15   0.314  13.999  -5.297
  161   1H4     C  15          1H4         C  15  -6.175  13.837  -5.878
  162   2H4     C  15          2H4         C  15  -5.890  12.221  -5.268
  163    H5     C  15           H5         C  15  -3.637  11.313  -5.051
  164    H6     C  15           H6         C  15  -1.271  11.783  -5.325
  165   1H5*    G  16          1H5*        G  16   2.255  10.467 -11.886
  166   2H5*    G  16          2H5*        G  16   0.790   9.472 -11.994
  167    H4*    G  16           H4*        G  16   1.903   8.000 -10.768
  168    H3*    G  16           H3*        G  16   1.152   9.991  -8.648
  169    H2*    G  16           H2*        G  16   2.564   8.876  -7.086
  170   2HO*    G  16          2HO*        G  16   1.940   6.745  -7.494
  171    H1*    G  16           H1*        G  16   4.588   8.150  -8.968
  172    H8     G  16           H8         G  16   2.943  11.557  -8.090
  173    H1     G  16           H1         G  16   9.139  10.855  -6.594
  174   1H2     G  16          1H2         G  16   9.840   8.846  -7.179
  175   2H2     G  16          2H2         G  16   8.776   7.684  -7.939
  176   1H5*    U  17          1H5*        U  17  -0.461   8.448  -4.917
  177   2H5*    U  17          2H5*        U  17  -1.211  10.048  -5.024
  178    H4*    U  17           H4*        U  17   1.726   9.743  -5.477
  179    H3*    U  17           H3*        U  17   0.864   8.690  -3.182
  180    H2*    U  17           H2*        U  17  -0.420  10.514  -2.413
  181   2HO*    U  17          2HO*        U  17   2.133  11.422  -1.561
  182    H1*    U  17           H1*        U  17   1.749  12.457  -3.316
  183    H3     U  17           H3         U  17  -0.645  16.208  -3.110
  184    H5     U  17           H5         U  17  -3.576  13.276  -2.951
  185    H6     U  17           H6         U  17  -1.840  11.619  -3.210
  186   1H5*    C  18          1H5*        C  18   2.852  13.823  -2.851
  187   2H5*    C  18          2H5*        C  18   4.545  13.295  -2.774
  188    H4*    C  18           H4*        C  18   4.394  13.096  -0.383
  189    H3*    C  18           H3*        C  18   1.791  12.765  -0.324
  190    H2*    C  18           H2*        C  18   1.047  14.861  -1.168
  191   2HO*    C  18          2HO*        C  18   1.729  15.742   1.445
  192    H1*    C  18           H1*        C  18   3.146  16.497   0.279
  193   1H4     C  18          1H4         C  18   2.740  19.719  -5.298
  194   2H4     C  18          2H4         C  18   1.031  19.347  -5.264
  195    H5     C  18           H5         C  18   0.056  17.821  -3.637
  196    H6     C  18           H6         C  18   0.516  16.467  -1.675
  197   1H5*    G  19          1H5*        G  19   1.063  14.372   1.881
  198   2H5*    G  19          2H5*        G  19   0.387  14.395   3.517
  199    H4*    G  19           H4*        G  19  -1.334  14.867   1.947
  200    H3*    G  19           H3*        G  19  -1.566  12.262   3.353
  201    H2*    G  19           H2*        G  19  -3.125  11.425   1.874
  202   2HO*    G  19          2HO*        G  19  -4.735  12.935   0.984
  203    H1*    G  19           H1*        G  19  -2.745  13.682  -0.124
  204    H8     G  19           H8         G  19  -0.474  10.645  -0.062
  205    H1     G  19           H1         G  19  -5.570  10.407  -3.950
  206   1H2     G  19          1H2         G  19  -6.831  11.882  -3.560
  207   2H2     G  19          2H2         G  19  -6.752  13.145  -2.423
  208   1H5*    C  20          1H5*        C  20  -5.338  14.630   3.765
  209   2H5*    C  20          2H5*        C  20  -5.920  14.386   5.422
  210    H4*    C  20           H4*        C  20  -7.807  14.040   4.190
  211    H3*    C  20           H3*        C  20  -6.618  11.300   4.603
  212    H2*    C  20           H2*        C  20  -8.499  10.430   3.399
  213   2HO*    C  20          2HO*        C  20 -10.386  11.452   3.376
  214    H1*    C  20           H1*        C  20  -8.622  12.629   1.566
  215   1H4     C  20          1H4         C  20  -6.213   8.143  -1.998
  216   2H4     C  20          2H4         C  20  -4.690   8.036  -1.343
  217    H5     C  20           H5         C  20  -4.305   9.517   0.847
  218    H6     C  20           H6         C  20  -5.371  11.128   2.345
  219   1H5*    C  21          1H5*        C  21 -10.468  10.898   5.268
  220   2H5*    C  21          2H5*        C  21 -10.850  10.078   6.795
  221    H4*    C  21           H4*        C  21 -12.050   8.910   5.179
  222    H3*    C  21           H3*        C  21  -9.529   7.393   5.831
  223    H2*    C  21           H2*        C  21 -10.217   5.708   4.269
  224   2HO*    C  21          2HO*        C  21 -12.290   5.314   4.017
  225    H1*    C  21           H1*        C  21 -11.302   7.546   2.379
  226   1H4     C  21          1H4         C  21  -5.817   5.933  -0.203
  227   2H4     C  21          2H4         C  21  -4.803   6.784   0.793
  228    H5     C  21           H5         C  21  -5.970   8.006   2.846
  229    H6     C  21           H6         C  21  -8.116   8.422   3.935
  230   1H5*    C  22          1H5*        C  22  -8.933   3.653   6.988
  231   2H5*    C  22          2H5*        C  22  -9.077   4.865   5.702
  232    H4*    C  22           H4*        C  22 -10.993   2.691   5.431
  233    H3*    C  22           H3*        C  22  -8.118   1.928   5.724
  234    H2*    C  22           H2*        C  22  -8.173   0.640   3.724
  235   2HO*    C  22          2HO*        C  22 -10.829   0.488   4.379
  236    H1*    C  22           H1*        C  22  -9.722   2.378   2.193
  237   1H4     C  22          1H4         C  22  -3.742   3.612   0.735
  238   2H4     C  22          2H4         C  22  -3.349   4.528   2.060
  239    H5     C  22           H5         C  22  -5.229   4.674   3.932
  240    H6     C  22           H6         C  22  -7.507   4.062   4.485
  241   1H5*    C  23          1H5*        C  23 -10.007  -1.226   4.039
  242   2H5*    C  23          2H5*        C  23  -9.484  -2.746   4.791
  243    H4*    C  23           H4*        C  23  -9.069  -2.634   2.361
  244    H3*    C  23           H3*        C  23  -6.848  -3.155   4.285
  245    H2*    C  23           H2*        C  23  -5.210  -3.055   2.555
  246   2HO*    C  23          2HO*        C  23  -6.772  -4.337   1.164
  247    H1*    C  23           H1*        C  23  -6.394  -0.993   1.028
  248   1H4     C  23          1H4         C  23  -1.763   1.868   4.275
  249   2H4     C  23          2H4         C  23  -2.825   2.047   5.654
  250    H5     C  23           H5         C  23  -5.047   1.085   5.738
  251    H6     C  23           H6         C  23  -6.699  -0.225   4.511
  252   1H5*    G  24          1H5*        G  24  -3.842  -6.418   3.487
  253   2H5*    G  24          2H5*        G  24  -4.477  -4.818   3.905
  254    H4*    G  24           H4*        G  24  -4.350  -5.166   1.048
  255    H3*    G  24           H3*        G  24  -2.304  -6.606   1.900
  256    H2*    G  24           H2*        G  24  -1.274  -5.108   3.434
  257   2HO*    G  24          2HO*        G  24  -0.302  -4.837   0.859
  258    H1*    G  24           H1*        G  24  -1.731  -2.652   1.719
  259    H8     G  24           H8         G  24  -3.916  -3.299   4.671
  260    H1     G  24           H1         G  24   1.302   0.157   6.079
  261   1H2     G  24          1H2         G  24   2.702   0.149   4.402
  262   2H2     G  24          2H2         G  24   2.363  -0.712   2.920
  263   1H5*    A  25          1H5*        A  25  -1.245  -8.308  -3.049
  264   2H5*    A  25          2H5*        A  25  -0.043  -8.466  -1.755
  265    H4*    A  25           H4*        A  25   0.213  -7.377  -4.443
  266    H3*    A  25           H3*        A  25   2.059  -8.585  -2.423
  267    H2*    A  25           H2*        A  25   3.930  -7.423  -3.383
  268   2HO*    A  25          2HO*        A  25   2.468  -7.683  -5.590
  269    H1*    A  25           H1*        A  25   2.588  -5.002  -3.870
  270    H8     A  25           H8         A  25   1.288  -5.686  -0.581
  271   1H6     A  25          1H6         A  25   6.599  -3.604   1.815
  272   2H6     A  25          2H6         A  25   4.926  -3.997   2.162
  273    H2     A  25           H2         A  25   7.309  -4.536  -2.493
  274   1H5*    G  26          1H5*        G  26   5.892 -10.722  -5.355
  275   2H5*    G  26          2H5*        G  26   5.391 -11.240  -3.734
  276    H4*    G  26           H4*        G  26   7.325  -9.262  -4.517
  277    H3*    G  26           H3*        G  26   6.557 -10.547  -1.908
  278    H2*    G  26           H2*        G  26   7.915  -8.883  -0.793
  279   2HO*    G  26          2HO*        G  26   8.621  -8.091  -3.444
  280    H1*    G  26           H1*        G  26   6.782  -6.784  -2.191
  281    H8     G  26           H8         G  26   3.849  -8.797  -2.085
  282    H1     G  26           H1         G  26   5.330  -6.719   3.775
  283   1H2     G  26          1H2         G  26   7.136  -6.108   3.943
  284   2H2     G  26          2H2         G  26   8.418  -6.001   2.864
  285   1H5*    C  27          1H5*        C  27  11.929  -8.544  -2.215
  286   2H5*    C  27          2H5*        C  27  12.342 -10.206  -2.678
  287    H4*    C  27           H4*        C  27  13.424  -9.756  -0.626
  288    H3*    C  27           H3*        C  27  11.039 -11.559  -0.250
  289    H2*    C  27           H2*        C  27  11.631 -11.699   2.083
  290   2HO*    C  27          2HO*        C  27  13.638 -11.357   2.712
  291    H1*    C  27           H1*        C  27  12.043  -8.952   2.370
  292   1H4     C  27          1H4         C  27   5.989  -9.797   3.925
  293   2H4     C  27          2H4         C  27   5.379  -9.944   2.394
  294    H5     C  27           H5         C  27   7.144 -10.024   0.439
  295    H6     C  27           H6         C  27   9.519  -9.868  -0.093
  296   1H5*    G  28          1H5*        G  28  13.944 -12.954   1.898
  297   2H5*    G  28          2H5*        G  28  14.303 -14.676   1.671
  298    H4*    G  28           H4*        G  28  14.114 -14.397   3.977
  299    H3*    G  28           H3*        G  28  11.524 -15.539   2.930
  300    H2*    G  28           H2*        G  28  10.776 -15.626   5.219
  301   2HO*    G  28          2HO*        G  28  13.301 -16.017   5.710
  302    H1*    G  28           H1*        G  28  11.866 -13.110   5.897
  303    H8     G  28           H8         G  28  10.234 -12.739   2.584
  304    H1     G  28           H1         G  28   6.105 -12.696   7.491
  305   1H2     G  28          1H2         G  28   7.099 -13.417   9.326
  306   2H2     G  28          2H2         G  28   8.782 -13.900   9.331
  307   1H5*    C  29          1H5*        C  29  12.396 -17.948   6.087
  308   2H5*    C  29          2H5*        C  29  12.458 -19.642   5.561
  309    H4*    C  29           H4*        C  29  11.067 -19.678   7.413
  310    H3*    C  29           H3*        C  29   9.426 -19.699   4.899
  311    H2*    C  29           H2*        C  29   7.424 -19.705   6.225
  312   2HO*    C  29          2HO*        C  29   9.052 -20.915   7.970
  313    H1*    C  29           H1*        C  29   8.323 -17.821   8.108
  314   1H4     C  29          1H4         C  29   4.975 -14.428   3.987
  315   2H4     C  29          2H4         C  29   6.221 -14.071   2.959
  316    H5     C  29           H5         C  29   8.546 -15.250   3.490
  317    H6     C  29           H6         C  29   9.632 -16.897   4.928
  318   1H5*    C  30          1H5*        C  30   7.423 -22.154   7.069
  319   2H5*    C  30          2H5*        C  30   7.491 -23.817   6.451
  320    H4*    C  30           H4*        C  30   5.236 -23.454   6.892
  321    H3*    C  30           H3*        C  30   5.774 -23.077   3.952
  322    H2*    C  30           H2*        C  30   3.469 -22.611   3.623
  323   2HO*    C  30          2HO*        C  30   2.694 -23.143   6.260
  324    H1*    C  30           H1*        C  30   3.117 -21.200   6.083
  325   1H4     C  30          1H4         C  30   3.152 -16.890   1.499
  326   2H4     C  30          2H4         C  30   4.748 -16.979   1.077
  327    H5     C  30           H5         C  30   6.151 -18.883   2.308
  328    H6     C  30           H6         C  30   6.062 -20.600   4.019
  329    H3T    C  30           H3T        C  30   5.314 -25.107   5.652
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  -3.268 -20.408   0.268
    2   2H5*    G   1          2H5*        G   1  -4.236 -18.977   0.664
    3    H4*    G   1           H4*        G   1  -4.310 -20.272   2.581
    4    H3*    G   1           H3*        G   1  -2.345 -18.036   2.886
    5    H2*    G   1           H2*        G   1  -1.745 -18.845   5.076
    6   2HO*    G   1          2HO*        G   1  -4.209 -19.927   4.923
    7    H1*    G   1           H1*        G   1  -1.452 -21.490   4.324
    8    H8     G   1           H8         G   1  -0.623 -18.823   1.684
    9    H1     G   1           H1         G   1   4.293 -21.074   5.114
   10   1H2     G   1          1H2         G   1   3.760 -22.264   6.514
   11   2H2     G   1          2H2         G   1   2.251 -22.801   7.035
   12    H5T    G   1           H5T        G   1  -2.313 -17.841   1.056
   13   1H5*    G   2          1H5*        G   2  -4.147 -18.490   6.307
   14   2H5*    G   2          2H5*        G   2  -4.962 -17.044   6.935
   15    H4*    G   2           H4*        G   2  -3.691 -17.851   8.714
   16    H3*    G   2           H3*        G   2  -2.374 -15.494   7.406
   17    H2*    G   2           H2*        G   2  -0.537 -15.676   8.945
   18   2HO*    G   2          2HO*        G   2  -0.906 -16.449  10.882
   19    H1*    G   2           H1*        G   2  -0.286 -18.451   8.756
   20    H8     G   2           H8         G   2  -1.238 -16.570   5.558
   21    H1     G   2           H1         G   2   5.021 -17.507   6.542
   22   1H2     G   2          1H2         G   2   5.419 -18.237   8.250
   23   2H2     G   2          2H2         G   2   4.454 -18.706   9.546
   24   1H5*    U   3          1H5*        U   3  -1.926 -15.029  11.244
   25   2H5*    U   3          2H5*        U   3  -2.541 -13.496  11.892
   26    H4*    U   3           H4*        U   3  -0.382 -13.652  12.726
   27    H3*    U   3           H3*        U   3  -0.500 -11.804  10.373
   28    H2*    U   3           H2*        U   3   1.875 -11.458  10.508
   29   2HO*    U   3          2HO*        U   3   1.441 -12.051  13.066
   30    H1*    U   3           H1*        U   3   2.539 -14.136  10.835
   31    H3     U   3           H3         U   3   3.607 -13.701   6.476
   32    H5     U   3           H5         U   3  -0.569 -13.485   6.492
   33    H6     U   3           H6         U   3  -0.499 -13.492   8.895
   34   1H5*    G   4          1H5*        G   4   1.764 -10.057  13.386
   35   2H5*    G   4          2H5*        G   4   1.326  -8.355  13.637
   36    H4*    G   4           H4*        G   4   3.668  -8.436  13.403
   37    H3*    G   4           H3*        G   4   2.337  -7.334  10.946
   38    H2*    G   4           H2*        G   4   4.504  -7.115   9.913
   39   2HO*    G   4          2HO*        G   4   5.281  -6.875  12.432
   40    H1*    G   4           H1*        G   4   5.433  -9.626  10.707
   41    H8     G   4           H8         G   4   1.738  -9.685   9.852
   42    H1     G   4           H1         G   4   5.757 -10.429   4.924
   43   1H2     G   4          1H2         G   4   7.568 -10.078   5.367
   44   2H2     G   4          2H2         G   4   8.317  -9.597   6.799
   45   1H5*    C   5          1H5*        C   5   5.513  -5.138  11.858
   46   2H5*    C   5          2H5*        C   5   5.357  -3.372  11.774
   47    H4*    C   5           H4*        C   5   7.230  -4.041  10.459
   48    H3*    C   5           H3*        C   5   4.889  -3.021   8.884
   49    H2*    C   5           H2*        C   5   6.028  -3.485   6.845
   50   2HO*    C   5          2HO*        C   5   8.190  -3.053   8.459
   51    H1*    C   5           H1*        C   5   7.335  -5.852   7.720
   52   1H4     C   5          1H4         C   5   2.677  -8.004   4.100
   53   2H4     C   5          2H4         C   5   1.482  -7.967   5.243
   54    H5     C   5           H5         C   5   2.112  -6.818   7.546
   55    H6     C   5           H6         C   5   3.902  -5.675   8.756
   56   1H5*    G   6          1H5*        G   6   8.047  -1.918   6.641
   57   2H5*    G   6          2H5*        G   6   7.701  -0.334   5.919
   58    H4*    G   6           H4*        G   6   7.860  -2.238   4.310
   59    H3*    G   6           H3*        G   6   5.455  -0.454   4.425
   60    H2*    G   6           H2*        G   6   4.367  -1.737   2.732
   61   2HO*    G   6          2HO*        G   6   6.530  -2.070   1.605
   62    H1*    G   6           H1*        G   6   5.029  -4.231   3.767
   63    H8     G   6           H8         G   6   4.418  -1.686   6.466
   64    H1     G   6           H1         G   6  -0.894  -4.549   4.321
   65   1H2     G   6          1H2         G   6  -0.475  -5.620   2.437
   66   2H2     G   6          2H2         G   6   1.129  -5.676   1.757
   67   1H5*    A   7          1H5*        A   7   8.142   1.979   0.409
   68   2H5*    A   7          2H5*        A   7   6.898   1.164   1.377
   69    H4*    A   7           H4*        A   7   8.320  -0.084  -0.971
   70    H3*    A   7           H3*        A   7   5.738   1.464  -0.934
   71    H2*    A   7           H2*        A   7   4.819  -0.109  -2.473
   72   2HO*    A   7          2HO*        A   7   6.896  -0.086  -3.710
   73    H1*    A   7           H1*        A   7   6.148  -2.389  -1.372
   74    H8     A   7           H8         A   7   4.481  -0.476   1.372
   75   1H6     A   7          1H6         A   7  -0.713  -3.513  -0.112
   76   2H6     A   7          2H6         A   7   0.047  -2.464   1.058
   77    H2     A   7           H2         A   7   2.300  -4.247  -3.344
   78   1H5*    A   8          1H5*        A   8   4.337   2.671  -5.588
   79   2H5*    A   8          2H5*        A   8   3.783   2.277  -3.949
   80    H4*    A   8           H4*        A   8   4.499   0.228  -6.039
   81    H3*    A   8           H3*        A   8   1.844   1.521  -5.518
   82    H2*    A   8           H2*        A   8   0.762  -0.623  -5.708
   83   2HO*    A   8          2HO*        A   8   3.309  -1.699  -6.410
   84    H1*    A   8           H1*        A   8   2.626  -2.027  -4.182
   85    H8     A   8           H8         A   8   2.804   0.584  -1.939
   86   1H6     A   8          1H6         A   8  -3.112  -0.213  -0.298
   87   2H6     A   8          2H6         A   8  -1.684   0.550   0.301
   88    H2     A   8           H2         A   8  -2.540  -2.221  -4.126
   89   1H5*    G   9          1H5*        G   9   0.366  -0.857  -8.003
   90   2H5*    G   9          2H5*        G   9  -0.151   0.042  -9.443
   91    H4*    G   9           H4*        G   9  -2.039  -1.141  -8.802
   92    H3*    G   9           H3*        G   9  -2.186   1.692  -7.851
   93    H2*    G   9           H2*        G   9  -4.291   1.260  -6.784
   94   2HO*    G   9          2HO*        G   9  -5.367  -0.151  -8.103
   95    H1*    G   9           H1*        G   9  -3.476  -1.085  -5.561
   96    H8     G   9           H8         G   9  -0.367   0.853  -5.600
   97    H1     G   9           H1         G   9  -4.499   2.892  -1.162
   98   1H2     G   9          1H2         G   9  -6.279   2.268  -1.425
   99   2H2     G   9          2H2         G   9  -6.979   1.266  -2.576
  100   1H5*    G  10          1H5*        G  10  -6.272   2.244 -10.435
  101   2H5*    G  10          2H5*        G  10  -4.980   2.389  -9.227
  102    H4*    G  10           H4*        G  10  -7.763   1.372  -8.662
  103    H3*    G  10           H3*        G  10  -6.645   4.154  -8.351
  104    H2*    G  10           H2*        G  10  -8.020   4.358  -6.367
  105   2HO*    G  10          2HO*        G  10  -9.589   2.720  -7.577
  106    H1*    G  10           H1*        G  10  -7.240   1.898  -5.334
  107    H8     G  10           H8         G  10  -4.156   2.951  -6.950
  108    H1     G  10           H1         G  10  -5.400   6.385  -1.705
  109   1H2     G  10          1H2         G  10  -7.226   6.283  -1.139
  110   2H2     G  10          2H2         G  10  -8.549   5.419  -1.717
  111   1H5*    G  11          1H5*        G  11 -10.867   4.542  -8.202
  112   2H5*    G  11          2H5*        G  11 -11.391   5.867  -9.261
  113    H4*    G  11           H4*        G  11 -12.424   6.179  -7.155
  114    H3*    G  11           H3*        G  11 -10.221   8.148  -7.675
  115    H2*    G  11           H2*        G  11 -10.572   9.101  -5.495
  116   2HO*    G  11          2HO*        G  11 -12.545   9.043  -4.722
  117    H1*    G  11           H1*        G  11 -10.678   6.692  -4.150
  118    H8     G  11           H8         G  11  -8.245   5.988  -6.822
  119    H1     G  11           H1         G  11  -5.915   9.742  -2.200
  120   1H2     G  11          1H2         G  11  -7.262  10.548  -1.119
  121   2H2     G  11          2H2         G  11  -8.938  10.402  -1.097
  122   1H5*    C  12          1H5*        C  12 -13.275  10.206  -5.938
  123   2H5*    C  12          2H5*        C  12 -13.685  11.685  -6.827
  124    H4*    C  12           H4*        C  12 -13.414  12.271  -4.549
  125    H3*    C  12           H3*        C  12 -11.070  13.196  -6.204
  126    H2*    C  12           H2*        C  12 -10.199  14.221  -4.191
  127   2HO*    C  12          2HO*        C  12 -11.858  14.980  -3.027
  128    H1*    C  12           H1*        C  12 -10.624  11.966  -2.609
  129   1H4     C  12          1H4         C  12  -4.799  11.340  -4.924
  130   2H4     C  12          2H4         C  12  -5.191  10.409  -6.253
  131    H5     C  12           H5         C  12  -7.796  10.038  -6.633
  132    H6     C  12           H6         C  12 -10.012  10.636  -5.809
  133   1H5*    G  13          1H5*        G  13 -11.435  18.213  -4.760
  134   2H5*    G  13          2H5*        G  13 -11.544  18.195  -6.530
  135    H4*    G  13           H4*        G  13  -9.476  19.237  -5.337
  136    H3*    G  13           H3*        G  13  -9.475  17.619  -7.856
  137    H2*    G  13           H2*        G  13  -7.099  17.557  -7.877
  138   2HO*    G  13          2HO*        G  13  -7.420  19.857  -6.345
  139    H1*    G  13           H1*        G  13  -6.707  17.381  -5.103
  140    H8     G  13           H8         G  13  -8.768  14.843  -4.946
  141    H1     G  13           H1         G  13  -4.309  13.137  -9.143
  142   1H2     G  13          1H2         G  13  -3.229  14.957  -9.897
  143   2H2     G  13          2H2         G  13  -3.656  16.558  -9.327
  144   1H5*    U  14          1H5*        U  14  -6.726  21.131  -7.333
  145   2H5*    U  14          2H5*        U  14  -6.386  21.889  -8.899
  146    H4*    U  14           H4*        U  14  -4.267  21.417  -8.695
  147    H3*    U  14           H3*        U  14  -5.093  18.957  -9.504
  148    H2*    U  14           H2*        U  14  -5.223  17.860  -7.398
  149   2HO*    U  14          2HO*        U  14  -2.920  17.169  -6.925
  150    H1*    U  14           H1*        U  14  -2.838  19.484  -6.387
  151    H3     U  14           H3         U  14  -4.913  20.327  -2.199
  152    H5     U  14           H5         U  14  -5.183  16.265  -3.178
  153    H6     U  14           H6         U  14  -4.591  16.808  -5.421
  154   1H5*    C  15          1H5*        C  15  -0.295  20.052  -6.596
  155   2H5*    C  15          2H5*        C  15   0.630  20.841  -7.885
  156    H4*    C  15           H4*        C  15   2.260  19.414  -7.514
  157    H3*    C  15           H3*        C  15   0.323  17.575  -8.796
  158    H2*    C  15           H2*        C  15   1.388  15.611  -7.955
  159   2HO*    C  15          2HO*        C  15   3.531  17.170  -8.101
  160    H1*    C  15           H1*        C  15   1.805  16.458  -5.353
  161   1H4     C  15          1H4         C  15  -4.683  15.455  -5.902
  162   2H4     C  15          2H4         C  15  -4.029  13.876  -6.215
  163    H5     C  15           H5         C  15  -1.693  13.415  -6.367
  164    H6     C  15           H6         C  15   0.532  14.354  -6.297
  165   1H5*    G  16          1H5*        G  16   2.239  15.344 -12.948
  166   2H5*    G  16          2H5*        G  16   0.878  14.931 -11.886
  167    H4*    G  16           H4*        G  16   2.100  12.948 -12.290
  168    H3*    G  16           H3*        G  16   2.317  14.025  -9.519
  169    H2*    G  16           H2*        G  16   3.976  12.413  -8.914
  170   2HO*    G  16          2HO*        G  16   2.650  10.923 -10.595
  171    H1*    G  16           H1*        G  16   5.458  12.498 -11.278
  172    H8     G  16           H8         G  16   4.078  15.865 -10.143
  173    H1     G  16           H1         G  16   9.892  14.394  -7.874
  174   1H2     G  16          1H2         G  16  10.406  12.309  -8.376
  175   2H2     G  16          2H2         G  16   9.307  11.282  -9.271
  176   1H5*    U  17          1H5*        U  17   1.309  11.244  -6.479
  177   2H5*    U  17          2H5*        U  17   0.289  12.561  -5.872
  178    H4*    U  17           H4*        U  17   2.782  13.701  -5.904
  179    H3*    U  17           H3*        U  17   3.646  11.271  -6.262
  180    H2*    U  17           H2*        U  17   2.330  10.137  -4.600
  181   2HO*    U  17          2HO*        U  17   4.890  10.844  -3.720
  182    H1*    U  17           H1*        U  17   2.960  12.284  -2.533
  183    H3     U  17           H3         U  17   0.089   9.620  -0.132
  184    H5     U  17           H5         U  17  -2.072  11.217  -3.384
  185    H6     U  17           H6         U  17  -0.008  11.909  -4.294
  186   1H5*    C  18          1H5*        C  18   3.673  16.742  -5.714
  187   2H5*    C  18          2H5*        C  18   5.410  16.389  -5.745
  188    H4*    C  18           H4*        C  18   5.608  16.536  -3.461
  189    H3*    C  18           H3*        C  18   3.251  15.304  -3.051
  190    H2*    C  18           H2*        C  18   1.798  17.166  -3.407
  191   2HO*    C  18          2HO*        C  18   1.195  17.269  -1.371
  192    H1*    C  18           H1*        C  18   3.829  19.092  -2.170
  193   1H4     C  18          1H4         C  18   0.753  23.151  -6.071
  194   2H4     C  18          2H4         C  18  -0.707  22.282  -5.648
  195    H5     C  18           H5         C  18  -0.661  20.202  -4.377
  196    H6     C  18           H6         C  18   0.747  18.628  -3.218
  197   1H5*    G  19          1H5*        G  19   2.635  16.694  -0.309
  198   2H5*    G  19          2H5*        G  19   2.475  16.107   1.354
  199    H4*    G  19           H4*        G  19   0.355  16.828   0.566
  200    H3*    G  19           H3*        G  19   0.572  13.908   1.029
  201    H2*    G  19           H2*        G  19  -1.301  13.406  -0.221
  202   2HO*    G  19          2HO*        G  19  -2.213  15.494   1.326
  203    H1*    G  19           H1*        G  19  -1.574  16.195  -1.337
  204    H8     G  19           H8         G  19   0.774  14.294  -3.276
  205    H1     G  19           H1         G  19  -5.280  12.692  -4.581
  206   1H2     G  19          1H2         G  19  -6.544  13.356  -3.214
  207   2H2     G  19          2H2         G  19  -6.340  14.309  -1.838
  208   1H5*    C  20          1H5*        C  20  -2.970  15.779   3.048
  209   2H5*    C  20          2H5*        C  20  -3.067  15.071   4.669
  210    H4*    C  20           H4*        C  20  -5.244  15.038   3.976
  211    H3*    C  20           H3*        C  20  -4.152  12.306   3.313
  212    H2*    C  20           H2*        C  20  -6.403  11.751   2.621
  213   2HO*    C  20          2HO*        C  20  -7.063  13.539   4.417
  214    H1*    C  20           H1*        C  20  -6.771  14.157   1.211
  215   1H4     C  20          1H4         C  20  -4.823  10.007  -3.079
  216   2H4     C  20          2H4         C  20  -3.197  10.278  -2.938
  217    H5     C  20           H5         C  20  -2.501  11.944  -0.974
  218    H6     C  20           H6         C  20  -3.366  13.333   0.826
  219   1H5*    C  21          1H5*        C  21  -7.622  11.732   4.824
  220   2H5*    C  21          2H5*        C  21  -7.702  10.523   6.121
  221    H4*    C  21           H4*        C  21  -9.363   9.973   4.529
  222    H3*    C  21           H3*        C  21  -7.016   8.088   4.310
  223    H2*    C  21           H2*        C  21  -8.297   6.889   2.651
  224   2HO*    C  21          2HO*        C  21 -10.340   7.979   4.010
  225    H1*    C  21           H1*        C  21  -9.179   9.231   1.349
  226   1H4     C  21          1H4         C  21  -4.229   7.164  -1.939
  227   2H4     C  21          2H4         C  21  -3.084   8.125  -1.215
  228    H5     C  21           H5         C  21  -3.936   9.528   0.875
  229    H6     C  21           H6         C  21  -5.886  10.018   2.258
  230   1H5*    C  22          1H5*        C  22 -10.331   6.186   4.276
  231   2H5*    C  22          2H5*        C  22 -10.601   4.878   5.444
  232    H4*    C  22           H4*        C  22 -11.307   4.058   3.359
  233    H3*    C  22           H3*        C  22  -8.657   2.911   4.182
  234    H2*    C  22           H2*        C  22  -8.509   1.731   2.130
  235   2HO*    C  22          2HO*        C  22 -10.260   1.132   0.999
  236    H1*    C  22           H1*        C  22  -9.722   3.711   0.505
  237   1H4     C  22          1H4         C  22  -3.543   3.783  -0.627
  238   2H4     C  22          2H4         C  22  -3.076   4.695   0.675
  239    H5     C  22           H5         C  22  -5.009   5.270   2.412
  240    H6     C  22           H6         C  22  -7.386   5.068   2.848
  241   1H5*    C  23          1H5*        C  23 -10.735  -0.129   1.961
  242   2H5*    C  23          2H5*        C  23 -10.520  -1.603   2.925
  243    H4*    C  23           H4*        C  23  -9.720  -1.846   0.624
  244    H3*    C  23           H3*        C  23  -7.754  -2.182   2.868
  245    H2*    C  23           H2*        C  23  -6.024  -2.634   1.254
  246   2HO*    C  23          2HO*        C  23  -8.023  -2.518  -0.783
  247    H1*    C  23           H1*        C  23  -6.787  -0.610  -0.545
  248   1H4     C  23          1H4         C  23  -2.212   2.047   2.941
  249   2H4     C  23          2H4         C  23  -3.371   2.463   4.186
  250    H5     C  23           H5         C  23  -5.685   1.747   4.113
  251    H6     C  23           H6         C  23  -7.347   0.506   2.829
  252   1H5*    G  24          1H5*        G  24  -6.458  -6.680   1.522
  253   2H5*    G  24          2H5*        G  24  -5.098  -6.294   2.593
  254    H4*    G  24           H4*        G  24  -5.457  -5.818  -0.281
  255    H3*    G  24           H3*        G  24  -3.598  -7.212   0.947
  256    H2*    G  24           H2*        G  24  -2.695  -5.586   2.440
  257   2HO*    G  24          2HO*        G  24  -1.418  -5.508  -0.052
  258    H1*    G  24           H1*        G  24  -2.754  -3.313   0.456
  259    H8     G  24           H8         G  24  -5.411  -3.616   3.070
  260    H1     G  24           H1         G  24  -0.343  -0.160   4.947
  261   1H2     G  24          1H2         G  24   1.306  -0.384   3.524
  262   2H2     G  24          2H2         G  24   1.166  -1.378   2.093
  263   1H5*    A  25          1H5*        A  25  -1.556  -9.761  -2.898
  264   2H5*    A  25          2H5*        A  25  -0.536  -9.107  -1.602
  265    H4*    A  25           H4*        A  25  -0.254  -8.887  -4.560
  266    H3*    A  25           H3*        A  25   1.471  -9.816  -2.334
  267    H2*    A  25           H2*        A  25   3.428  -8.736  -3.186
  268   2HO*    A  25          2HO*        A  25   2.268  -9.294  -5.488
  269    H1*    A  25           H1*        A  25   2.241  -6.378  -4.076
  270    H8     A  25           H8         A  25   0.385  -6.742  -0.999
  271   1H6     A  25          1H6         A  25   5.261  -4.446   2.035
  272   2H6     A  25          2H6         A  25   3.547  -4.803   2.142
  273    H2     A  25           H2         A  25   6.658  -5.799  -1.979
  274   1H5*    G  26          1H5*        G  26   4.367 -10.790  -5.207
  275   2H5*    G  26          2H5*        G  26   5.091 -12.258  -4.523
  276    H4*    G  26           H4*        G  26   6.569 -10.256  -4.544
  277    H3*    G  26           H3*        G  26   6.088 -11.891  -2.118
  278    H2*    G  26           H2*        G  26   7.107 -10.305  -0.653
  279   2HO*    G  26          2HO*        G  26   8.938  -9.856  -1.861
  280    H1*    G  26           H1*        G  26   6.158  -7.974  -1.814
  281    H8     G  26           H8         G  26   3.330 -10.331  -2.052
  282    H1     G  26           H1         G  26   4.015  -7.728   3.746
  283   1H2     G  26          1H2         G  26   5.732  -6.922   4.020
  284   2H2     G  26          2H2         G  26   7.081  -6.742   3.033
  285   1H5*    C  27          1H5*        C  27  10.631 -10.043  -1.768
  286   2H5*    C  27          2H5*        C  27  11.282 -11.686  -1.932
  287    H4*    C  27           H4*        C  27  12.379 -10.675  -0.103
  288    H3*    C  27           H3*        C  27  10.398 -12.778   0.665
  289    H2*    C  27           H2*        C  27  10.767 -12.358   2.986
  290   2HO*    C  27          2HO*        C  27  12.653 -11.642   3.657
  291    H1*    C  27           H1*        C  27  10.774  -9.578   2.822
  292   1H4     C  27          1H4         C  27   4.761 -10.965   4.099
  293   2H4     C  27          2H4         C  27   4.302 -11.431   2.583
  294    H5     C  27           H5         C  27   6.237 -11.575   0.779
  295    H6     C  27           H6         C  27   8.610 -11.192   0.391
  296   1H5*    G  28          1H5*        G  28  13.481 -13.118   3.042
  297   2H5*    G  28          2H5*        G  28  14.229 -14.726   3.092
  298    H4*    G  28           H4*        G  28  13.893 -14.104   5.325
  299    H3*    G  28           H3*        G  28  11.851 -16.109   4.418
  300    H2*    G  28           H2*        G  28  10.796 -15.999   6.566
  301   2HO*    G  28          2HO*        G  28  12.247 -15.894   8.136
  302    H1*    G  28           H1*        G  28  11.065 -13.217   6.890
  303    H8     G  28           H8         G  28  10.019 -14.038   3.370
  304    H1     G  28           H1         G  28   5.209 -13.721   7.604
  305   1H2     G  28          1H2         G  28   5.972 -13.686   9.627
  306   2H2     G  28          2H2         G  28   7.687 -13.720   9.979
  307   1H5*    C  29          1H5*        C  29  13.158 -17.430   8.170
  308   2H5*    C  29          2H5*        C  29  13.856 -19.051   7.984
  309    H4*    C  29           H4*        C  29  12.476 -19.256   9.826
  310    H3*    C  29           H3*        C  29  11.159 -20.346   7.374
  311    H2*    C  29           H2*        C  29   9.146 -20.784   8.590
  312   2HO*    C  29          2HO*        C  29   9.468 -21.484  10.571
  313    H1*    C  29           H1*        C  29   9.156 -18.422  10.111
  314   1H4     C  29          1H4         C  29   5.370 -16.780   5.383
  315   2H4     C  29          2H4         C  29   6.529 -16.379   4.284
  316    H5     C  29           H5         C  29   9.041 -16.881   5.019
  317    H6     C  29           H6         C  29  10.424 -17.829   6.794
  318   1H5*    C  30          1H5*        C  30  10.362 -23.183  10.272
  319   2H5*    C  30          2H5*        C  30  11.176 -24.698   9.830
  320    H4*    C  30           H4*        C  30   9.027 -25.349  10.428
  321    H3*    C  30           H3*        C  30   9.355 -25.226   7.452
  322    H2*    C  30           H2*        C  30   7.069 -25.770   7.124
  323   2HO*    C  30          2HO*        C  30   5.783 -26.560   8.862
  324    H1*    C  30           H1*        C  30   6.039 -24.222   9.240
  325   1H4     C  30          1H4         C  30   5.194 -20.750   4.074
  326   2H4     C  30          2H4         C  30   6.777 -20.453   3.696
  327    H5     C  30           H5         C  30   8.571 -21.677   5.230
  328    H6     C  30           H6         C  30   8.859 -23.078   7.189
  329    H3T    C  30           H3T        C  30   8.689 -27.445   8.950
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -3.593 -19.651   0.972
    2   2H5*    G   1          2H5*        G   1  -4.375 -18.110   1.365
    3    H4*    G   1           H4*        G   1  -4.438 -19.310   3.343
    4    H3*    G   1           H3*        G   1  -2.233 -17.289   3.400
    5    H2*    G   1           H2*        G   1  -1.555 -18.061   5.575
    6   2HO*    G   1          2HO*        G   1  -3.022 -18.907   6.847
    7    H1*    G   1           H1*        G   1  -1.606 -20.753   4.943
    8    H8     G   1           H8         G   1  -0.692 -18.310   2.126
    9    H1     G   1           H1         G   1   4.198 -20.895   5.351
   10   1H2     G   1          1H2         G   1   3.652 -21.946   6.850
   11   2H2     G   1          2H2         G   1   2.141 -22.314   7.489
   12    H5T    G   1           H5T        G   1  -2.576 -17.427   0.420
   13   1H5*    G   2          1H5*        G   2  -4.037 -17.422   6.940
   14   2H5*    G   2          2H5*        G   2  -4.645 -15.859   7.522
   15    H4*    G   2           H4*        G   2  -3.501 -16.842   9.321
   16    H3*    G   2           H3*        G   2  -1.991 -14.596   8.044
   17    H2*    G   2           H2*        G   2  -0.151 -14.947   9.544
   18   2HO*    G   2          2HO*        G   2  -0.623 -15.619  11.493
   19    H1*    G   2           H1*        G   2  -0.113 -17.724   9.337
   20    H8     G   2           H8         G   2  -1.042 -15.813   6.165
   21    H1     G   2           H1         G   2   5.183 -17.120   6.915
   22   1H2     G   2          1H2         G   2   5.604 -17.871   8.619
   23   2H2     G   2          2H2         G   2   4.666 -18.269   9.954
   24   1H5*    U   3          1H5*        U   3  -1.548 -14.139  11.963
   25   2H5*    U   3          2H5*        U   3  -2.062 -12.548  12.559
   26    H4*    U   3           H4*        U   3   0.067 -12.826  13.437
   27    H3*    U   3           H3*        U   3   0.097 -11.062  11.023
   28    H2*    U   3           H2*        U   3   2.486 -10.881  11.146
   29   2HO*    U   3          2HO*        U   3   3.284 -10.883  13.110
   30    H1*    U   3           H1*        U   3   2.971 -13.578  11.565
   31    H3     U   3           H3         U   3   3.991 -13.438   7.186
   32    H5     U   3           H5         U   3  -0.156 -12.911   7.243
   33    H6     U   3           H6         U   3  -0.039 -12.791   9.641
   34   1H5*    G   4          1H5*        G   4   2.492  -9.354  13.920
   35   2H5*    G   4          2H5*        G   4   2.143  -7.626  14.133
   36    H4*    G   4           H4*        G   4   4.466  -7.801  13.835
   37    H3*    G   4           H3*        G   4   3.072  -6.760  11.396
   38    H2*    G   4           H2*        G   4   5.173  -6.675  10.224
   39   2HO*    G   4          2HO*        G   4   6.116  -6.456  12.723
   40    H1*    G   4           H1*        G   4   6.037  -9.194  11.032
   41    H8     G   4           H8         G   4   2.286  -9.118  10.585
   42    H1     G   4           H1         G   4   5.647 -10.239   5.262
   43   1H2     G   4          1H2         G   4   7.512  -9.939   5.464
   44   2H2     G   4          2H2         G   4   8.459  -9.424   6.755
   45   1H5*    C   5          1H5*        C   5   6.261  -4.889  11.808
   46   2H5*    C   5          2H5*        C   5   6.377  -3.132  11.594
   47    H4*    C   5           H4*        C   5   7.873  -4.130  10.061
   48    H3*    C   5           H3*        C   5   5.417  -3.006   8.747
   49    H2*    C   5           H2*        C   5   6.192  -3.784   6.633
   50   2HO*    C   5          2HO*        C   5   8.592  -3.394   7.849
   51    H1*    C   5           H1*        C   5   7.401  -6.177   7.598
   52   1H4     C   5          1H4         C   5   2.166  -8.217   4.801
   53   2H4     C   5          2H4         C   5   1.129  -7.977   6.070
   54    H5     C   5           H5         C   5   2.156  -6.706   8.172
   55    H6     C   5           H6         C   5   4.164  -5.599   9.018
   56   1H5*    G   6          1H5*        G   6   8.320  -2.391   6.088
   57   2H5*    G   6          2H5*        G   6   8.070  -0.846   5.253
   58    H4*    G   6           H4*        G   6   7.872  -2.778   3.760
   59    H3*    G   6           H3*        G   6   5.504  -0.976   4.136
   60    H2*    G   6           H2*        G   6   4.200  -2.339   2.668
   61   2HO*    G   6          2HO*        G   6   6.188  -2.733   1.276
   62    H1*    G   6           H1*        G   6   5.016  -4.778   3.727
   63    H8     G   6           H8         G   6   4.738  -2.106   6.363
   64    H1     G   6           H1         G   6  -0.778  -5.076   5.029
   65   1H2     G   6          1H2         G   6  -0.577  -6.238   3.154
   66   2H2     G   6          2H2         G   6   0.941  -6.327   2.299
   67   1H5*    A   7          1H5*        A   7   7.557   1.188  -0.396
   68   2H5*    A   7          2H5*        A   7   6.475   0.439   0.795
   69    H4*    A   7           H4*        A   7   7.637  -1.033  -1.563
   70    H3*    A   7           H3*        A   7   5.090   0.566  -1.444
   71    H2*    A   7           H2*        A   7   3.996  -1.139  -2.689
   72   2HO*    A   7          2HO*        A   7   5.528  -1.445  -4.301
   73    H1*    A   7           H1*        A   7   5.421  -3.322  -1.515
   74    H8     A   7           H8         A   7   4.056  -1.233   1.239
   75   1H6     A   7          1H6         A   7  -1.343  -4.137   0.348
   76   2H6     A   7          2H6         A   7  -0.445  -3.083   1.417
   77    H2     A   7           H2         A   7   1.322  -5.077  -3.115
   78   1H5*    A   8          1H5*        A   8   4.095   0.627  -6.792
   79   2H5*    A   8          2H5*        A   8   3.148   1.171  -5.393
   80    H4*    A   8           H4*        A   8   3.408  -1.589  -6.543
   81    H3*    A   8           H3*        A   8   1.097   0.282  -6.109
   82    H2*    A   8           H2*        A   8  -0.321  -1.609  -5.702
   83   2HO*    A   8          2HO*        A   8   1.383  -2.746  -7.412
   84    H1*    A   8           H1*        A   8   1.640  -3.120  -4.302
   85    H8     A   8           H8         A   8   2.209  -0.370  -2.333
   86   1H6     A   8          1H6         A   8  -3.409  -0.848   0.206
   87   2H6     A   8          2H6         A   8  -1.879  -0.110   0.533
   88    H2     A   8           H2         A   8  -3.497  -3.059  -3.542
   89   1H5*    G   9          1H5*        G   9  -0.123  -2.030  -8.049
   90   2H5*    G   9          2H5*        G   9  -0.911  -2.234  -9.624
   91    H4*    G   9           H4*        G   9  -2.711  -2.758  -8.427
   92    H3*    G   9           H3*        G   9  -2.742   0.234  -8.085
   93    H2*    G   9           H2*        G   9  -4.728  -0.080  -6.738
   94   2HO*    G   9          2HO*        G   9  -5.856  -1.782  -7.491
   95    H1*    G   9           H1*        G   9  -3.570  -2.076  -5.220
   96    H8     G   9           H8         G   9  -0.805   0.213  -6.088
   97    H1     G   9           H1         G   9  -4.473   2.400  -1.323
   98   1H2     G   9          1H2         G   9  -6.132   1.471  -1.147
   99   2H2     G   9          2H2         G   9  -6.823   0.194  -1.992
  100   1H5*    G  10          1H5*        G  10  -7.888  -2.315  -8.897
  101   2H5*    G  10          2H5*        G  10  -7.825  -1.109 -10.198
  102    H4*    G  10           H4*        G  10  -9.484  -0.755  -8.284
  103    H3*    G  10           H3*        G  10  -7.631   1.448  -9.201
  104    H2*    G  10           H2*        G  10  -8.827   2.874  -7.657
  105   2HO*    G  10          2HO*        G  10 -10.828   2.418  -7.116
  106    H1*    G  10           H1*        G  10  -8.783   0.970  -5.589
  107    H8     G  10           H8         G  10  -5.577   1.054  -7.611
  108    H1     G  10           H1         G  10  -5.878   5.246  -2.784
  109   1H2     G  10          1H2         G  10  -7.614   5.349  -1.980
  110   2H2     G  10          2H2         G  10  -9.071   4.572  -2.308
  111   1H5*    G  11          1H5*        G  11 -11.624   2.586  -8.959
  112   2H5*    G  11          2H5*        G  11 -12.132   3.627 -10.303
  113    H4*    G  11           H4*        G  11 -12.838   4.640  -8.279
  114    H3*    G  11           H3*        G  11 -10.534   6.100  -9.540
  115    H2*    G  11           H2*        G  11 -10.575   7.662  -7.714
  116   2HO*    G  11          2HO*        G  11 -12.363   8.004  -6.625
  117    H1*    G  11           H1*        G  11 -10.820   5.741  -5.726
  118    H8     G  11           H8         G  11  -8.591   4.405  -8.448
  119    H1     G  11           H1         G  11  -5.739   8.289  -4.242
  120   1H2     G  11          1H2         G  11  -6.989   9.250  -3.142
  121   2H2     G  11          2H2         G  11  -8.674   9.263  -3.085
  122   1H5*    C  12          1H5*        C  12 -13.065   8.661  -8.048
  123   2H5*    C  12          2H5*        C  12 -13.606   9.938  -9.153
  124    H4*    C  12           H4*        C  12 -12.990  11.040  -7.194
  125    H3*    C  12           H3*        C  12 -10.803  11.311  -9.246
  126    H2*    C  12           H2*        C  12  -9.600  12.671  -7.660
  127   2HO*    C  12          2HO*        C  12 -10.946  13.931  -6.565
  128    H1*    C  12           H1*        C  12 -10.164  11.021  -5.449
  129   1H4     C  12          1H4         C  12  -4.442   9.283  -7.491
  130   2H4     C  12          2H4         C  12  -4.939   8.163  -8.602
  131    H5     C  12           H5         C  12  -7.571   7.994  -8.968
  132    H6     C  12           H6         C  12  -9.710   8.987  -8.353
  133   1H5*    G  13          1H5*        G  13  -8.841  14.376 -10.614
  134   2H5*    G  13          2H5*        G  13  -9.278  13.022  -9.554
  135    H4*    G  13           H4*        G  13  -9.414  15.339  -7.975
  136    H3*    G  13           H3*        G  13  -7.239  15.614  -9.952
  137    H2*    G  13           H2*        G  13  -5.494  15.766  -8.347
  138   2HO*    G  13          2HO*        G  13  -7.456  16.900  -6.912
  139    H1*    G  13           H1*        G  13  -6.403  13.903  -6.497
  140    H8     G  13           H8         G  13  -7.285  12.455  -9.770
  141    H1     G  13           H1         G  13  -1.086  11.768  -8.353
  142   1H2     G  13          1H2         G  13  -0.521  13.132  -6.700
  143   2H2     G  13          2H2         G  13  -1.696  14.183  -5.944
  144   1H5*    U  14          1H5*        U  14  -5.631  19.258 -11.109
  145   2H5*    U  14          2H5*        U  14  -5.063  17.669 -11.654
  146    H4*    U  14           H4*        U  14  -3.779  19.460  -9.599
  147    H3*    U  14           H3*        U  14  -3.458  19.811 -12.208
  148    H2*    U  14           H2*        U  14  -2.834  17.655 -12.923
  149   2HO*    U  14          2HO*        U  14  -0.665  19.186 -12.209
  150    H1*    U  14           H1*        U  14  -1.147  16.998 -10.499
  151    H3     U  14           H3         U  14  -1.534  13.274 -13.261
  152    H5     U  14           H5         U  14  -5.031  13.502 -10.960
  153    H6     U  14           H6         U  14  -4.303  15.662 -10.196
  154   1H5*    C  15          1H5*        C  15  -3.177  20.239  -7.597
  155   2H5*    C  15          2H5*        C  15  -3.750  21.912  -7.706
  156    H4*    C  15           H4*        C  15  -2.343  22.648  -6.146
  157    H3*    C  15           H3*        C  15  -0.292  21.286  -7.672
  158    H2*    C  15           H2*        C  15   0.909  20.244  -5.976
  159   2HO*    C  15          2HO*        C  15   1.287  21.294  -4.196
  160    H1*    C  15           H1*        C  15  -1.087  19.579  -4.192
  161   1H4     C  15          1H4         C  15  -2.477  15.081  -8.688
  162   2H4     C  15          2H4         C  15  -0.734  14.936  -8.798
  163    H5     C  15           H5         C  15   0.766  16.439  -7.632
  164    H6     C  15           H6         C  15   0.916  18.375  -6.168
  165   1H5*    G  16          1H5*        G  16  -0.281  25.797  -3.627
  166   2H5*    G  16          2H5*        G  16   1.225  26.599  -4.111
  167    H4*    G  16           H4*        G  16   2.413  25.418  -2.681
  168    H3*    G  16           H3*        G  16   1.225  22.999  -3.989
  169    H2*    G  16           H2*        G  16   1.754  21.660  -2.080
  170   2HO*    G  16          2HO*        G  16   3.848  22.434  -1.702
  171    H1*    G  16           H1*        G  16   1.099  23.588  -0.134
  172    H8     G  16           H8         G  16  -0.370  21.663  -3.103
  173    H1     G  16           H1         G  16  -4.264  22.384   1.942
  174   1H2     G  16          1H2         G  16  -3.358  23.745   3.416
  175   2H2     G  16          2H2         G  16  -1.789  24.475   3.163
  176   1H5*    U  17          1H5*        U  17   3.864  19.642  -5.429
  177   2H5*    U  17          2H5*        U  17   2.144  19.271  -5.240
  178    H4*    U  17           H4*        U  17   4.127  19.215  -3.004
  179    H3*    U  17           H3*        U  17   4.256  17.367  -4.975
  180    H2*    U  17           H2*        U  17   2.119  16.403  -4.790
  181   2HO*    U  17          2HO*        U  17   3.738  15.356  -2.727
  182    H1*    U  17           H1*        U  17   2.100  16.795  -1.767
  183    H3     U  17           H3         U  17  -2.379  17.474  -1.265
  184    H5     U  17           H5         U  17  -1.904  15.866  -5.114
  185    H6     U  17           H6         U  17   0.477  16.135  -4.836
  186   1H5*    C  18          1H5*        C  18   7.326  14.583  -4.399
  187   2H5*    C  18          2H5*        C  18   6.778  14.705  -6.083
  188    H4*    C  18           H4*        C  18   5.035  14.892  -3.653
  189    H3*    C  18           H3*        C  18   5.816  12.507  -4.954
  190    H2*    C  18           H2*        C  18   4.049  12.376  -6.429
  191   2HO*    C  18          2HO*        C  18   2.640  12.356  -3.964
  192    H1*    C  18           H1*        C  18   2.453  14.458  -4.873
  193   1H4     C  18          1H4         C  18   1.091  15.518 -11.185
  194   2H4     C  18          2H4         C  18   0.315  13.965 -10.998
  195    H5     C  18           H5         C  18   0.575  12.610  -8.992
  196    H6     C  18           H6         C  18   1.494  12.521  -6.772
  197   1H5*    G  19          1H5*        G  19   3.533  13.652  -2.653
  198   2H5*    G  19          2H5*        G  19   3.132  13.573  -0.931
  199    H4*    G  19           H4*        G  19   1.415  14.625  -2.159
  200    H3*    G  19           H3*        G  19   0.796  12.041  -0.844
  201    H2*    G  19           H2*        G  19  -1.096  11.625  -2.087
  202   2HO*    G  19          2HO*        G  19  -2.273  13.276  -1.068
  203    H1*    G  19           H1*        G  19  -0.665  13.939  -3.962
  204    H8     G  19           H8         G  19   1.379  11.316  -5.112
  205    H1     G  19           H1         G  19  -4.787  10.068  -6.375
  206   1H2     G  19          1H2         G  19  -5.996  11.199  -5.428
  207   2H2     G  19          2H2         G  19  -5.755  12.428  -4.306
  208   1H5*    C  20          1H5*        C  20  -2.430  14.688   0.312
  209   2H5*    C  20          2H5*        C  20  -2.623  14.558   2.071
  210    H4*    C  20           H4*        C  20  -4.763  14.259   1.310
  211    H3*    C  20           H3*        C  20  -3.579  11.510   1.658
  212    H2*    C  20           H2*        C  20  -5.702  10.619   0.998
  213   2HO*    C  20          2HO*        C  20  -7.482  11.680   1.459
  214    H1*    C  20           H1*        C  20  -6.177  12.625  -0.978
  215   1H4     C  20          1H4         C  20  -4.482   7.659  -4.411
  216   2H4     C  20          2H4         C  20  -2.844   7.809  -4.252
  217    H5     C  20           H5         C  20  -2.031   9.627  -2.476
  218    H6     C  20           H6         C  20  -2.791  11.380  -0.957
  219   1H5*    C  21          1H5*        C  21  -7.172  11.441   3.212
  220   2H5*    C  21          2H5*        C  21  -7.263  10.686   4.815
  221    H4*    C  21           H4*        C  21  -8.885   9.614   3.512
  222    H3*    C  21           H3*        C  21  -6.452   7.837   3.694
  223    H2*    C  21           H2*        C  21  -7.672   6.213   2.423
  224   2HO*    C  21          2HO*        C  21  -9.789   6.096   2.580
  225    H1*    C  21           H1*        C  21  -8.918   8.149   0.732
  226   1H4     C  21          1H4         C  21  -4.461   5.429  -2.770
  227   2H4     C  21          2H4         C  21  -3.171   6.329  -2.256
  228    H5     C  21           H5         C  21  -3.669   8.009  -0.255
  229    H6     C  21           H6         C  21  -5.410   8.827   1.245
  230   1H5*    C  22          1H5*        C  22  -9.711   5.881   4.360
  231   2H5*    C  22          2H5*        C  22  -9.844   4.910   5.839
  232    H4*    C  22           H4*        C  22 -10.604   3.495   4.172
  233    H3*    C  22           H3*        C  22  -7.758   2.839   4.858
  234    H2*    C  22           H2*        C  22  -7.687   1.218   3.122
  235   2HO*    C  22          2HO*        C  22 -10.266   0.966   3.788
  236    H1*    C  22           H1*        C  22  -9.321   2.600   1.272
  237   1H4     C  22          1H4         C  22  -3.455   3.276  -0.867
  238   2H4     C  22          2H4         C  22  -2.948   4.448   0.188
  239    H5     C  22           H5         C  22  -4.648   5.022   2.154
  240    H6     C  22           H6         C  22  -6.867   4.585   3.029
  241   1H5*    C  23          1H5*        C  23 -10.243  -0.841   4.283
  242   2H5*    C  23          2H5*        C  23  -9.463  -2.134   5.214
  243    H4*    C  23           H4*        C  23  -9.700  -2.495   2.724
  244    H3*    C  23           H3*        C  23  -7.143  -2.897   4.219
  245    H2*    C  23           H2*        C  23  -5.962  -3.345   2.172
  246   2HO*    C  23          2HO*        C  23  -8.438  -4.070   1.385
  247    H1*    C  23           H1*        C  23  -7.075  -1.279   0.685
  248   1H4     C  23          1H4         C  23  -1.869   1.314   3.207
  249   2H4     C  23          2H4         C  23  -2.761   1.748   4.649
  250    H5     C  23           H5         C  23  -5.054   1.055   5.025
  251    H6     C  23           H6         C  23  -6.940  -0.180   4.093
  252   1H5*    G  24          1H5*        G  24  -7.217  -5.586   1.287
  253   2H5*    G  24          2H5*        G  24  -6.339  -7.083   1.656
  254    H4*    G  24           H4*        G  24  -5.427  -5.523  -0.158
  255    H3*    G  24           H3*        G  24  -4.119  -7.414   1.209
  256    H2*    G  24           H2*        G  24  -3.341  -6.107   3.063
  257   2HO*    G  24          2HO*        G  24  -1.596  -6.234   0.943
  258    H1*    G  24           H1*        G  24  -2.760  -3.733   1.228
  259    H8     G  24           H8         G  24  -5.374  -4.006   3.982
  260    H1     G  24           H1         G  24  -0.194  -0.529   5.472
  261   1H2     G  24          1H2         G  24   1.330  -0.723   3.920
  262   2H2     G  24          2H2         G  24   1.073  -1.706   2.497
  263   1H5*    A  25          1H5*        A  25  -3.226  -9.502  -3.037
  264   2H5*    A  25          2H5*        A  25  -2.367 -10.573  -1.913
  265    H4*    A  25           H4*        A  25  -1.319  -9.554  -4.191
  266    H3*    A  25           H3*        A  25   0.039 -10.561  -1.708
  267    H2*    A  25           H2*        A  25   2.145  -9.794  -2.570
  268   2HO*    A  25          2HO*        A  25   1.109 -10.465  -4.844
  269    H1*    A  25           H1*        A  25   1.141  -7.407  -3.711
  270    H8     A  25           H8         A  25  -0.434  -7.455  -0.408
  271   1H6     A  25          1H6         A  25   4.793  -5.033   1.851
  272   2H6     A  25          2H6         A  25   3.099  -5.345   2.173
  273    H2     A  25           H2         A  25   5.694  -6.747  -2.173
  274   1H5*    G  26          1H5*        G  26   2.855 -12.375  -4.413
  275   2H5*    G  26          2H5*        G  26   3.548 -13.622  -3.359
  276    H4*    G  26           H4*        G  26   4.963 -11.570  -3.942
  277    H3*    G  26           H3*        G  26   4.745 -12.842  -1.261
  278    H2*    G  26           H2*        G  26   5.909 -11.040  -0.194
  279   2HO*    G  26          2HO*        G  26   7.560 -10.791  -1.713
  280    H1*    G  26           H1*        G  26   4.757  -8.940  -1.597
  281    H8     G  26           H8         G  26   1.870 -11.109  -1.172
  282    H1     G  26           H1         G  26   3.446  -8.035   4.211
  283   1H2     G  26          1H2         G  26   5.249  -7.352   4.197
  284   2H2     G  26          2H2         G  26   6.471  -7.382   3.045
  285   1H5*    C  27          1H5*        C  27   9.314 -11.055  -1.938
  286   2H5*    C  27          2H5*        C  27   9.917 -12.725  -1.944
  287    H4*    C  27           H4*        C  27  11.368 -11.450  -0.581
  288    H3*    C  27           H3*        C  27   9.614 -13.360   0.894
  289    H2*    C  27           H2*        C  27  10.380 -12.569   3.008
  290   2HO*    C  27          2HO*        C  27  12.580 -12.054   1.611
  291    H1*    C  27           H1*        C  27  10.307  -9.856   2.417
  292   1H4     C  27          1H4         C  27   4.651 -11.198   4.876
  293   2H4     C  27          2H4         C  27   3.935 -11.763   3.491
  294    H5     C  27           H5         C  27   5.532 -12.041   1.405
  295    H6     C  27           H6         C  27   7.790 -11.673   0.583
  296   1H5*    G  28          1H5*        G  28  13.159 -13.442   2.801
  297   2H5*    G  28          2H5*        G  28  13.879 -15.064   2.752
  298    H4*    G  28           H4*        G  28  14.073 -14.411   4.969
  299    H3*    G  28           H3*        G  28  11.785 -16.301   4.594
  300    H2*    G  28           H2*        G  28  11.176 -16.076   6.904
  301   2HO*    G  28          2HO*        G  28  13.771 -15.624   7.165
  302    H1*    G  28           H1*        G  28  11.503 -13.315   7.050
  303    H8     G  28           H8         G  28  10.107 -14.300   3.691
  304    H1     G  28           H1         G  28   5.712 -13.451   8.292
  305   1H2     G  28          1H2         G  28   6.659 -13.320  10.235
  306   2H2     G  28          2H2         G  28   8.395 -13.431  10.437
  307   1H5*    C  29          1H5*        C  29  13.362 -17.607   8.056
  308   2H5*    C  29          2H5*        C  29  13.954 -19.270   7.864
  309    H4*    C  29           H4*        C  29  12.673 -19.372   9.780
  310    H3*    C  29           H3*        C  29  11.160 -20.401   7.417
  311    H2*    C  29           H2*        C  29   9.190 -20.702   8.747
  312   2HO*    C  29          2HO*        C  29  11.028 -21.040  10.663
  313    H1*    C  29           H1*        C  29   9.429 -18.334  10.238
  314   1H4     C  29          1H4         C  29   5.514 -16.417   5.741
  315   2H4     C  29          2H4         C  29   6.629 -16.087   4.573
  316    H5     C  29           H5         C  29   9.143 -16.780   5.161
  317    H6     C  29           H6         C  29  10.549 -17.842   6.850
  318   1H5*    C  30          1H5*        C  30  10.352 -23.142  10.387
  319   2H5*    C  30          2H5*        C  30  11.054 -24.709   9.935
  320    H4*    C  30           H4*        C  30   8.905 -25.225  10.649
  321    H3*    C  30           H3*        C  30   9.092 -25.166   7.661
  322    H2*    C  30           H2*        C  30   6.765 -25.576   7.451
  323   2HO*    C  30          2HO*        C  30   7.112 -27.014   9.584
  324    H1*    C  30           H1*        C  30   5.930 -23.923   9.569
  325   1H4     C  30          1H4         C  30   5.134 -20.455   4.390
  326   2H4     C  30          2H4         C  30   6.711 -20.322   3.916
  327    H5     C  30           H5         C  30   8.473 -21.659   5.395
  328    H6     C  30           H6         C  30   8.742 -23.018   7.387
  329    H3T    C  30           H3T        C  30  10.039 -26.817   8.750
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -0.294 -22.402  -0.132
    2   2H5*    G   1          2H5*        G   1  -1.598 -21.565   0.729
    3    H4*    G   1           H4*        G   1  -0.570 -22.859   2.351
    4    H3*    G   1           H3*        G   1   0.302 -20.003   2.552
    5    H2*    G   1           H2*        G   1   1.810 -20.559   4.331
    6   2HO*    G   1          2HO*        G   1   1.206 -22.098   5.650
    7    H1*    G   1           H1*        G   1   2.792 -22.913   3.185
    8    H8     G   1           H8         G   1   2.188 -20.250   0.572
    9    H1     G   1           H1         G   1   7.876 -19.978   3.503
   10   1H2     G   1          1H2         G   1   8.017 -21.154   4.994
   11   2H2     G   1          2H2         G   1   6.936 -22.226   5.711
   12    H5T    G   1           H5T        G   1  -0.666 -19.921  -0.269
   13   1H5*    G   2          1H5*        G   2  -0.416 -21.529   6.232
   14   2H5*    G   2          2H5*        G   2  -1.593 -20.597   7.179
   15    H4*    G   2           H4*        G   2   0.196 -21.037   8.623
   16    H3*    G   2           H3*        G   2   0.167 -18.209   7.643
   17    H2*    G   2           H2*        G   2   2.198 -17.749   8.833
   18   2HO*    G   2          2HO*        G   2   2.520 -18.782  10.651
   19    H1*    G   2           H1*        G   2   3.516 -20.096   8.110
   20    H8     G   2           H8         G   2   1.292 -18.704   5.361
   21    H1     G   2           H1         G   2   7.278 -16.435   5.497
   22   1H2     G   2          1H2         G   2   8.247 -16.953   7.064
   23   2H2     G   2          2H2         G   2   7.840 -17.889   8.402
   24   1H5*    U   3          1H5*        U   3   1.100 -17.993  11.479
   25   2H5*    U   3          2H5*        U   3   0.029 -16.932  12.415
   26    H4*    U   3           H4*        U   3   2.168 -16.200  12.938
   27    H3*    U   3           H3*        U   3   0.898 -14.410  10.899
   28    H2*    U   3           H2*        U   3   2.907 -13.088  10.812
   29   2HO*    U   3          2HO*        U   3   3.180 -13.963  13.290
   30    H1*    U   3           H1*        U   3   4.656 -15.238  10.665
   31    H3     U   3           H3         U   3   4.668 -13.946   6.338
   32    H5     U   3           H5         U   3   0.935 -15.764   6.834
   33    H6     U   3           H6         U   3   1.391 -15.904   9.192
   34   1H5*    G   4          1H5*        G   4   2.675 -12.081  13.871
   35   2H5*    G   4          2H5*        G   4   1.609 -10.762  14.396
   36    H4*    G   4           H4*        G   4   3.721  -9.823  13.898
   37    H3*    G   4           H3*        G   4   1.638  -9.154  11.849
   38    H2*    G   4           H2*        G   4   3.284  -7.971  10.558
   39   2HO*    G   4          2HO*        G   4   4.972  -7.114  11.519
   40    H1*    G   4           H1*        G   4   5.264  -9.906  10.782
   41    H8     G   4           H8         G   4   1.898 -11.575  10.575
   42    H1     G   4           H1         G   4   4.537 -10.053   4.953
   43   1H2     G   4          1H2         G   4   6.040  -8.883   5.114
   44   2H2     G   4          2H2         G   4   6.783  -8.143   6.431
   45   1H5*    C   5          1H5*        C   5   3.865  -6.170  12.728
   46   2H5*    C   5          2H5*        C   5   3.250  -4.517  12.929
   47    H4*    C   5           H4*        C   5   4.973  -4.460  11.306
   48    H3*    C   5           H3*        C   5   2.225  -4.046  10.195
   49    H2*    C   5           H2*        C   5   3.080  -3.986   7.974
   50   2HO*    C   5          2HO*        C   5   4.858  -2.833   7.856
   51    H1*    C   5           H1*        C   5   5.087  -5.954   8.313
   52   1H4     C   5          1H4         C   5   0.529  -9.124   5.372
   53   2H4     C   5          2H4         C   5  -0.433  -9.395   6.692
   54    H5     C   5           H5         C   5   0.347  -8.274   8.955
   55    H6     C   5           H6         C   5   1.977  -6.753   9.942
   56   1H5*    G   6          1H5*        G   6   3.370  -0.101   6.823
   57   2H5*    G   6          2H5*        G   6   1.872  -0.893   7.348
   58    H4*    G   6           H4*        G   6   4.045  -1.949   5.566
   59    H3*    G   6           H3*        G   6   1.234  -1.144   5.107
   60    H2*    G   6           H2*        G   6   0.671  -3.133   3.902
   61   2HO*    G   6          2HO*        G   6   3.193  -2.939   3.159
   62    H1*    G   6           H1*        G   6   2.047  -4.983   5.438
   63    H8     G   6           H8         G   6   0.923  -2.667   7.969
   64    H1     G   6           H1         G   6  -3.901  -6.265   5.793
   65   1H2     G   6          1H2         G   6  -3.377  -7.130   3.836
   66   2H2     G   6          2H2         G   6  -1.828  -6.834   3.083
   67   1H5*    A   7          1H5*        A   7   4.977  -0.721   3.308
   68   2H5*    A   7          2H5*        A   7   5.840   0.484   2.333
   69    H4*    A   7           H4*        A   7   5.469  -1.061   0.730
   70    H3*    A   7           H3*        A   7   2.952   0.602   0.672
   71    H2*    A   7           H2*        A   7   2.164  -0.824  -1.075
   72   2HO*    A   7          2HO*        A   7   4.751  -0.948  -1.648
   73    H1*    A   7           H1*        A   7   3.291  -3.206   0.025
   74    H8     A   7           H8         A   7   1.389  -1.541   2.732
   75   1H6     A   7          1H6         A   7  -3.730  -4.034   0.298
   76   2H6     A   7          2H6         A   7  -3.077  -3.215   1.697
   77    H2     A   7           H2         A   7  -0.422  -4.502  -2.667
   78   1H5*    A   8          1H5*        A   8   4.130   0.495  -3.273
   79   2H5*    A   8          2H5*        A   8   3.337   1.776  -4.209
   80    H4*    A   8           H4*        A   8   2.589  -0.622  -4.608
   81    H3*    A   8           H3*        A   8   0.597   1.574  -4.045
   82    H2*    A   8           H2*        A   8  -1.131  -0.061  -4.421
   83   2HO*    A   8          2HO*        A   8  -0.780  -1.677  -5.752
   84    H1*    A   8           H1*        A   8   0.249  -2.135  -3.059
   85    H8     A   8           H8         A   8   0.719   0.269  -0.529
   86   1H6     A   8          1H6         A   8  -5.326   0.015   0.791
   87   2H6     A   8          2H6         A   8  -3.864   0.562   1.524
   88    H2     A   8           H2         A   8  -4.794  -1.684  -3.180
   89   1H5*    G   9          1H5*        G   9  -0.564   0.022  -7.449
   90   2H5*    G   9          2H5*        G   9  -1.333   1.091  -8.639
   91    H4*    G   9           H4*        G   9  -2.884  -0.587  -7.864
   92    H3*    G   9           H3*        G   9  -3.522   2.261  -7.202
   93    H2*    G   9           H2*        G   9  -5.483   1.540  -5.989
   94   2HO*    G   9          2HO*        G   9  -5.107  -0.664  -7.599
   95    H1*    G   9           H1*        G   9  -4.274  -0.579  -4.687
   96    H8     G   9           H8         G   9  -1.495   1.716  -4.564
   97    H1     G   9           H1         G   9  -6.179   3.435  -0.553
   98   1H2     G   9          1H2         G   9  -7.864   2.610  -0.942
   99   2H2     G   9          2H2         G   9  -8.355   1.522  -2.124
  100   1H5*    G  10          1H5*        G  10  -6.542   1.208  -9.686
  101   2H5*    G  10          2H5*        G  10  -7.051   2.223 -11.049
  102    H4*    G  10           H4*        G  10  -8.845   2.397  -9.639
  103    H3*    G  10           H3*        G  10  -7.049   4.729  -8.988
  104    H2*    G  10           H2*        G  10  -8.737   5.419  -7.388
  105   2HO*    G  10          2HO*        G  10 -10.356   4.131  -9.006
  106    H1*    G  10           H1*        G  10  -8.998   2.882  -6.278
  107    H8     G  10           H8         G  10  -5.452   2.981  -7.131
  108    H1     G  10           H1         G  10  -6.818   6.538  -1.993
  109   1H2     G  10          1H2         G  10  -8.680   6.825  -1.730
  110   2H2     G  10          2H2         G  10 -10.046   6.351  -2.588
  111   1H5*    G  11          1H5*        G  11 -10.808   6.484 -10.002
  112   2H5*    G  11          2H5*        G  11 -10.550   7.796 -11.170
  113    H4*    G  11           H4*        G  11 -11.889   8.704  -9.478
  114    H3*    G  11           H3*        G  11  -9.043   9.605  -9.227
  115    H2*    G  11           H2*        G  11  -9.594  10.809  -7.217
  116   2HO*    G  11          2HO*        G  11 -12.000  10.876  -8.326
  117    H1*    G  11           H1*        G  11 -10.989   8.743  -6.039
  118    H8     G  11           H8         G  11  -8.418   7.001  -8.055
  119    H1     G  11           H1         G  11  -6.112   9.665  -2.724
  120   1H2     G  11          1H2         G  11  -7.345  10.902  -1.899
  121   2H2     G  11          2H2         G  11  -8.901  11.388  -2.313
  122   1H5*    C  12          1H5*        C  12 -11.284  12.659  -8.263
  123   2H5*    C  12          2H5*        C  12 -10.968  14.145  -9.178
  124    H4*    C  12           H4*        C  12 -11.041  14.715  -6.883
  125    H3*    C  12           H3*        C  12  -8.265  14.810  -8.023
  126    H2*    C  12           H2*        C  12  -7.389  15.339  -5.849
  127   2HO*    C  12          2HO*        C  12  -9.762  16.487  -5.575
  128    H1*    C  12           H1*        C  12  -9.054  13.595  -4.399
  129   1H4     C  12          1H4         C  12  -3.583  10.395  -5.019
  130   2H4     C  12          2H4         C  12  -4.065   9.589  -6.365
  131    H5     C  12           H5         C  12  -6.358  10.258  -7.464
  132    H6     C  12           H6         C  12  -8.239  11.807  -7.333
  133   1H5*    G  13          1H5*        G  13  -6.561  16.316  -7.126
  134   2H5*    G  13          2H5*        G  13  -6.322  17.642  -5.982
  135    H4*    G  13           H4*        G  13  -4.944  18.829  -7.546
  136    H3*    G  13           H3*        G  13  -5.936  16.927  -9.565
  137    H2*    G  13           H2*        G  13  -3.853  16.311 -10.424
  138   2HO*    G  13          2HO*        G  13  -3.206  18.845  -9.564
  139    H1*    G  13           H1*        G  13  -2.368  16.242  -8.092
  140    H8     G  13           H8         G  13  -6.021  15.139  -8.190
  141    H1     G  13           H1         G  13  -1.740  10.410  -8.267
  142   1H2     G  13          1H2         G  13   0.328  11.257  -8.456
  143   2H2     G  13          2H2         G  13   0.604  12.977  -8.520
  144   1H5*    U  14          1H5*        U  14  -3.141  21.941  -7.793
  145   2H5*    U  14          2H5*        U  14  -3.037  22.150  -9.551
  146    H4*    U  14           H4*        U  14  -0.833  22.039  -9.168
  147    H3*    U  14           H3*        U  14  -1.508  19.747 -10.252
  148    H2*    U  14           H2*        U  14  -2.177  18.610  -8.284
  149   2HO*    U  14          2HO*        U  14  -0.630  17.290  -9.242
  150    H1*    U  14           H1*        U  14   0.319  19.524  -6.776
  151    H3     U  14           H3         U  14  -1.949  20.101  -2.746
  152    H5     U  14           H5         U  14  -3.866  17.083  -4.940
  153    H6     U  14           H6         U  14  -2.621  17.751  -6.835
  154   1H5*    C  15          1H5*        C  15   2.919  17.819  -9.789
  155   2H5*    C  15          2H5*        C  15   1.239  17.316  -9.529
  156    H4*    C  15           H4*        C  15   3.731  16.454  -8.175
  157    H3*    C  15           H3*        C  15   1.202  15.053  -9.045
  158    H2*    C  15           H2*        C  15   1.834  13.290  -7.496
  159   2HO*    C  15          2HO*        C  15   3.960  14.270  -6.272
  160    H1*    C  15           H1*        C  15   2.412  15.084  -5.429
  161   1H4     C  15          1H4         C  15  -4.119  15.225  -5.363
  162   2H4     C  15          2H4         C  15  -3.900  13.497  -5.195
  163    H5     C  15           H5         C  15  -1.711  12.451  -5.376
  164    H6     C  15           H6         C  15   0.657  12.855  -5.754
  165   1H5*    G  16          1H5*        G  16   4.971  13.862 -11.123
  166   2H5*    G  16          2H5*        G  16   5.007  13.093 -12.721
  167    H4*    G  16           H4*        G  16   4.861  10.930 -11.800
  168    H3*    G  16           H3*        G  16   4.004  12.228  -9.247
  169    H2*    G  16           H2*        G  16   5.260  10.650  -7.953
  170   2HO*    G  16          2HO*        G  16   4.778   8.746  -9.049
  171    H1*    G  16           H1*        G  16   7.524  10.580  -9.603
  172    H8     G  16           H8         G  16   5.358  13.522  -8.292
  173    H1     G  16           H1         G  16  11.468  13.360  -6.352
  174   1H2     G  16          1H2         G  16  12.510  11.654  -7.257
  175   2H2     G  16          2H2         G  16  11.701  10.534  -8.331
  176   1H5*    U  17          1H5*        U  17   2.104   9.692  -6.227
  177   2H5*    U  17          2H5*        U  17   1.238  11.219  -5.995
  178    H4*    U  17           H4*        U  17   4.222  11.158  -6.143
  179    H3*    U  17           H3*        U  17   3.111   9.596  -4.250
  180    H2*    U  17           H2*        U  17   1.776  11.206  -3.149
  181   2HO*    U  17          2HO*        U  17   4.287  11.947  -2.042
  182    H1*    U  17           H1*        U  17   3.948  13.319  -3.524
  183    H3     U  17           H3         U  17   1.453  16.993  -3.116
  184    H5     U  17           H5         U  17  -1.374  13.953  -3.000
  185    H6     U  17           H6         U  17   0.396  12.390  -3.503
  186   1H5*    C  18          1H5*        C  18   5.215  14.598  -3.026
  187   2H5*    C  18          2H5*        C  18   6.862  13.979  -2.793
  188    H4*    C  18           H4*        C  18   6.507  13.649  -0.502
  189    H3*    C  18           H3*        C  18   3.934  13.069  -0.733
  190    H2*    C  18           H2*        C  18   3.113  15.236  -1.315
  191   2HO*    C  18          2HO*        C  18   1.980  15.128   0.525
  192    H1*    C  18           H1*        C  18   4.994  16.609   0.654
  193   1H4     C  18          1H4         C  18   4.384  21.292  -3.715
  194   2H4     C  18          2H4         C  18   2.724  20.769  -3.900
  195    H5     C  18           H5         C  18   1.869  18.729  -2.869
  196    H6     C  18           H6         C  18   2.418  16.884  -1.403
  197   1H5*    G  19          1H5*        G  19   3.186  14.421   1.939
  198   2H5*    G  19          2H5*        G  19   2.462  14.175   3.537
  199    H4*    G  19           H4*        G  19   0.815  14.964   1.993
  200    H3*    G  19           H3*        G  19   0.403  12.187   2.971
  201    H2*    G  19           H2*        G  19  -1.137  11.690   1.332
  202   2HO*    G  19          2HO*        G  19  -2.568  13.289   2.310
  203    H1*    G  19           H1*        G  19  -0.549  14.208  -0.269
  204    H8     G  19           H8         G  19   1.642  11.223  -0.849
  205    H1     G  19           H1         G  19  -3.841  11.430  -4.171
  206   1H2     G  19          1H2         G  19  -5.061  12.785  -3.473
  207   2H2     G  19          2H2         G  19  -4.882  13.885  -2.193
  208   1H5*    C  20          1H5*        C  20  -3.129  14.826   3.560
  209   2H5*    C  20          2H5*        C  20  -3.828  14.446   5.142
  210    H4*    C  20           H4*        C  20  -5.661  14.602   3.771
  211    H3*    C  20           H3*        C  20  -5.012  11.656   3.909
  212    H2*    C  20           H2*        C  20  -6.966  11.314   2.551
  213   2HO*    C  20          2HO*        C  20  -7.740  13.568   3.810
  214    H1*    C  20           H1*        C  20  -6.528  13.660   0.970
  215   1H4     C  20          1H4         C  20  -4.841   9.045  -2.889
  216   2H4     C  20          2H4         C  20  -3.358   8.697  -2.240
  217    H5     C  20           H5         C  20  -2.769   9.975   0.023
  218    H6     C  20           H6         C  20  -3.576  11.646   1.610
  219   1H5*    C  21          1H5*        C  21  -8.958  12.023   4.431
  220   2H5*    C  21          2H5*        C  21  -9.571  11.073   5.798
  221    H4*    C  21           H4*        C  21 -10.913  10.519   3.952
  222    H3*    C  21           H3*        C  21  -8.925   8.306   4.455
  223    H2*    C  21           H2*        C  21  -9.953   7.106   2.648
  224   2HO*    C  21          2HO*        C  21 -12.098   8.503   3.463
  225    H1*    C  21           H1*        C  21 -10.371   9.427   1.037
  226   1H4     C  21          1H4         C  21  -5.482   6.410  -1.522
  227   2H4     C  21          2H4         C  21  -4.288   7.003  -0.541
  228    H5     C  21           H5         C  21  -5.134   8.496   1.497
  229    H6     C  21           H6         C  21  -7.119   9.414   2.576
  230   1H5*    C  22          1H5*        C  22 -12.611   6.602   3.975
  231   2H5*    C  22          2H5*        C  22 -12.989   5.487   5.302
  232    H4*    C  22           H4*        C  22 -13.452   4.308   3.336
  233    H3*    C  22           H3*        C  22 -10.869   3.430   4.580
  234    H2*    C  22           H2*        C  22 -10.437   1.977   2.751
  235   2HO*    C  22          2HO*        C  22 -12.639   1.149   2.735
  236    H1*    C  22           H1*        C  22 -11.506   3.623   0.720
  237   1H4     C  22          1H4         C  22  -5.275   4.196   0.261
  238   2H4     C  22          2H4         C  22  -5.017   5.192   1.562
  239    H5     C  22           H5         C  22  -7.159   5.655   3.076
  240    H6     C  22           H6         C  22  -9.546   5.267   3.281
  241   1H5*    C  23          1H5*        C  23 -13.077  -0.600   3.183
  242   2H5*    C  23          2H5*        C  23 -12.060  -1.687   4.148
  243    H4*    C  23           H4*        C  23 -12.006  -1.632   1.492
  244    H3*    C  23           H3*        C  23  -9.779  -2.229   3.402
  245    H2*    C  23           H2*        C  23  -8.219  -2.376   1.592
  246   2HO*    C  23          2HO*        C  23  -9.432  -3.366  -0.036
  247    H1*    C  23           H1*        C  23  -9.095  -0.071   0.310
  248   1H4     C  23          1H4         C  23  -4.489   1.800   4.278
  249   2H4     C  23          2H4         C  23  -5.694   2.171   5.492
  250    H5     C  23           H5         C  23  -8.042   1.626   5.211
  251    H6     C  23           H6         C  23  -9.690   0.623   3.718
  252   1H5*    G  24          1H5*        G  24  -9.312  -6.612   0.558
  253   2H5*    G  24          2H5*        G  24  -9.019  -5.404   1.824
  254    H4*    G  24           H4*        G  24  -7.859  -5.167  -0.936
  255    H3*    G  24           H3*        G  24  -7.069  -7.305   0.441
  256    H2*    G  24           H2*        G  24  -6.487  -6.273   2.523
  257   2HO*    G  24          2HO*        G  24  -4.389  -6.526   0.778
  258    H1*    G  24           H1*        G  24  -5.237  -3.864   1.138
  259    H8     G  24           H8         G  24  -8.442  -4.095   3.212
  260    H1     G  24           H1         G  24  -3.462  -1.358   6.175
  261   1H2     G  24          1H2         G  24  -1.658  -1.502   4.933
  262   2H2     G  24          2H2         G  24  -1.673  -2.275   3.366
  263   1H5*    A  25          1H5*        A  25  -4.949  -9.923  -2.852
  264   2H5*    A  25          2H5*        A  25  -3.931 -10.510  -1.523
  265    H4*    A  25           H4*        A  25  -3.163  -9.182  -3.908
  266    H3*    A  25           H3*        A  25  -1.681 -10.399  -1.607
  267    H2*    A  25           H2*        A  25   0.297  -9.183  -2.202
  268   2HO*    A  25          2HO*        A  25   0.332  -9.462  -4.404
  269    H1*    A  25           H1*        A  25  -0.996  -6.789  -2.931
  270    H8     A  25           H8         A  25  -2.658  -7.844   0.202
  271   1H6     A  25          1H6         A  25   1.863  -4.914   3.214
  272   2H6     A  25          2H6         A  25   0.266  -5.632   3.366
  273    H2     A  25           H2         A  25   3.189  -5.501  -1.006
  274   1H5*    G  26          1H5*        G  26   2.738 -12.024  -4.277
  275   2H5*    G  26          2H5*        G  26   2.153 -12.358  -2.635
  276    H4*    G  26           H4*        G  26   3.590 -10.024  -3.716
  277    H3*    G  26           H3*        G  26   3.579 -11.549  -1.142
  278    H2*    G  26           H2*        G  26   4.258  -9.615   0.071
  279   2HO*    G  26          2HO*        G  26   4.509  -8.267  -2.432
  280    H1*    G  26           H1*        G  26   2.529  -7.856  -1.200
  281    H8     G  26           H8         G  26   0.297 -10.647  -1.038
  282    H1     G  26           H1         G  26   1.433  -8.220   4.760
  283   1H2     G  26          1H2         G  26   3.043  -7.142   4.840
  284   2H2     G  26          2H2         G  26   4.171  -6.697   3.677
  285   1H5*    C  27          1H5*        C  27   7.161  -7.553  -2.433
  286   2H5*    C  27          2H5*        C  27   8.569  -8.515  -2.923
  287    H4*    C  27           H4*        C  27   9.281  -7.127  -1.164
  288    H3*    C  27           H3*        C  27   8.935  -9.980  -0.306
  289    H2*    C  27           H2*        C  27   9.553  -9.378   1.934
  290   2HO*    C  27          2HO*        C  27  10.932  -7.503   0.670
  291    H1*    C  27           H1*        C  27   8.031  -7.042   2.051
  292   1H4     C  27          1H4         C  27   4.186 -11.372   4.486
  293   2H4     C  27          2H4         C  27   3.679 -12.076   3.068
  294    H5     C  27           H5         C  27   4.948 -11.276   0.886
  295    H6     C  27           H6         C  27   6.594  -9.701   0.021
  296   1H5*    G  28          1H5*        G  28  12.194  -8.639   1.449
  297   2H5*    G  28          2H5*        G  28  13.633  -9.647   1.199
  298    H4*    G  28           H4*        G  28  13.513  -9.341   3.503
  299    H3*    G  28           H3*        G  28  12.420 -12.050   2.777
  300    H2*    G  28           H2*        G  28  12.014 -12.448   5.117
  301   2HO*    G  28          2HO*        G  28  13.438 -11.587   6.441
  302    H1*    G  28           H1*        G  28  10.966  -9.908   5.634
  303    H8     G  28           H8         G  28   9.790 -11.130   2.273
  304    H1     G  28           H1         G  28   6.328 -13.228   7.254
  305   1H2     G  28          1H2         G  28   7.359 -12.824   9.122
  306   2H2     G  28          2H2         G  28   8.917 -12.028   9.171
  307   1H5*    C  29          1H5*        C  29  14.734 -12.697   6.041
  308   2H5*    C  29          2H5*        C  29  16.014 -13.866   5.663
  309    H4*    C  29           H4*        C  29  15.111 -14.641   7.649
  310    H3*    C  29           H3*        C  29  14.049 -16.196   5.321
  311    H2*    C  29           H2*        C  29  12.632 -17.463   6.777
  312   2HO*    C  29          2HO*        C  29  13.086 -17.709   8.873
  313    H1*    C  29           H1*        C  29  11.847 -15.311   8.404
  314   1H4     C  29          1H4         C  29   7.102 -15.686   4.309
  315   2H4     C  29          2H4         C  29   7.751 -14.737   3.124
  316    H5     C  29           H5         C  29  10.271 -13.954   3.528
  317    H6     C  29           H6         C  29  12.190 -14.194   5.017
  318   1H5*    C  30          1H5*        C  30  14.715 -18.952   8.093
  319   2H5*    C  30          2H5*        C  30  16.041 -20.036   7.626
  320    H4*    C  30           H4*        C  30  14.389 -21.458   8.429
  321    H3*    C  30           H3*        C  30  14.403 -21.402   5.431
  322    H2*    C  30           H2*        C  30  12.522 -22.847   5.356
  323   2HO*    C  30          2HO*        C  30  11.792 -23.883   7.341
  324    H1*    C  30           H1*        C  30  11.139 -21.719   7.542
  325   1H4     C  30          1H4         C  30   8.457 -19.332   2.386
  326   2H4     C  30          2H4         C  30   9.723 -18.421   1.833
  327    H5     C  30           H5         C  30  11.986 -18.643   3.210
  328    H6     C  30           H6         C  30  13.005 -19.632   5.176
  329    H3T    C  30           H3T        C  30  14.831 -23.592   7.061
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  -4.433 -14.356  -0.599
    2   2H5*    G   1          2H5*        G   1  -4.738 -12.927   0.405
    3    H4*    G   1           H4*        G   1  -5.366 -14.775   1.693
    4    H3*    G   1           H3*        G   1  -2.760 -13.597   2.583
    5    H2*    G   1           H2*        G   1  -2.554 -15.304   4.268
    6   2HO*    G   1          2HO*        G   1  -5.214 -15.305   4.085
    7    H1*    G   1           H1*        G   1  -3.235 -17.422   2.611
    8    H8     G   1           H8         G   1  -1.303 -14.521   1.000
    9    H1     G   1           H1         G   1   2.179 -19.456   3.129
   10   1H2     G   1          1H2         G   1   1.142 -20.746   4.100
   11   2H2     G   1          2H2         G   1  -0.492 -20.810   4.506
   12    H5T    G   1           H5T        G   1  -2.528 -12.843   0.884
   13   1H5*    G   2          1H5*        G   2  -4.714 -14.629   5.922
   14   2H5*    G   2          2H5*        G   2  -5.018 -13.215   6.951
   15    H4*    G   2           H4*        G   2  -4.176 -14.797   8.413
   16    H3*    G   2           H3*        G   2  -2.024 -12.874   7.596
   17    H2*    G   2           H2*        G   2  -0.465 -14.059   8.998
   18   2HO*    G   2          2HO*        G   2  -2.661 -14.660  10.342
   19    H1*    G   2           H1*        G   2  -1.225 -16.598   8.142
   20    H8     G   2           H8         G   2  -1.300 -13.738   5.587
   21    H1     G   2           H1         G   2   4.045 -17.265   5.745
   22   1H2     G   2          1H2         G   2   4.077 -18.532   7.162
   23   2H2     G   2          2H2         G   2   2.981 -18.918   8.376
   24   1H5*    U   3          1H5*        U   3  -1.630 -13.369  11.459
   25   2H5*    U   3          2H5*        U   3  -1.692 -11.865  12.401
   26    H4*    U   3           H4*        U   3   0.218 -12.930  13.162
   27    H3*    U   3           H3*        U   3   0.876 -10.776  11.195
   28    H2*    U   3           H2*        U   3   3.209 -11.334  11.321
   29   2HO*    U   3          2HO*        U   3   2.522 -12.143  13.742
   30    H1*    U   3           H1*        U   3   2.876 -14.081  11.143
   31    H3     U   3           H3         U   3   4.085 -13.466   6.872
   32    H5     U   3           H5         U   3   0.352 -11.590   7.092
   33    H6     U   3           H6         U   3   0.372 -11.984   9.465
   34   1H5*    G   4          1H5*        G   4   3.518 -10.375  14.336
   35   2H5*    G   4          2H5*        G   4   3.613  -8.694  14.899
   36    H4*    G   4           H4*        G   4   5.821  -9.355  14.509
   37    H3*    G   4           H3*        G   4   4.803  -7.607  12.295
   38    H2*    G   4           H2*        G   4   6.883  -7.874  11.122
   39   2HO*    G   4          2HO*        G   4   8.656  -8.224  12.225
   40    H1*    G   4           H1*        G   4   7.072 -10.628  11.518
   41    H8     G   4           H8         G   4   3.486  -9.490  11.067
   42    H1     G   4           H1         G   4   6.691 -10.741   5.679
   43   1H2     G   4          1H2         G   4   8.573 -11.001   5.963
   44   2H2     G   4          2H2         G   4   9.542 -10.918   7.338
   45   1H5*    C   5          1H5*        C   5   8.447  -6.620  13.098
   46   2H5*    C   5          2H5*        C   5   8.914  -4.909  13.148
   47    H4*    C   5           H4*        C   5  10.282  -6.027  11.549
   48    H3*    C   5           H3*        C   5   8.294  -4.100  10.404
   49    H2*    C   5           H2*        C   5   8.910  -4.707   8.187
   50   2HO*    C   5          2HO*        C   5  11.284  -5.197   9.447
   51    H1*    C   5           H1*        C   5   9.433  -7.451   8.712
   52   1H4     C   5          1H4         C   5   3.929  -7.793   5.756
   53   2H4     C   5          2H4         C   5   2.955  -7.435   7.044
   54    H5     C   5           H5         C   5   4.205  -6.652   9.257
   55    H6     C   5           H6         C   5   6.404  -6.207  10.229
   56   1H5*    G   6          1H5*        G   6   9.400  -1.200   7.285
   57   2H5*    G   6          2H5*        G   6   8.205  -2.090   8.243
   58    H4*    G   6           H4*        G   6   9.635  -3.302   5.893
   59    H3*    G   6           H3*        G   6   7.369  -1.396   5.798
   60    H2*    G   6           H2*        G   6   5.983  -2.834   4.500
   61   2HO*    G   6          2HO*        G   6   8.083  -3.444   3.287
   62    H1*    G   6           H1*        G   6   6.592  -5.248   5.727
   63    H8     G   6           H8         G   6   6.602  -2.880   8.499
   64    H1     G   6           H1         G   6   0.654  -4.392   6.683
   65   1H2     G   6          1H2         G   6   0.669  -5.327   4.685
   66   2H2     G   6          2H2         G   6   2.166  -5.587   3.837
   67   1H5*    A   7          1H5*        A   7   8.107   1.618   2.277
   68   2H5*    A   7          2H5*        A   7   7.404   0.421   3.382
   69    H4*    A   7           H4*        A   7   9.030  -0.500   1.053
   70    H3*    A   7           H3*        A   7   6.323   0.744   0.821
   71    H2*    A   7           H2*        A   7   5.514  -1.051  -0.482
   72   2HO*    A   7          2HO*        A   7   6.839  -2.373  -1.654
   73    H1*    A   7           H1*        A   7   6.904  -3.145   0.805
   74    H8     A   7           H8         A   7   5.503  -1.291   3.587
   75   1H6     A   7          1H6         A   7  -0.084  -3.526   2.117
   76   2H6     A   7          2H6         A   7   0.839  -2.697   3.352
   77    H2     A   7           H2         A   7   2.673  -4.335  -1.294
   78   1H5*    A   8          1H5*        A   8   5.603   1.376  -3.967
   79   2H5*    A   8          2H5*        A   8   4.196   1.816  -2.980
   80    H4*    A   8           H4*        A   8   4.890  -0.735  -4.301
   81    H3*    A   8           H3*        A   8   2.401   0.871  -3.911
   82    H2*    A   8           H2*        A   8   1.059  -1.121  -3.856
   83   2HO*    A   8          2HO*        A   8   2.049  -3.169  -4.349
   84    H1*    A   8           H1*        A   8   2.757  -2.623  -2.246
   85    H8     A   8           H8         A   8   3.271   0.456  -0.526
   86   1H6     A   8          1H6         A   8  -2.421  -0.022   1.869
   87   2H6     A   8          2H6         A   8  -0.976   0.876   2.143
   88    H2     A   8           H2         A   8  -2.189  -2.792  -1.474
   89   1H5*    G   9          1H5*        G   9   1.276  -1.862  -6.502
   90   2H5*    G   9          2H5*        G   9   0.267  -1.224  -7.815
   91    H4*    G   9           H4*        G   9  -0.897  -2.909  -6.496
   92    H3*    G   9           H3*        G   9  -2.005  -0.141  -6.627
   93    H2*    G   9           H2*        G   9  -3.720  -0.683  -5.030
   94   2HO*    G   9          2HO*        G   9  -3.427  -3.085  -6.092
   95    H1*    G   9           H1*        G   9  -2.126  -2.101  -3.275
   96    H8     G   9           H8         G   9   0.248   0.440  -4.311
   97    H1     G   9           H1         G   9  -4.230   2.799  -0.398
   98   1H2     G   9          1H2         G   9  -5.755   1.658  -0.191
   99   2H2     G   9          2H2         G   9  -6.159   0.168  -0.854
  100   1H5*    G  10          1H5*        G  10  -5.092  -2.340  -7.466
  101   2H5*    G  10          2H5*        G  10  -5.996  -2.125  -8.978
  102    H4*    G  10           H4*        G  10  -7.638  -1.828  -7.418
  103    H3*    G  10           H3*        G  10  -6.561   0.888  -8.109
  104    H2*    G  10           H2*        G  10  -8.069   1.860  -6.495
  105   2HO*    G  10          2HO*        G  10  -9.087  -0.733  -5.944
  106    H1*    G  10           H1*        G  10  -7.512   0.033  -4.481
  107    H8     G  10           H8         G  10  -4.291   0.402  -6.237
  108    H1     G  10           H1         G  10  -5.674   5.373  -2.453
  109   1H2     G  10          1H2         G  10  -7.476   5.368  -1.821
  110   2H2     G  10          2H2         G  10  -8.781   4.341  -2.089
  111   1H5*    G  11          1H5*        G  11 -10.748   1.185  -8.312
  112   2H5*    G  11          2H5*        G  11 -11.245   1.972  -9.823
  113    H4*    G  11           H4*        G  11 -12.355   3.074  -8.054
  114    H3*    G  11           H3*        G  11 -10.138   4.707  -9.234
  115    H2*    G  11           H2*        G  11 -10.560   6.446  -7.627
  116   2HO*    G  11          2HO*        G  11 -12.957   5.046  -7.389
  117    H1*    G  11           H1*        G  11 -10.711   4.773  -5.440
  118    H8     G  11           H8         G  11  -8.232   3.145  -7.664
  119    H1     G  11           H1         G  11  -5.927   8.168  -4.452
  120   1H2     G  11          1H2         G  11  -7.293   9.240  -3.648
  121   2H2     G  11          2H2         G  11  -8.973   9.125  -3.635
  122   1H5*    C  12          1H5*        C  12 -13.105   7.118  -8.375
  123   2H5*    C  12          2H5*        C  12 -13.657   8.140  -9.716
  124    H4*    C  12           H4*        C  12 -13.381   9.604  -7.931
  125    H3*    C  12           H3*        C  12 -10.990   9.789  -9.750
  126    H2*    C  12           H2*        C  12 -10.114  11.507  -8.293
  127   2HO*    C  12          2HO*        C  12 -12.700  11.832  -7.724
  128    H1*    C  12           H1*        C  12 -10.629  10.094  -5.943
  129   1H4     C  12          1H4         C  12  -4.786   8.525  -7.683
  130   2H4     C  12          2H4         C  12  -5.167   7.259  -8.680
  131    H5     C  12           H5         C  12  -7.772   6.852  -9.049
  132    H6     C  12           H6         C  12  -9.988   7.733  -8.548
  133   1H5*    G  13          1H5*        G  13 -11.851  13.186  -8.747
  134   2H5*    G  13          2H5*        G  13 -11.935  14.534  -9.896
  135    H4*    G  13           H4*        G  13 -10.384  15.109  -8.197
  136    H3*    G  13           H3*        G  13  -9.009  14.439 -10.796
  137    H2*    G  13           H2*        G  13  -6.954  15.131  -9.721
  138   2HO*    G  13          2HO*        G  13  -8.682  16.505  -8.169
  139    H1*    G  13           H1*        G  13  -7.475  13.695  -7.371
  140    H8     G  13           H8         G  13  -8.743  11.779 -10.323
  141    H1     G  13           H1         G  13  -2.473  11.012  -9.294
  142   1H2     G  13          1H2         G  13  -1.741  12.535  -7.871
  143   2H2     G  13          2H2         G  13  -2.813  13.722  -7.161
  144   1H5*    U  14          1H5*        U  14  -7.445  17.289  -9.088
  145   2H5*    U  14          2H5*        U  14  -7.659  18.891  -9.814
  146    H4*    U  14           H4*        U  14  -5.495  18.734  -8.832
  147    H3*    U  14           H3*        U  14  -5.849  19.638 -11.386
  148    H2*    U  14           H2*        U  14  -4.981  17.783 -12.580
  149   2HO*    U  14          2HO*        U  14  -2.510  18.000 -12.442
  150    H1*    U  14           H1*        U  14  -2.977  17.160 -10.352
  151    H3     U  14           H3         U  14  -2.297  14.229 -13.948
  152    H5     U  14           H5         U  14  -5.423  12.724 -11.595
  153    H6     U  14           H6         U  14  -5.418  14.806 -10.387
  154   1H5*    C  15          1H5*        C  15  -4.926  21.067  -7.494
  155   2H5*    C  15          2H5*        C  15  -5.029  22.823  -7.263
  156    H4*    C  15           H4*        C  15  -3.142  22.905  -6.112
  157    H3*    C  15           H3*        C  15  -1.980  21.445  -8.403
  158    H2*    C  15           H2*        C  15  -0.350  20.297  -7.121
  159   2HO*    C  15          2HO*        C  15   0.579  21.424  -5.579
  160    H1*    C  15           H1*        C  15  -1.855  19.760  -4.836
  161   1H4     C  15          1H4         C  15  -4.198  15.042  -8.633
  162   2H4     C  15          2H4         C  15  -2.490  14.764  -8.919
  163    H5     C  15           H5         C  15  -0.776  16.282  -8.152
  164    H6     C  15           H6         C  15  -0.332  18.341  -6.931
  165   1H5*    G  16          1H5*        G  16  -0.931  25.340  -7.025
  166   2H5*    G  16          2H5*        G  16   0.076  26.641  -7.689
  167    H4*    G  16           H4*        G  16   2.033  25.771  -6.699
  168    H3*    G  16           H3*        G  16   0.524  23.229  -6.280
  169    H2*    G  16           H2*        G  16   1.513  22.905  -4.123
  170   2HO*    G  16          2HO*        G  16   3.540  24.180  -5.248
  171    H1*    G  16           H1*        G  16   1.375  25.563  -3.265
  172    H8     G  16           H8         G  16  -0.857  22.790  -4.689
  173    H1     G  16           H1         G  16  -3.418  26.259   0.055
  174   1H2     G  16          1H2         G  16  -2.090  27.942   0.570
  175   2H2     G  16          2H2         G  16  -0.576  28.212  -0.261
  176   1H5*    U  17          1H5*        U  17   2.188  19.380  -6.865
  177   2H5*    U  17          2H5*        U  17   0.696  19.500  -5.916
  178    H4*    U  17           H4*        U  17   3.227  19.651  -4.428
  179    H3*    U  17           H3*        U  17   3.304  17.623  -6.181
  180    H2*    U  17           H2*        U  17   1.274  16.523  -5.651
  181   2HO*    U  17          2HO*        U  17   3.205  15.750  -3.733
  182    H1*    U  17           H1*        U  17   1.617  17.076  -2.681
  183    H3     U  17           H3         U  17  -2.749  17.364  -1.545
  184    H5     U  17           H5         U  17  -2.766  15.937  -5.498
  185    H6     U  17           H6         U  17  -0.390  16.350  -5.562
  186   1H5*    C  18          1H5*        C  18   6.512  15.035  -5.817
  187   2H5*    C  18          2H5*        C  18   5.771  14.995  -7.430
  188    H4*    C  18           H4*        C  18   4.335  15.228  -4.811
  189    H3*    C  18           H3*        C  18   5.059  12.842  -6.125
  190    H2*    C  18           H2*        C  18   3.160  12.630  -7.438
  191   2HO*    C  18          2HO*        C  18   1.947  12.589  -4.869
  192    H1*    C  18           H1*        C  18   1.636  14.628  -5.702
  193   1H4     C  18          1H4         C  18  -0.568  15.680 -11.764
  194   2H4     C  18          2H4         C  18  -1.151  14.041 -11.571
  195    H5     C  18           H5         C  18  -0.538  12.663  -9.660
  196    H6     C  18           H6         C  18   0.642  12.595  -7.571
  197   1H5*    G  19          1H5*        G  19   2.889  13.979  -3.676
  198   2H5*    G  19          2H5*        G  19   2.584  13.907  -1.933
  199    H4*    G  19           H4*        G  19   0.765  14.887  -3.070
  200    H3*    G  19           H3*        G  19   0.311  12.314  -1.692
  201    H2*    G  19           H2*        G  19  -1.600  11.762  -2.830
  202   2HO*    G  19          2HO*        G  19  -2.630  13.585  -1.710
  203    H1*    G  19           H1*        G  19  -1.418  14.010  -4.814
  204    H8     G  19           H8         G  19   0.817  11.458  -5.808
  205    H1     G  19           H1         G  19  -5.214   9.651  -6.933
  206   1H2     G  19          1H2         G  19  -6.513  10.758  -6.057
  207   2H2     G  19          2H2         G  19  -6.376  12.093  -5.046
  208   1H5*    C  20          1H5*        C  20  -2.955  15.079  -0.709
  209   2H5*    C  20          2H5*        C  20  -3.159  15.044   1.053
  210    H4*    C  20           H4*        C  20  -5.314  14.880   0.282
  211    H3*    C  20           H3*        C  20  -4.348  12.080   0.825
  212    H2*    C  20           H2*        C  20  -6.558  11.320   0.228
  213   2HO*    C  20          2HO*        C  20  -7.305  13.615   1.163
  214    H1*    C  20           H1*        C  20  -6.749  12.986  -2.028
  215   1H4     C  20          1H4         C  20  -4.661   7.530  -4.344
  216   2H4     C  20          2H4         C  20  -3.040   7.810  -4.163
  217    H5     C  20           H5         C  20  -2.421   9.980  -2.747
  218    H6     C  20           H6         C  20  -3.351  11.938  -1.627
  219   1H5*    C  21          1H5*        C  21  -7.888  12.160   2.380
  220   2H5*    C  21          2H5*        C  21  -7.961  11.573   4.053
  221    H4*    C  21           H4*        C  21  -9.571  10.356   2.848
  222    H3*    C  21           H3*        C  21  -7.124   8.667   3.341
  223    H2*    C  21           H2*        C  21  -8.243   6.856   2.229
  224   2HO*    C  21          2HO*        C  21 -10.380   6.742   2.184
  225    H1*    C  21           H1*        C  21  -9.346   8.476   0.185
  226   1H4     C  21          1H4         C  21  -4.279   5.627  -2.233
  227   2H4     C  21          2H4         C  21  -3.154   6.780  -1.837
  228    H5     C  21           H5         C  21  -4.055   8.762  -0.305
  229    H6     C  21           H6         C  21  -6.028   9.625   0.840
  230   1H5*    C  22          1H5*        C  22 -10.314   6.405   4.064
  231   2H5*    C  22          2H5*        C  22 -10.349   5.803   5.733
  232    H4*    C  22           H4*        C  22 -10.869   3.943   4.451
  233    H3*    C  22           H3*        C  22  -7.987   3.868   5.273
  234    H2*    C  22           H2*        C  22  -7.630   1.906   3.973
  235   2HO*    C  22          2HO*        C  22 -10.193   1.482   4.605
  236    H1*    C  22           H1*        C  22  -9.244   2.621   1.794
  237   1H4     C  22          1H4         C  22  -3.338   3.815   0.058
  238   2H4     C  22          2H4         C  22  -3.112   5.235   0.883
  239    H5     C  22           H5         C  22  -5.100   5.915   2.522
  240    H6     C  22           H6         C  22  -7.329   5.314   3.266
  241   1H5*    C  23          1H5*        C  23  -9.677  -0.399   5.507
  242   2H5*    C  23          2H5*        C  23  -8.480  -1.202   6.541
  243    H4*    C  23           H4*        C  23  -8.786  -1.823   3.997
  244    H3*    C  23           H3*        C  23  -6.307  -1.887   5.657
  245    H2*    C  23           H2*        C  23  -4.934  -2.267   3.730
  246   2HO*    C  23          2HO*        C  23  -5.983  -2.667   1.665
  247    H1*    C  23           H1*        C  23  -6.222  -0.495   2.003
  248   1H4     C  23          1H4         C  23  -1.412   2.856   4.428
  249   2H4     C  23          2H4         C  23  -2.489   3.502   5.647
  250    H5     C  23           H5         C  23  -4.775   2.713   5.920
  251    H6     C  23           H6         C  23  -6.443   1.131   5.115
  252   1H5*    G  24          1H5*        G  24  -6.035  -4.593   2.833
  253   2H5*    G  24          2H5*        G  24  -5.348  -6.161   3.300
  254    H4*    G  24           H4*        G  24  -4.190  -4.729   1.490
  255    H3*    G  24           H3*        G  24  -3.212  -6.786   2.891
  256    H2*    G  24           H2*        G  24  -2.370  -5.616   4.800
  257   2HO*    G  24          2HO*        G  24  -0.541  -6.070   2.855
  258    H1*    G  24           H1*        G  24  -1.368  -3.302   3.079
  259    H8     G  24           H8         G  24  -4.217  -3.325   5.601
  260    H1     G  24           H1         G  24   1.152  -0.487   7.648
  261   1H2     G  24          1H2         G  24   2.764  -0.740   6.183
  262   2H2     G  24          2H2         G  24   2.518  -1.612   4.687
  263   1H5*    A  25          1H5*        A  25  -0.819  -9.435   0.550
  264   2H5*    A  25          2H5*        A  25  -0.435  -7.766   1.005
  265    H4*    A  25           H4*        A  25  -0.822  -8.387  -1.878
  266    H3*    A  25           H3*        A  25   1.330  -9.643  -0.309
  267    H2*    A  25           H2*        A  25   3.130  -8.681  -1.555
  268   2HO*    A  25          2HO*        A  25   1.497  -9.020  -3.527
  269    H1*    A  25           H1*        A  25   2.086  -6.149  -1.981
  270    H8     A  25           H8         A  25   0.815  -6.471   1.332
  271   1H6     A  25          1H6         A  25   6.407  -5.199   3.607
  272   2H6     A  25          2H6         A  25   4.696  -5.307   3.974
  273    H2     A  25           H2         A  25   6.918  -6.410  -0.662
  274   1H5*    G  26          1H5*        G  26   3.882 -11.567  -3.690
  275   2H5*    G  26          2H5*        G  26   4.091 -12.847  -2.478
  276    H4*    G  26           H4*        G  26   6.055 -11.228  -3.079
  277    H3*    G  26           H3*        G  26   5.336 -12.276  -0.371
  278    H2*    G  26           H2*        G  26   7.059 -10.938   0.636
  279   2HO*    G  26          2HO*        G  26   8.754 -10.907  -0.792
  280    H1*    G  26           H1*        G  26   6.398  -8.623  -0.690
  281    H8     G  26           H8         G  26   3.100 -10.087  -0.407
  282    H1     G  26           H1         G  26   5.234  -7.955   5.224
  283   1H2     G  26          1H2         G  26   7.151  -7.723   5.272
  284   2H2     G  26          2H2         G  26   8.359  -7.950   4.128
  285   1H5*    C  27          1H5*        C  27  10.754 -11.133  -1.383
  286   2H5*    C  27          2H5*        C  27  11.027 -12.820  -1.862
  287    H4*    C  27           H4*        C  27  12.426 -12.375  -0.009
  288    H3*    C  27           H3*        C  27  10.095 -14.138   0.661
  289    H2*    C  27           H2*        C  27  10.779 -14.188   2.959
  290   2HO*    C  27          2HO*        C  27  13.173 -13.891   1.878
  291    H1*    C  27           H1*        C  27  11.436 -11.474   3.151
  292   1H4     C  27          1H4         C  27   5.535 -11.540   5.280
  293   2H4     C  27          2H4         C  27   4.745 -11.758   3.833
  294    H5     C  27           H5         C  27   6.296 -12.238   1.749
  295    H6     C  27           H6         C  27   8.611 -12.368   0.992
  296   1H5*    G  28          1H5*        G  28  13.262 -15.676   2.654
  297   2H5*    G  28          2H5*        G  28  13.509 -17.390   2.268
  298    H4*    G  28           H4*        G  28  13.511 -17.321   4.587
  299    H3*    G  28           H3*        G  28  10.835 -18.234   3.580
  300    H2*    G  28           H2*        G  28  10.054 -18.389   5.846
  301   2HO*    G  28          2HO*        G  28  12.560 -18.951   6.328
  302    H1*    G  28           H1*        G  28  11.235 -16.000   6.714
  303    H8     G  28           H8         G  28   9.777 -15.730   3.230
  304    H1     G  28           H1         G  28   5.694 -14.407   8.004
  305   1H2     G  28          1H2         G  28   6.544 -15.022   9.920
  306   2H2     G  28          2H2         G  28   8.132 -15.749  10.042
  307   1H5*    C  29          1H5*        C  29  11.508 -20.813   6.632
  308   2H5*    C  29          2H5*        C  29  11.554 -22.473   6.004
  309    H4*    C  29           H4*        C  29  10.085 -22.624   7.771
  310    H3*    C  29           H3*        C  29   8.604 -22.373   5.183
  311    H2*    C  29           H2*        C  29   6.511 -22.351   6.349
  312   2HO*    C  29          2HO*        C  29   7.878 -23.857   8.052
  313    H1*    C  29           H1*        C  29   7.356 -20.725   8.489
  314   1H4     C  29          1H4         C  29   4.668 -16.453   4.780
  315   2H4     C  29          2H4         C  29   5.897 -16.224   3.713
  316    H5     C  29           H5         C  29   7.996 -17.871   4.032
  317    H6     C  29           H6         C  29   8.840 -19.752   5.340
  318   1H5*    C  30          1H5*        C  30   6.512 -25.338   7.056
  319   2H5*    C  30          2H5*        C  30   6.698 -26.847   6.139
  320    H4*    C  30           H4*        C  30   4.414 -26.694   6.523
  321    H3*    C  30           H3*        C  30   5.114 -25.794   3.750
  322    H2*    C  30           H2*        C  30   2.855 -25.216   3.318
  323   2HO*    C  30          2HO*        C  30   1.167 -25.945   4.684
  324    H1*    C  30           H1*        C  30   2.275 -24.176   5.882
  325   1H4     C  30          1H4         C  30   3.282 -19.112   2.310
  326   2H4     C  30          2H4         C  30   4.882 -19.345   1.964
  327    H5     C  30           H5         C  30   5.932 -21.624   2.864
  328    H6     C  30           H6         C  30   5.492 -23.604   4.198
  329    H3T    C  30           H3T        C  30   3.450 -27.885   4.423
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  -4.626 -13.832   1.309
    2   2H5*    G   1          2H5*        G   1  -5.085 -12.911   2.753
    3    H4*    G   1           H4*        G   1  -4.342 -15.008   3.503
    4    H3*    G   1           H3*        G   1  -2.320 -12.843   4.004
    5    H2*    G   1           H2*        G   1  -0.843 -14.463   4.963
    6   2HO*    G   1          2HO*        G   1  -1.748 -16.000   6.105
    7    H1*    G   1           H1*        G   1  -1.457 -16.537   3.127
    8    H8     G   1           H8         G   1  -0.765 -12.931   1.960
    9    H1     G   1           H1         G   1   4.088 -17.099   1.601
   10   1H2     G   1          1H2         G   1   3.692 -18.793   2.403
   11   2H2     G   1          2H2         G   1   2.310 -19.382   3.168
   12    H5T    G   1           H5T        G   1  -2.682 -12.700   1.252
   13   1H5*    G   2          1H5*        G   2  -2.617 -15.134   7.394
   14   2H5*    G   2          2H5*        G   2  -2.939 -14.130   8.821
   15    H4*    G   2           H4*        G   2  -1.176 -15.475   9.471
   16    H3*    G   2           H3*        G   2  -0.126 -12.783   8.641
   17    H2*    G   2           H2*        G   2   2.089 -13.542   9.207
   18   2HO*    G   2          2HO*        G   2   0.747 -15.045  10.913
   19    H1*    G   2           H1*        G   2   1.798 -16.074   8.031
   20    H8     G   2           H8         G   2   0.329 -12.954   6.320
   21    H1     G   2           H1         G   2   6.073 -14.935   4.287
   22   1H2     G   2          1H2         G   2   6.788 -16.367   5.310
   23   2H2     G   2          2H2         G   2   6.197 -17.226   6.632
   24   1H5*    U   3          1H5*        U   3   1.715 -13.809  11.960
   25   2H5*    U   3          2H5*        U   3   1.558 -12.629  13.278
   26    H4*    U   3           H4*        U   3   3.827 -13.066  13.189
   27    H3*    U   3           H3*        U   3   3.131 -10.501  11.838
   28    H2*    U   3           H2*        U   3   5.390 -10.179  11.122
   29   2HO*    U   3          2HO*        U   3   6.892 -10.865  12.446
   30    H1*    U   3           H1*        U   3   5.848 -12.794  10.295
   31    H3     U   3           H3         U   3   5.235 -11.257   6.154
   32    H5     U   3           H5         U   3   1.502 -10.620   7.955
   33    H6     U   3           H6         U   3   2.458 -11.361  10.034
   34   1H5*    G   4          1H5*        G   4   6.523  -9.820  13.931
   35   2H5*    G   4          2H5*        G   4   6.418  -8.363  14.940
   36    H4*    G   4           H4*        G   4   8.357  -8.095  13.664
   37    H3*    G   4           H3*        G   4   6.089  -6.438  12.613
   38    H2*    G   4           H2*        G   4   7.442  -5.718  10.770
   39   2HO*    G   4          2HO*        G   4   9.354  -5.975  12.575
   40    H1*    G   4           H1*        G   4   8.758  -8.192  10.368
   41    H8     G   4           H8         G   4   4.981  -8.344  10.872
   42    H1     G   4           H1         G   4   7.077  -8.107   4.832
   43   1H2     G   4          1H2         G   4   8.935  -7.728   4.688
   44   2H2     G   4          2H2         G   4  10.133  -7.408   5.822
   45   1H5*    C   5          1H5*        C   5   5.621  -2.676  11.912
   46   2H5*    C   5          2H5*        C   5   6.084  -4.312  11.415
   47    H4*    C   5           H4*        C   5   8.081  -2.195  10.934
   48    H3*    C   5           H3*        C   5   5.373  -1.976   9.737
   49    H2*    C   5           H2*        C   5   6.183  -1.881   7.515
   50   2HO*    C   5          2HO*        C   5   8.290  -0.747   8.743
   51    H1*    C   5           H1*        C   5   8.213  -3.771   7.708
   52   1H4     C   5          1H4         C   5   3.148  -6.897   5.548
   53   2H4     C   5          2H4         C   5   2.495  -7.260   7.020
   54    H5     C   5           H5         C   5   3.733  -6.232   9.134
   55    H6     C   5           H6         C   5   5.489  -4.691   9.818
   56   1H5*    G   6          1H5*        G   6   6.996   0.508   7.061
   57   2H5*    G   6          2H5*        G   6   5.690   1.642   6.665
   58    H4*    G   6           H4*        G   6   6.324  -0.209   4.987
   59    H3*    G   6           H3*        G   6   3.575   0.718   5.667
   60    H2*    G   6           H2*        G   6   2.568  -1.083   4.436
   61   2HO*    G   6          2HO*        G   6   4.672  -0.790   2.935
   62    H1*    G   6           H1*        G   6   4.275  -3.108   5.266
   63    H8     G   6           H8         G   6   3.854  -0.813   8.134
   64    H1     G   6           H1         G   6  -1.051  -4.868   7.430
   65   1H2     G   6          1H2         G   6  -1.032  -5.749   5.407
   66   2H2     G   6          2H2         G   6   0.222  -5.358   4.253
   67   1H5*    A   7          1H5*        A   7   6.353   1.928   2.691
   68   2H5*    A   7          2H5*        A   7   6.439   3.254   1.515
   69    H4*    A   7           H4*        A   7   6.118   1.386   0.197
   70    H3*    A   7           H3*        A   7   3.413   2.653   0.632
   71    H2*    A   7           H2*        A   7   2.511   0.967  -0.801
   72   2HO*    A   7          2HO*        A   7   4.741   1.228  -2.058
   73    H1*    A   7           H1*        A   7   4.212  -1.110   0.166
   74    H8     A   7           H8         A   7   2.697   0.521   3.128
   75   1H6     A   7          1H6         A   7  -2.428  -2.756   1.969
   76   2H6     A   7          2H6         A   7  -1.621  -1.718   3.121
   77    H2     A   7           H2         A   7   0.282  -3.127  -1.568
   78   1H5*    A   8          1H5*        A   8   3.232   3.298  -3.886
   79   2H5*    A   8          2H5*        A   8   1.509   3.723  -3.901
   80    H4*    A   8           H4*        A   8   2.723   1.161  -4.042
   81    H3*    A   8           H3*        A   8  -0.101   2.159  -4.201
   82    H2*    A   8           H2*        A   8  -0.913  -0.068  -3.794
   83   2HO*    A   8          2HO*        A   8   1.258  -0.702  -5.106
   84    H1*    A   8           H1*        A   8   1.051  -0.766  -1.892
   85    H8     A   8           H8         A   8   0.551   2.215  -0.312
   86   1H6     A   8          1H6         A   8  -5.111   0.509   1.511
   87   2H6     A   8          2H6         A   8  -3.891   1.658   1.930
   88    H2     A   8           H2         A   8  -4.020  -2.012  -1.875
   89   1H5*    G   9          1H5*        G   9  -0.460  -0.494  -5.888
   90   2H5*    G   9          2H5*        G   9  -0.623  -0.870  -7.613
   91    H4*    G   9           H4*        G   9  -2.505  -1.884  -7.060
   92    H3*    G   9           H3*        G   9  -3.344   0.977  -7.021
   93    H2*    G   9           H2*        G   9  -5.429   0.422  -5.968
   94   2HO*    G   9          2HO*        G   9  -6.113  -1.738  -5.803
   95    H1*    G   9           H1*        G   9  -4.412  -1.413  -4.141
   96    H8     G   9           H8         G   9  -1.861   1.289  -4.465
   97    H1     G   9           H1         G   9  -6.631   2.648  -0.430
   98   1H2     G   9          1H2         G   9  -8.132   1.487  -0.604
   99   2H2     G   9          2H2         G   9  -8.461   0.179  -1.608
  100   1H5*    G  10          1H5*        G  10  -5.990  -0.451  -8.248
  101   2H5*    G  10          2H5*        G  10  -6.958  -0.709  -9.712
  102    H4*    G  10           H4*        G  10  -8.523   0.606  -8.911
  103    H3*    G  10           H3*        G  10  -6.412   2.769  -8.870
  104    H2*    G  10           H2*        G  10  -8.036   4.118  -7.735
  105   2HO*    G  10          2HO*        G  10  -9.904   3.718  -8.857
  106    H1*    G  10           H1*        G  10  -9.034   1.950  -6.180
  107    H8     G  10           H8         G  10  -5.268   2.171  -6.162
  108    H1     G  10           H1         G  10  -8.243   5.942  -1.925
  109   1H2     G  10          1H2         G  10 -10.135   6.007  -2.162
  110   2H2     G  10          2H2         G  10 -11.168   5.291  -3.280
  111   1H5*    G  11          1H5*        G  11 -10.060   4.199 -10.757
  112   2H5*    G  11          2H5*        G  11  -9.646   5.146 -12.199
  113    H4*    G  11           H4*        G  11 -11.213   6.426 -11.048
  114    H3*    G  11           H3*        G  11  -8.447   7.493 -10.674
  115    H2*    G  11           H2*        G  11  -9.250   9.165  -9.159
  116   2HO*    G  11          2HO*        G  11 -11.510   8.777 -10.569
  117    H1*    G  11           H1*        G  11 -10.935   7.506  -7.722
  118    H8     G  11           H8         G  11  -7.867   5.580  -8.749
  119    H1     G  11           H1         G  11  -7.294   8.991  -3.372
  120   1H2     G  11          1H2         G  11  -8.778  10.201  -3.089
  121   2H2     G  11          2H2         G  11 -10.160  10.523  -4.003
  122   1H5*    C  12          1H5*        C  12 -10.926  10.481 -10.808
  123   2H5*    C  12          2H5*        C  12 -10.597  11.662 -12.089
  124    H4*    C  12           H4*        C  12 -10.949  12.957 -10.207
  125    H3*    C  12           H3*        C  12  -8.004  12.656 -10.702
  126    H2*    C  12           H2*        C  12  -7.570  14.007  -8.765
  127   2HO*    C  12          2HO*        C  12  -9.777  15.173  -9.490
  128    H1*    C  12           H1*        C  12  -9.627  12.882  -7.172
  129   1H4     C  12          1H4         C  12  -4.445   9.845  -5.272
  130   2H4     C  12          2H4         C  12  -4.364   8.715  -6.491
  131    H5     C  12           H5         C  12  -6.128   9.051  -8.451
  132    H6     C  12           H6         C  12  -7.989  10.420  -9.223
  133   1H5*    G  13          1H5*        G  13  -5.271  15.912 -11.367
  134   2H5*    G  13          2H5*        G  13  -5.953  14.706 -10.256
  135    H4*    G  13           H4*        G  13  -6.401  17.593  -9.691
  136    H3*    G  13           H3*        G  13  -3.717  16.279  -9.336
  137    H2*    G  13           H2*        G  13  -3.527  17.415  -7.215
  138   2HO*    G  13          2HO*        G  13  -5.080  19.177  -8.397
  139    H1*    G  13           H1*        G  13  -6.120  16.803  -6.377
  140    H8     G  13           H8         G  13  -4.396  14.125  -8.460
  141    H1     G  13           H1         G  13  -3.376  13.679  -2.175
  142   1H2     G  13          1H2         G  13  -4.263  15.413  -1.115
  143   2H2     G  13          2H2         G  13  -5.092  16.685  -1.981
  144   1H5*    U  14          1H5*        U  14  -0.276  20.165  -9.432
  145   2H5*    U  14          2H5*        U  14  -0.244  19.361 -11.013
  146    H4*    U  14           H4*        U  14   1.765  18.722 -10.091
  147    H3*    U  14           H3*        U  14   0.260  16.653 -10.641
  148    H2*    U  14           H2*        U  14  -1.061  16.642  -8.616
  149   2HO*    U  14          2HO*        U  14  -0.513  14.610  -8.258
  150    H1*    U  14           H1*        U  14   1.453  16.915  -6.892
  151    H3     U  14           H3         U  14  -0.985  20.108  -4.231
  152    H5     U  14           H5         U  14  -3.179  16.618  -4.996
  153    H6     U  14           H6         U  14  -1.595  16.070  -6.696
  154   1H5*    C  15          1H5*        C  15   1.742  12.001  -9.485
  155   2H5*    C  15          2H5*        C  15   0.737  13.452  -9.307
  156    H4*    C  15           H4*        C  15   2.704  13.939  -7.500
  157    H3*    C  15           H3*        C  15   2.342  10.936  -7.486
  158    H2*    C  15           H2*        C  15   2.602  11.075  -5.091
  159   2HO*    C  15          2HO*        C  15   3.474  12.816  -4.170
  160    H1*    C  15           H1*        C  15   0.690  13.089  -4.856
  161   1H4     C  15          1H4         C  15  -2.281   7.434  -6.586
  162   2H4     C  15          2H4         C  15  -2.407   7.489  -4.840
  163    H5     C  15           H5         C  15  -1.414   9.272  -3.512
  164    H6     C  15           H6         C  15  -0.078  11.274  -3.582
  165   1H5*    G  16          1H5*        G  16   6.773  11.402  -7.185
  166   2H5*    G  16          2H5*        G  16   7.719  10.184  -8.063
  167    H4*    G  16           H4*        G  16   7.157   8.486  -6.545
  168    H3*    G  16           H3*        G  16   4.875  10.186  -5.696
  169    H2*    G  16           H2*        G  16   5.192   9.727  -3.375
  170   2HO*    G  16          2HO*        G  16   5.548   7.556  -3.321
  171    H1*    G  16           H1*        G  16   7.976   9.817  -3.319
  172    H8     G  16           H8         G  16   5.297  12.050  -5.008
  173    H1     G  16           H1         G  16   9.051  14.892  -0.655
  174   1H2     G  16          1H2         G  16  10.538  13.469   0.111
  175   2H2     G  16          2H2         G  16  10.611  11.811  -0.441
  176   1H5*    U  17          1H5*        U  17   1.402   8.241  -3.125
  177   2H5*    U  17          2H5*        U  17   1.641   9.724  -4.067
  178    H4*    U  17           H4*        U  17   3.298   9.365  -1.659
  179    H3*    U  17           H3*        U  17   0.642   8.923  -1.191
  180    H2*    U  17           H2*        U  17  -0.193  11.027  -1.834
  181   2HO*    U  17          2HO*        U  17  -0.437  12.256   0.008
  182    H1*    U  17           H1*        U  17   2.359  12.370  -0.813
  183    H3     U  17           H3         U  17   2.436  15.747  -3.929
  184    H5     U  17           H5         U  17  -1.555  14.595  -3.373
  185    H6     U  17           H6         U  17  -0.737  12.610  -2.257
  186   1H5*    C  18          1H5*        C  18   3.346  11.147  -0.379
  187   2H5*    C  18          2H5*        C  18   4.994  11.547   0.111
  188    H4*    C  18           H4*        C  18   3.810  11.384   2.497
  189    H3*    C  18           H3*        C  18   1.460  11.337   1.191
  190    H2*    C  18           H2*        C  18   1.546  13.493   0.163
  191   2HO*    C  18          2HO*        C  18   1.120  14.396   2.813
  192    H1*    C  18           H1*        C  18   3.053  14.650   2.551
  193   1H4     C  18          1H4         C  18   5.379  18.750  -1.717
  194   2H4     C  18          2H4         C  18   3.967  18.466  -2.715
  195    H5     C  18           H5         C  18   2.320  16.760  -2.186
  196    H6     C  18           H6         C  18   1.731  14.992  -0.668
  197   1H5*    G  19          1H5*        G  19   0.044  13.299   2.976
  198   2H5*    G  19          2H5*        G  19  -1.069  13.512   4.338
  199    H4*    G  19           H4*        G  19  -2.122  14.340   2.394
  200    H3*    G  19           H3*        G  19  -3.270  11.823   3.457
  201    H2*    G  19           H2*        G  19  -4.407  11.315   1.517
  202   2HO*    G  19          2HO*        G  19  -5.830  13.097   1.812
  203    H1*    G  19           H1*        G  19  -3.049  13.477  -0.115
  204    H8     G  19           H8         G  19  -1.167  10.310   0.261
  205    H1     G  19           H1         G  19  -5.540  10.329  -4.452
  206   1H2     G  19          1H2         G  19  -6.689  11.827  -4.409
  207   2H2     G  19          2H2         G  19  -6.848  13.118  -3.337
  208   1H5*    C  20          1H5*        C  20  -6.578  14.668   2.807
  209   2H5*    C  20          2H5*        C  20  -7.643  14.565   4.221
  210    H4*    C  20           H4*        C  20  -9.113  14.397   2.478
  211    H3*    C  20           H3*        C  20  -8.467  11.559   3.269
  212    H2*    C  20           H2*        C  20 -10.015  10.860   1.573
  213   2HO*    C  20          2HO*        C  20 -11.227  13.096   2.256
  214    H1*    C  20           H1*        C  20  -9.283  12.935  -0.257
  215   1H4     C  20          1H4         C  20  -6.452   7.979  -2.795
  216   2H4     C  20          2H4         C  20  -5.208   7.795  -1.712
  217    H5     C  20           H5         C  20  -5.345   9.360   0.451
  218    H6     C  20           H6         C  20  -6.617  11.157   1.507
  219   1H5*    C  21          1H5*        C  21 -12.413  11.717   2.791
  220   2H5*    C  21          2H5*        C  21 -13.311  10.995   4.141
  221    H4*    C  21           H4*        C  21 -14.154   9.964   2.221
  222    H3*    C  21           H3*        C  21 -12.186   8.124   3.573
  223    H2*    C  21           H2*        C  21 -12.612   6.509   1.852
  224   2HO*    C  21          2HO*        C  21 -14.428   6.587   0.597
  225    H1*    C  21           H1*        C  21 -12.813   8.425  -0.249
  226   1H4     C  21          1H4         C  21  -7.127   5.880  -1.047
  227   2H4     C  21          2H4         C  21  -6.322   6.683   0.158
  228    H5     C  21           H5         C  21  -7.832   8.209   1.726
  229    H6     C  21           H6         C  21 -10.112   8.979   2.126
  230   1H5*    C  22          1H5*        C  22 -12.078   4.949   5.108
  231   2H5*    C  22          2H5*        C  22 -12.021   5.583   3.453
  232    H4*    C  22           H4*        C  22 -13.782   3.277   3.751
  233    H3*    C  22           H3*        C  22 -10.975   2.997   4.719
  234    H2*    C  22           H2*        C  22 -10.586   1.084   3.363
  235   2HO*    C  22          2HO*        C  22 -12.176  -0.245   2.906
  236    H1*    C  22           H1*        C  22 -11.860   1.979   1.063
  237   1H4     C  22          1H4         C  22  -5.842   3.599   0.254
  238   2H4     C  22          2H4         C  22  -5.756   4.820   1.371
  239    H5     C  22           H5         C  22  -7.929   5.182   2.846
  240    H6     C  22           H6         C  22 -10.217   4.452   3.195
  241   1H5*    C  23          1H5*        C  23 -12.370  -1.173   4.568
  242   2H5*    C  23          2H5*        C  23 -11.338  -1.955   5.781
  243    H4*    C  23           H4*        C  23 -11.040  -2.569   3.311
  244    H3*    C  23           H3*        C  23  -8.794  -1.976   5.199
  245    H2*    C  23           H2*        C  23  -7.196  -2.287   3.444
  246   2HO*    C  23          2HO*        C  23  -7.768  -3.806   2.043
  247    H1*    C  23           H1*        C  23  -8.594  -0.808   1.547
  248   1H4     C  23          1H4         C  23  -4.727   3.382   4.350
  249   2H4     C  23          2H4         C  23  -5.978   3.744   5.525
  250    H5     C  23           H5         C  23  -8.050   2.512   5.658
  251    H6     C  23           H6         C  23  -9.354   0.694   4.688
  252   1H5*    G  24          1H5*        G  24  -6.990  -6.431   4.062
  253   2H5*    G  24          2H5*        G  24  -7.321  -4.737   4.469
  254    H4*    G  24           H4*        G  24  -6.570  -5.183   1.679
  255    H3*    G  24           H3*        G  24  -5.002  -6.772   3.128
  256    H2*    G  24           H2*        G  24  -4.231  -5.248   4.793
  257   2HO*    G  24          2HO*        G  24  -2.619  -5.283   2.544
  258    H1*    G  24           H1*        G  24  -3.980  -2.932   2.841
  259    H8     G  24           H8         G  24  -6.684  -3.297   5.475
  260    H1     G  24           H1         G  24  -1.722   0.381   7.218
  261   1H2     G  24          1H2         G  24  -0.155   0.317   5.695
  262   2H2     G  24          2H2         G  24  -0.321  -0.638   4.241
  263   1H5*    A  25          1H5*        A  25  -3.417  -9.096  -0.991
  264   2H5*    A  25          2H5*        A  25  -1.983  -9.551  -0.052
  265    H4*    A  25           H4*        A  25  -2.170  -7.884  -2.342
  266    H3*    A  25           H3*        A  25   0.095  -8.955  -0.698
  267    H2*    A  25           H2*        A  25   1.563  -7.274  -1.573
  268   2HO*    A  25          2HO*        A  25   0.024  -7.618  -3.694
  269    H1*    A  25           H1*        A  25  -0.350  -5.187  -1.692
  270    H8     A  25           H8         A  25  -0.994  -6.361   1.652
  271   1H6     A  25          1H6         A  25   3.928  -3.135   3.532
  272   2H6     A  25          2H6         A  25   2.471  -3.958   4.059
  273    H2     A  25           H2         A  25   4.263  -3.693  -0.880
  274   1H5*    G  26          1H5*        G  26   2.617  -8.910  -4.432
  275   2H5*    G  26          2H5*        G  26   3.694 -10.205  -3.875
  276    H4*    G  26           H4*        G  26   4.638  -7.837  -4.027
  277    H3*    G  26           H3*        G  26   4.958  -9.614  -1.633
  278    H2*    G  26           H2*        G  26   6.190  -7.885  -0.517
  279   2HO*    G  26          2HO*        G  26   7.394  -6.804  -2.008
  280    H1*    G  26           H1*        G  26   4.400  -5.869  -1.154
  281    H8     G  26           H8         G  26   2.239  -8.827  -0.732
  282    H1     G  26           H1         G  26   4.196  -6.319   4.817
  283   1H2     G  26          1H2         G  26   5.698  -5.126   4.629
  284   2H2     G  26          2H2         G  26   6.573  -4.594   3.297
  285   1H5*    C  27          1H5*        C  27   9.343  -6.157  -2.900
  286   2H5*    C  27          2H5*        C  27  10.042  -7.547  -3.752
  287    H4*    C  27           H4*        C  27  11.523  -6.988  -2.005
  288    H3*    C  27           H3*        C  27   9.969  -9.494  -1.437
  289    H2*    C  27           H2*        C  27  11.066  -9.679   0.686
  290   2HO*    C  27          2HO*        C  27  13.088  -9.063   0.772
  291    H1*    C  27           H1*        C  27  11.001  -6.924   1.295
  292   1H4     C  27          1H4         C  27   6.031  -9.016   4.464
  293   2H4     C  27          2H4         C  27   5.022  -9.347   3.186
  294    H5     C  27           H5         C  27   6.111  -9.117   0.793
  295    H6     C  27           H6         C  27   8.138  -8.466  -0.405
  296   1H5*    G  28          1H5*        G  28  13.724 -10.364  -0.318
  297   2H5*    G  28          2H5*        G  28  14.309 -11.873  -1.045
  298    H4*    G  28           H4*        G  28  14.661 -12.150   1.237
  299    H3*    G  28           H3*        G  28  12.136 -13.575   0.427
  300    H2*    G  28           H2*        G  28  11.865 -14.277   2.702
  301   2HO*    G  28          2HO*        G  28  14.488 -14.280   2.659
  302    H1*    G  28           H1*        G  28  12.779 -11.836   3.834
  303    H8     G  28           H8         G  28  10.299 -11.396   1.008
  304    H1     G  28           H1         G  28   7.702 -12.021   6.840
  305   1H2     G  28          1H2         G  28   9.221 -12.673   8.283
  306   2H2     G  28          2H2         G  28  10.885 -12.949   7.813
  307   1H5*    C  29          1H5*        C  29  14.100 -16.429   2.685
  308   2H5*    C  29          2H5*        C  29  14.373 -17.857   1.666
  309    H4*    C  29           H4*        C  29  13.434 -18.762   3.559
  310    H3*    C  29           H3*        C  29  11.349 -18.370   1.445
  311    H2*    C  29           H2*        C  29   9.653 -19.169   2.933
  312   2HO*    C  29          2HO*        C  29  11.689 -20.583   3.884
  313    H1*    C  29           H1*        C  29  10.644 -17.890   5.246
  314   1H4     C  29          1H4         C  29   6.270 -13.746   3.568
  315   2H4     C  29          2H4         C  29   7.049 -13.012   2.324
  316    H5     C  29           H5         C  29   9.419 -14.116   1.667
  317    H6     C  29           H6         C  29  10.958 -15.936   2.201
  318   1H5*    C  30          1H5*        C  30  10.547 -22.193   2.775
  319   2H5*    C  30          2H5*        C  30  10.811 -23.328   1.435
  320    H4*    C  30           H4*        C  30   8.741 -23.936   2.292
  321    H3*    C  30           H3*        C  30   8.448 -22.250  -0.171
  322    H2*    C  30           H2*        C  30   6.084 -22.267   0.045
  323   2HO*    C  30          2HO*        C  30   6.479 -24.678   0.934
  324    H1*    C  30           H1*        C  30   6.003 -22.056   2.862
  325   1H4     C  30          1H4         C  30   4.895 -16.210   0.874
  326   2H4     C  30          2H4         C  30   6.320 -15.911   0.096
  327    H5     C  30           H5         C  30   8.032 -17.958   0.009
  328    H6     C  30           H6         C  30   8.422 -20.232   0.770
  329    H3T    C  30           H3T        C  30   9.157 -24.272  -0.461
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  -6.118 -14.404   1.440
    2   2H5*    G   1          2H5*        G   1  -6.339 -12.715   1.930
    3    H4*    G   1           H4*        G   1  -6.739 -13.933   3.859
    4    H3*    G   1           H3*        G   1  -3.984 -12.758   3.899
    5    H2*    G   1           H2*        G   1  -3.536 -13.829   5.996
    6   2HO*    G   1          2HO*        G   1  -5.121 -14.284   7.344
    7    H1*    G   1           H1*        G   1  -4.714 -16.285   5.341
    8    H8     G   1           H8         G   1  -2.704 -14.414   2.654
    9    H1     G   1           H1         G   1   0.416 -18.923   5.966
   10   1H2     G   1          1H2         G   1  -0.598 -19.646   7.406
   11   2H2     G   1          2H2         G   1  -2.148 -19.325   7.979
   12    H5T    G   1           H5T        G   1  -4.103 -12.489   2.050
   13   1H5*    G   2          1H5*        G   2  -5.493 -12.453   7.509
   14   2H5*    G   2          2H5*        G   2  -5.495 -10.811   8.183
   15    H4*    G   2           H4*        G   2  -4.546 -12.114   9.849
   16    H3*    G   2           H3*        G   2  -2.397 -10.697   8.300
   17    H2*    G   2           H2*        G   2  -0.749 -11.730   9.714
   18   2HO*    G   2          2HO*        G   2  -2.778 -11.711  11.446
   19    H1*    G   2           H1*        G   2  -1.958 -14.267   9.723
   20    H8     G   2           H8         G   2  -1.959 -12.323   6.423
   21    H1     G   2           H1         G   2   2.957 -16.317   7.376
   22   1H2     G   2          1H2         G   2   2.998 -17.062   9.126
   23   2H2     G   2          2H2         G   2   1.988 -16.889  10.462
   24   1H5*    U   3          1H5*        U   3  -1.365 -10.349  12.047
   25   2H5*    U   3          2H5*        U   3  -1.074  -8.678  12.572
   26    H4*    U   3           H4*        U   3   0.834  -9.823  13.218
   27    H3*    U   3           H3*        U   3   1.320  -8.314  10.676
   28    H2*    U   3           H2*        U   3   3.558  -9.177  10.587
   29   2HO*    U   3          2HO*        U   3   4.526  -9.551  12.431
   30    H1*    U   3           H1*        U   3   2.883 -11.801  11.216
   31    H3     U   3           H3         U   3   3.554 -12.362   6.811
   32    H5     U   3           H5         U   3   0.063 -10.057   6.978
   33    H6     U   3           H6         U   3   0.374  -9.872   9.357
   34   1H5*    G   4          1H5*        G   4   4.504  -7.838  13.162
   35   2H5*    G   4          2H5*        G   4   5.003  -6.144  13.330
   36    H4*    G   4           H4*        G   4   6.961  -7.288  12.817
   37    H3*    G   4           H3*        G   4   5.884  -5.941  10.353
   38    H2*    G   4           H2*        G   4   7.749  -6.825   9.117
   39   2HO*    G   4          2HO*        G   4   9.557  -6.896  10.215
   40    H1*    G   4           H1*        G   4   7.638  -9.385  10.279
   41    H8     G   4           H8         G   4   4.239  -7.861   9.556
   42    H1     G   4           H1         G   4   6.883 -11.144   4.738
   43   1H2     G   4          1H2         G   4   8.690 -11.624   5.044
   44   2H2     G   4          2H2         G   4   9.754 -11.340   6.315
   45   1H5*    C   5          1H5*        C   5   9.857  -4.613  10.669
   46   2H5*    C   5          2H5*        C   5  10.106  -3.033   9.903
   47    H4*    C   5           H4*        C   5  11.363  -4.837   8.812
   48    H3*    C   5           H3*        C   5   9.299  -3.367   7.188
   49    H2*    C   5           H2*        C   5   9.825  -4.745   5.319
   50   2HO*    C   5          2HO*        C   5  12.253  -4.762   6.504
   51    H1*    C   5           H1*        C   5  10.274  -7.124   6.816
   52   1H4     C   5          1H4         C   5   4.692  -7.967   4.062
   53   2H4     C   5          2H4         C   5   3.774  -7.158   5.175
   54    H5     C   5           H5         C   5   5.111  -5.893   7.089
   55    H6     C   5           H6         C   5   7.355  -5.352   7.901
   56   1H5*    G   6          1H5*        G   6  11.918  -4.328   4.448
   57   2H5*    G   6          2H5*        G   6  12.114  -2.973   3.320
   58    H4*    G   6           H4*        G   6  11.104  -4.932   2.263
   59    H3*    G   6           H3*        G   6   9.563  -2.368   2.349
   60    H2*    G   6           H2*        G   6   7.681  -3.419   1.312
   61   2HO*    G   6          2HO*        G   6   9.221  -4.634  -0.130
   62    H1*    G   6           H1*        G   6   7.859  -5.863   2.694
   63    H8     G   6           H8         G   6   8.499  -3.000   5.022
   64    H1     G   6           H1         G   6   2.298  -4.390   4.209
   65   1H2     G   6          1H2         G   6   2.027  -5.687   2.451
   66   2H2     G   6          2H2         G   6   3.378  -6.232   1.486
   67   1H5*    A   7          1H5*        A   7   9.181   0.048  -1.079
   68   2H5*    A   7          2H5*        A   7   8.955  -1.165   0.195
   69    H4*    A   7           H4*        A   7  10.116  -2.289  -2.221
   70    H3*    A   7           H3*        A   7   7.586  -0.719  -2.544
   71    H2*    A   7           H2*        A   7   6.550  -2.513  -3.683
   72   2HO*    A   7          2HO*        A   7   7.814  -4.277  -4.497
   73    H1*    A   7           H1*        A   7   7.763  -4.630  -2.225
   74    H8     A   7           H8         A   7   6.483  -2.347   0.322
   75   1H6     A   7          1H6         A   7   0.826  -4.629  -0.750
   76   2H6     A   7          2H6         A   7   1.791  -3.679   0.356
   77    H2     A   7           H2         A   7   3.492  -5.896  -4.102
   78   1H5*    A   8          1H5*        A   8   5.842   1.572  -5.255
   79   2H5*    A   8          2H5*        A   8   6.288   0.578  -3.856
   80    H4*    A   8           H4*        A   8   6.400  -0.932  -6.319
   81    H3*    A   8           H3*        A   8   3.948   0.693  -5.966
   82    H2*    A   8           H2*        A   8   2.479  -1.184  -6.006
   83   2HO*    A   8          2HO*        A   8   3.119  -3.157  -6.862
   84    H1*    A   8           H1*        A   8   4.056  -2.998  -4.590
   85    H8     A   8           H8         A   8   4.758  -0.267  -2.438
   86   1H6     A   8          1H6         A   8  -0.987  -0.700  -0.176
   87   2H6     A   8          2H6         A   8   0.519   0.027   0.245
   88    H2     A   8           H2         A   8  -0.896  -2.932  -3.911
   89   1H5*    G   9          1H5*        G   9   2.279  -1.569  -8.238
   90   2H5*    G   9          2H5*        G   9   1.507  -0.751  -9.611
   91    H4*    G   9           H4*        G   9  -0.209  -1.755  -8.328
   92    H3*    G   9           H3*        G   9  -0.054   1.225  -8.059
   93    H2*    G   9           H2*        G   9  -1.766   1.256  -6.466
   94   2HO*    G   9          2HO*        G   9  -3.267  -0.160  -7.489
   95    H1*    G   9           H1*        G   9  -1.120  -1.227  -5.227
   96    H8     G   9           H8         G   9   1.886   0.886  -5.490
   97    H1     G   9           H1         G   9  -2.023   2.529  -0.700
   98   1H2     G   9          1H2         G   9  -3.767   1.782  -0.863
   99   2H2     G   9          2H2         G   9  -4.464   0.743  -1.990
  100   1H5*    G  10          1H5*        G  10  -4.239  -1.899  -7.569
  101   2H5*    G  10          2H5*        G  10  -5.188  -1.868  -9.066
  102    H4*    G  10           H4*        G  10  -6.782  -1.099  -7.700
  103    H3*    G  10           H3*        G  10  -5.267   1.448  -8.267
  104    H2*    G  10           H2*        G  10  -6.893   2.549  -6.846
  105   2HO*    G  10          2HO*        G  10  -8.241   0.072  -7.142
  106    H1*    G  10           H1*        G  10  -6.812   0.552  -4.866
  107    H8     G  10           H8         G  10  -3.374   1.104  -6.210
  108    H1     G  10           H1         G  10  -5.120   5.328  -1.737
  109   1H2     G  10          1H2         G  10  -6.962   5.214  -1.257
  110   2H2     G  10          2H2         G  10  -8.228   4.245  -1.791
  111   1H5*    G  11          1H5*        G  11  -9.297   1.869  -8.456
  112   2H5*    G  11          2H5*        G  11  -9.880   2.754  -9.879
  113    H4*    G  11           H4*        G  11 -10.961   3.660  -7.989
  114    H3*    G  11           H3*        G  11  -8.868   5.483  -9.119
  115    H2*    G  11           H2*        G  11  -9.280   7.059  -7.373
  116   2HO*    G  11          2HO*        G  11 -11.246   7.221  -6.594
  117    H1*    G  11           H1*        G  11  -9.501   5.197  -5.314
  118    H8     G  11           H8         G  11  -6.705   4.138  -7.587
  119    H1     G  11           H1         G  11  -5.204   8.605  -3.259
  120   1H2     G  11          1H2         G  11  -6.732   9.381  -2.419
  121   2H2     G  11          2H2         G  11  -8.387   9.114  -2.610
  122   1H5*    C  12          1H5*        C  12 -12.127   7.508  -8.025
  123   2H5*    C  12          2H5*        C  12 -12.797   8.566  -9.280
  124    H4*    C  12           H4*        C  12 -12.738   9.891  -7.381
  125    H3*    C  12           H3*        C  12 -10.395  10.531  -9.143
  126    H2*    C  12           H2*        C  12  -9.668  12.156  -7.539
  127   2HO*    C  12          2HO*        C  12 -11.005  12.972  -6.008
  128    H1*    C  12           H1*        C  12 -10.224  10.603  -5.272
  129   1H4     C  12          1H4         C  12  -4.092   9.866  -6.357
  130   2H4     C  12          2H4         C  12  -4.158   8.731  -7.552
  131    H5     C  12           H5         C  12  -6.639   8.116  -8.362
  132    H6     C  12           H6         C  12  -8.999   8.628  -8.027
  133   1H5*    G  13          1H5*        G  13  -9.185  14.537  -9.953
  134   2H5*    G  13          2H5*        G  13  -9.257  12.878  -9.329
  135    H4*    G  13           H4*        G  13 -10.533  14.455  -7.411
  136    H3*    G  13           H3*        G  13  -8.363  16.039  -8.645
  137    H2*    G  13           H2*        G  13  -7.181  16.360  -6.583
  138   2HO*    G  13          2HO*        G  13  -9.675  16.185  -5.599
  139    H1*    G  13           H1*        G  13  -7.546  13.842  -5.486
  140    H8     G  13           H8         G  13  -7.031  13.328  -9.133
  141    H1     G  13           H1         G  13  -1.633  13.847  -5.767
  142   1H2     G  13          1H2         G  13  -2.070  14.711  -3.809
  143   2H2     G  13          2H2         G  13  -3.691  15.145  -3.306
  144   1H5*    U  14          1H5*        U  14  -6.661  18.476  -9.239
  145   2H5*    U  14          2H5*        U  14  -7.129  17.212  -8.099
  146    H4*    U  14           H4*        U  14  -7.097  19.007  -6.301
  147    H3*    U  14           H3*        U  14  -6.965  20.986  -7.958
  148    H2*    U  14           H2*        U  14  -5.282  19.955  -9.417
  149   2HO*    U  14          2HO*        U  14  -3.338  21.198  -8.977
  150    H1*    U  14           H1*        U  14  -3.441  19.516  -7.043
  151    H3     U  14           H3         U  14  -1.780  18.176 -11.379
  152    H5     U  14           H5         U  14  -3.015  14.948  -9.013
  153    H6     U  14           H6         U  14  -4.203  16.520  -7.613
  154   1H5*    C  15          1H5*        C  15  -5.817  22.227  -3.069
  155   2H5*    C  15          2H5*        C  15  -5.531  23.977  -3.043
  156    H4*    C  15           H4*        C  15  -3.437  23.791  -3.765
  157    H3*    C  15           H3*        C  15  -4.479  21.954  -5.831
  158    H2*    C  15           H2*        C  15  -2.538  20.588  -5.911
  159   2HO*    C  15          2HO*        C  15  -1.221  22.415  -4.171
  160    H1*    C  15           H1*        C  15  -1.987  20.432  -3.215
  161   1H4     C  15          1H4         C  15  -7.256  16.557  -3.762
  162   2H4     C  15          2H4         C  15  -6.071  15.663  -4.689
  163    H5     C  15           H5         C  15  -3.870  16.556  -5.213
  164    H6     C  15           H6         C  15  -2.404  18.478  -4.978
  165   1H5*    G  16          1H5*        G  16  -3.311  24.847 -10.076
  166   2H5*    G  16          2H5*        G  16  -3.561  23.363  -9.137
  167    H4*    G  16           H4*        G  16  -1.251  23.765 -10.095
  168    H3*    G  16           H3*        G  16  -1.762  22.972  -7.256
  169    H2*    G  16           H2*        G  16   0.575  23.179  -6.736
  170   2HO*    G  16          2HO*        G  16   0.778  22.710  -9.406
  171    H1*    G  16           H1*        G  16   1.004  25.565  -8.112
  172    H8     G  16           H8         G  16  -1.069  23.917  -5.406
  173    H1     G  16           H1         G  16   0.003  30.177  -4.520
  174   1H2     G  16          1H2         G  16   0.910  31.058  -6.319
  175   2H2     G  16          2H2         G  16   1.258  30.106  -7.744
  176   1H5*    U  17          1H5*        U  17  -1.409  17.789  -8.084
  177   2H5*    U  17          2H5*        U  17  -2.341  17.917  -6.585
  178    H4*    U  17           H4*        U  17   0.584  18.422  -6.866
  179    H3*    U  17           H3*        U  17  -0.563  15.894  -6.835
  180    H2*    U  17           H2*        U  17  -1.034  15.711  -4.571
  181   2HO*    U  17          2HO*        U  17   0.768  15.001  -3.423
  182    H1*    U  17           H1*        U  17   1.151  17.729  -3.826
  183    H3     U  17           H3         U  17  -0.632  18.565   0.227
  184    H5     U  17           H5         U  17  -3.686  16.549  -1.853
  185    H6     U  17           H6         U  17  -2.318  16.639  -3.777
  186   1H5*    C  18          1H5*        C  18   4.599  13.167  -6.005
  187   2H5*    C  18          2H5*        C  18   3.008  12.983  -5.241
  188    H4*    C  18           H4*        C  18   5.012  13.302  -3.724
  189    H3*    C  18           H3*        C  18   2.502  13.828  -3.110
  190    H2*    C  18           H2*        C  18   2.257  16.029  -3.939
  191   2HO*    C  18          2HO*        C  18   2.265  17.337  -2.197
  192    H1*    C  18           H1*        C  18   4.982  16.957  -3.045
  193   1H4     C  18          1H4         C  18   4.921  20.319  -8.456
  194   2H4     C  18          2H4         C  18   3.264  19.847  -8.762
  195    H5     C  18           H5         C  18   2.086  18.224  -7.380
  196    H6     C  18           H6         C  18   2.188  16.982  -5.282
  197   1H5*    G  19          1H5*        G  19   2.511  15.409  -0.923
  198   2H5*    G  19          2H5*        G  19   2.036  15.515   0.783
  199    H4*    G  19           H4*        G  19   0.166  16.091  -0.512
  200    H3*    G  19           H3*        G  19   0.041  13.459   0.857
  201    H2*    G  19           H2*        G  19  -1.651  12.612  -0.452
  202   2HO*    G  19          2HO*        G  19  -2.748  14.865   0.450
  203    H1*    G  19           H1*        G  19  -1.635  14.976  -2.323
  204    H8     G  19           H8         G  19   0.875  12.932  -3.474
  205    H1     G  19           H1         G  19  -4.732  10.473  -5.243
  206   1H2     G  19          1H2         G  19  -6.234  11.276  -4.381
  207   2H2     G  19          2H2         G  19  -6.369  12.453  -3.188
  208   1H5*    C  20          1H5*        C  20  -3.755  15.431   1.646
  209   2H5*    C  20          2H5*        C  20  -4.133  15.223   3.366
  210    H4*    C  20           H4*        C  20  -6.069  14.555   2.333
  211    H3*    C  20           H3*        C  20  -4.472  12.053   2.851
  212    H2*    C  20           H2*        C  20  -6.286  10.811   1.909
  213   2HO*    C  20          2HO*        C  20  -8.297  11.552   1.929
  214    H1*    C  20           H1*        C  20  -6.851  12.737  -0.121
  215   1H4     C  20          1H4         C  20  -3.846   8.220  -3.252
  216   2H4     C  20          2H4         C  20  -2.302   8.612  -2.842
  217    H5     C  20           H5         C  20  -2.074  10.499  -0.951
  218    H6     C  20           H6         C  20  -3.334  12.080   0.416
  219   1H5*    C  21          1H5*        C  21  -8.151  11.356   3.770
  220   2H5*    C  21          2H5*        C  21  -8.419  10.652   5.374
  221    H4*    C  21           H4*        C  21  -9.623   9.296   3.914
  222    H3*    C  21           H3*        C  21  -7.005   7.935   4.551
  223    H2*    C  21           H2*        C  21  -7.751   6.099   3.195
  224   2HO*    C  21          2HO*        C  21 -10.095   6.826   4.120
  225    H1*    C  21           H1*        C  21  -9.030   7.760   1.248
  226   1H4     C  21          1H4         C  21  -3.767   5.710  -1.508
  227   2H4     C  21          2H4         C  21  -2.701   6.791  -0.842
  228    H5     C  21           H5         C  21  -3.724   8.400   1.015
  229    H6     C  21           H6         C  21  -5.768   8.980   2.213
  230   1H5*    C  22          1H5*        C  22  -6.345   4.123   5.914
  231   2H5*    C  22          2H5*        C  22  -6.438   5.429   4.717
  232    H4*    C  22           H4*        C  22  -8.521   3.458   4.322
  233    H3*    C  22           H3*        C  22  -5.746   2.380   4.591
  234    H2*    C  22           H2*        C  22  -5.899   1.233   2.522
  235   2HO*    C  22          2HO*        C  22  -8.510   1.147   3.204
  236    H1*    C  22           H1*        C  22  -7.317   3.175   1.094
  237   1H4     C  22          1H4         C  22  -1.230   3.688  -0.418
  238   2H4     C  22          2H4         C  22  -0.751   4.638   0.857
  239    H5     C  22           H5         C  22  -2.624   5.070   2.702
  240    H6     C  22           H6         C  22  -4.954   4.717   3.261
  241   1H5*    C  23          1H5*        C  23  -8.139  -0.672   3.147
  242   2H5*    C  23          2H5*        C  23  -7.718  -2.220   3.906
  243    H4*    C  23           H4*        C  23  -7.547  -2.248   1.451
  244    H3*    C  23           H3*        C  23  -5.172  -2.910   3.141
  245    H2*    C  23           H2*        C  23  -3.778  -3.103   1.193
  246   2HO*    C  23          2HO*        C  23  -6.103  -3.767   0.064
  247    H1*    C  23           H1*        C  23  -4.758  -0.867  -0.150
  248   1H4     C  23          1H4         C  23   0.259   1.421   2.963
  249   2H4     C  23          2H4         C  23  -0.774   1.839   4.315
  250    H5     C  23           H5         C  23  -3.099   1.175   4.441
  251    H6     C  23           H6         C  23  -4.895  -0.023   3.304
  252   1H5*    G  24          1H5*        G  24  -5.184  -5.415   0.052
  253   2H5*    G  24          2H5*        G  24  -4.694  -7.085   0.395
  254    H4*    G  24           H4*        G  24  -3.300  -5.850  -1.271
  255    H3*    G  24           H3*        G  24  -2.446  -7.789   0.390
  256    H2*    G  24           H2*        G  24  -1.580  -6.453   2.172
  257   2HO*    G  24          2HO*        G  24   0.282  -6.959   0.194
  258    H1*    G  24           H1*        G  24  -0.553  -4.346   0.216
  259    H8     G  24           H8         G  24  -3.313  -4.138   2.867
  260    H1     G  24           H1         G  24   2.118  -1.038   4.279
  261   1H2     G  24          1H2         G  24   3.643  -1.439   2.766
  262   2H2     G  24          2H2         G  24   3.336  -2.480   1.396
  263   1H5*    A  25          1H5*        A  25  -1.231 -10.598  -3.404
  264   2H5*    A  25          2H5*        A  25  -0.157 -11.417  -2.254
  265    H4*    A  25           H4*        A  25   0.540 -10.158  -4.648
  266    H3*    A  25           H3*        A  25   2.154 -11.335  -2.404
  267    H2*    A  25           H2*        A  25   4.129 -10.342  -3.344
  268   2HO*    A  25          2HO*        A  25   2.896 -10.883  -5.583
  269    H1*    A  25           H1*        A  25   2.813  -7.978  -4.279
  270    H8     A  25           H8         A  25   1.688  -7.670  -0.965
  271   1H6     A  25          1H6         A  25   7.354  -5.954   0.831
  272   2H6     A  25          2H6         A  25   5.644  -5.959   1.239
  273    H2     A  25           H2         A  25   7.739  -8.079  -3.066
  274   1H5*    G  26          1H5*        G  26   5.099 -14.132  -4.281
  275   2H5*    G  26          2H5*        G  26   5.091 -14.854  -2.660
  276    H4*    G  26           H4*        G  26   7.059 -13.299  -3.511
  277    H3*    G  26           H3*        G  26   5.940 -13.394  -0.715
  278    H2*    G  26           H2*        G  26   7.630 -11.771  -0.099
  279   2HO*    G  26          2HO*        G  26   9.314 -12.550  -1.530
  280    H1*    G  26           H1*        G  26   7.043 -10.129  -2.233
  281    H8     G  26           H8         G  26   3.691 -11.123  -1.690
  282    H1     G  26           H1         G  26   5.944  -8.006   3.402
  283   1H2     G  26          1H2         G  26   7.883  -7.987   3.476
  284   2H2     G  26          2H2         G  26   9.065  -8.589   2.437
  285   1H5*    C  27          1H5*        C  27  11.126 -14.433  -2.090
  286   2H5*    C  27          2H5*        C  27  11.673 -16.102  -1.846
  287    H4*    C  27           H4*        C  27  12.427 -15.003   0.040
  288    H3*    C  27           H3*        C  27   9.815 -16.325   0.777
  289    H2*    C  27           H2*        C  27  10.180 -15.523   3.005
  290   2HO*    C  27          2HO*        C  27  12.170 -15.455   3.732
  291    H1*    C  27           H1*        C  27  11.341 -13.042   2.159
  292   1H4     C  27          1H4         C  27   5.601 -11.598   4.327
  293   2H4     C  27          2H4         C  27   4.747 -11.971   2.957
  294    H5     C  27           H5         C  27   6.120 -13.176   1.050
  295    H6     C  27           H6         C  27   8.348 -13.880   0.353
  296   1H5*    G  28          1H5*        G  28  12.526 -17.266   3.646
  297   2H5*    G  28          2H5*        G  28  12.538 -19.003   4.005
  298    H4*    G  28           H4*        G  28  12.324 -17.978   6.080
  299    H3*    G  28           H3*        G  28   9.607 -18.894   5.150
  300    H2*    G  28           H2*        G  28   8.716 -18.093   7.226
  301   2HO*    G  28          2HO*        G  28  11.088 -18.782   8.121
  302    H1*    G  28           H1*        G  28  10.355 -15.773   7.302
  303    H8     G  28           H8         G  28   8.802 -16.346   3.915
  304    H1     G  28           H1         G  28   5.109 -13.141   8.056
  305   1H2     G  28          1H2         G  28   5.937 -13.253  10.068
  306   2H2     G  28          2H2         G  28   7.423 -14.113  10.417
  307   1H5*    C  29          1H5*        C  29  10.050 -20.389   9.046
  308   2H5*    C  29          2H5*        C  29   9.835 -22.150   8.990
  309    H4*    C  29           H4*        C  29   8.507 -21.507  10.762
  310    H3*    C  29           H3*        C  29   6.840 -21.886   8.302
  311    H2*    C  29           H2*        C  29   4.884 -21.198   9.502
  312   2HO*    C  29          2HO*        C  29   6.230 -22.250  11.538
  313    H1*    C  29           H1*        C  29   6.119 -19.110  10.935
  314   1H4     C  29          1H4         C  29   3.526 -16.027   6.122
  315   2H4     C  29          2H4         C  29   4.687 -16.325   4.986
  316    H5     C  29           H5         C  29   6.637 -17.979   5.751
  317    H6     C  29           H6         C  29   7.410 -19.403   7.577
  318   1H5*    C  30          1H5*        C  30   4.642 -23.802  11.220
  319   2H5*    C  30          2H5*        C  30   4.547 -25.529  10.820
  320    H4*    C  30           H4*        C  30   2.362 -24.944  11.344
  321    H3*    C  30           H3*        C  30   2.775 -25.047   8.375
  322    H2*    C  30           H2*        C  30   0.545 -24.326   8.000
  323   2HO*    C  30          2HO*        C  30   0.027 -25.751  10.099
  324    H1*    C  30           H1*        C  30   0.426 -22.474  10.132
  325   1H4     C  30          1H4         C  30   1.482 -18.943   5.048
  326   2H4     C  30          2H4         C  30   2.971 -19.528   4.628
  327    H5     C  30           H5         C  30   3.877 -21.545   6.103
  328    H6     C  30           H6         C  30   3.415 -22.929   8.042
  329    H3T    C  30           H3T        C  30   2.757 -26.927   9.533