==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-DEC-05 2F9R . COMPND 2 MOLECULE: SPHINGOMYELINASE D 1; . SOURCE 2 ORGANISM_SCIENTIFIC: LOXOSCELES LAETA; . AUTHOR M.T.MURAKAMI,A.GABDOULKHAKOV,M.F.FERNANDES-PEDROSA,C.BETZEL, . 1140 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45214.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 858 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 166 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 102 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 147 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 325 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 3 2 3 4 6 2 4 0 2 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 6 6 8 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A A 0 0 159 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -17.8 23.5 47.2 23.8 2 2 A D - 0 0 71 1,-0.1 269,-0.0 2,-0.1 0, 0.0 -0.688 360.0-169.9 -79.3 119.6 24.5 48.0 20.3 3 3 A N + 0 0 117 -2,-0.5 2,-0.3 265,-0.1 -1,-0.1 0.282 49.5 111.3 -92.5 8.8 21.8 50.3 18.8 4 4 A R S S- 0 0 66 281,-0.1 266,-0.3 1,-0.1 265,-0.1 -0.614 77.0-105.8 -91.9 145.7 23.1 50.1 15.3 5 5 A R E -a 270 0A 14 264,-2.2 266,-2.1 -2,-0.3 2,-0.3 -0.525 34.1-125.7 -65.9 125.4 21.4 48.3 12.5 6 6 A P E -a 271 0A 7 0, 0.0 2,-0.4 0, 0.0 266,-0.2 -0.591 28.6-151.8 -72.5 134.3 23.2 45.1 11.6 7 7 A I E -a 272 0A 0 264,-2.8 266,-3.2 -2,-0.3 2,-0.6 -0.896 10.4-141.6-115.1 135.8 24.1 45.1 7.9 8 8 A W E -b 248 0B 1 239,-2.5 241,-3.1 -2,-0.4 2,-0.9 -0.867 10.6-157.7 -93.8 122.7 24.5 42.1 5.6 9 9 A N E -b 249 0B 0 -2,-0.6 21,-1.6 239,-0.2 20,-1.2 -0.870 17.9-164.0-102.4 92.9 27.4 42.7 3.2 10 10 A L E -bc 250 30B 0 239,-2.6 241,-2.8 -2,-0.9 2,-0.5 -0.757 15.2-139.4 -93.4 113.8 26.4 40.3 0.5 11 11 A A E -bc 251 31B 0 19,-2.7 21,-3.2 -2,-0.7 3,-0.4 -0.620 29.9-131.6 -65.1 120.6 29.0 39.4 -2.0 12 12 A H S S- 0 0 7 239,-2.7 3,-0.1 -2,-0.5 21,-0.1 -0.539 70.4 -2.1 -84.6 137.0 27.2 39.4 -5.3 13 13 A M + 0 0 4 -2,-0.2 2,-1.0 1,-0.2 -1,-0.2 0.916 69.0 167.5 55.9 60.0 27.4 36.6 -7.9 14 14 A V + 0 0 0 18,-3.6 -1,-0.2 -3,-0.4 32,-0.1 -0.832 13.8 146.9-107.1 89.0 29.8 34.3 -6.2 15 15 A N + 0 0 1 -2,-1.0 2,-0.4 -3,-0.1 30,-0.3 0.560 48.2 69.4-109.4 -12.7 29.4 31.2 -8.3 16 16 A A S >> S- 0 0 7 -3,-0.2 3,-1.0 1,-0.1 4,-0.6 -0.880 75.8-135.6-106.0 142.2 32.8 29.6 -8.3 17 17 A V T >4 S+ 0 0 34 -2,-0.4 3,-0.8 43,-0.3 -1,-0.1 0.822 104.2 64.0 -68.2 -28.6 34.1 28.1 -5.1 18 18 A A T 3> S+ 0 0 57 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.805 99.5 55.7 -59.8 -29.3 37.5 29.8 -5.6 19 19 A Q H <> S+ 0 0 14 -3,-1.0 4,-2.2 1,-0.2 5,-0.2 0.713 87.9 79.6 -78.5 -23.3 35.8 33.1 -5.3 20 20 A I H S+ 0 0 23 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.887 113.5 56.9 -64.9 -32.1 37.3 33.1 0.3 22 22 A D H X S+ 0 0 98 -4,-0.7 4,-1.3 2,-0.2 -2,-0.2 0.884 110.8 42.5 -63.0 -44.1 38.3 36.1 -1.9 23 23 A F H X>S+ 0 0 17 -4,-2.2 5,-1.8 2,-0.2 4,-0.5 0.877 114.9 49.3 -71.0 -41.0 34.9 37.8 -1.3 24 24 A L H ><5S+ 0 0 13 -4,-2.5 3,-1.0 -5,-0.2 -2,-0.2 0.886 109.1 54.3 -62.7 -37.2 34.9 36.9 2.4 25 25 A D H 3<5S+ 0 0 106 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.850 100.8 59.0 -63.7 -34.6 38.4 38.3 2.6 26 26 A L H 3<5S- 0 0 76 -4,-1.3 -1,-0.3 -5,-0.2 232,-0.2 0.677 132.2 -94.7 -67.2 -15.9 37.1 41.5 1.1 27 27 A G T <<5S+ 0 0 18 -3,-1.0 -3,-0.2 -4,-0.5 -2,-0.1 0.426 71.9 150.5 119.3 1.6 34.8 41.7 4.1 28 28 A A < - 0 0 6 -5,-1.8 -1,-0.3 1,-0.2 -18,-0.2 -0.383 27.6-169.1 -62.9 136.7 31.5 40.1 3.0 29 29 A N S S+ 0 0 2 -20,-1.2 57,-3.0 56,-0.1 58,-1.1 0.315 78.1 27.1-100.0 4.0 29.6 38.4 5.8 30 30 A A E -cd 10 87B 0 -21,-1.6 -19,-2.7 55,-0.2 2,-0.3 -0.967 68.9-154.4-154.5 161.4 27.3 36.9 3.2 31 31 A L E -cd 11 88B 0 56,-1.4 58,-2.8 -2,-0.3 2,-0.4 -0.984 8.8-139.6-143.0 164.6 27.3 35.9 -0.4 32 32 A E E - d 0 89B 0 -21,-3.2 -18,-3.6 -2,-0.3 2,-0.4 -0.973 16.8-175.7-125.8 134.5 25.0 35.4 -3.2 33 33 A A E - d 0 90B 0 56,-2.5 58,-3.3 -2,-0.4 2,-0.6 -0.976 23.2-128.8-132.3 144.8 25.0 32.6 -5.7 34 34 A D E - d 0 91B 0 -2,-0.4 12,-2.7 56,-0.2 2,-0.7 -0.829 20.0-153.3-100.1 118.8 22.8 32.1 -8.8 35 35 A V E -Ed 45 92B 0 56,-2.6 58,-3.1 -2,-0.6 10,-0.2 -0.838 8.9-157.4-100.7 113.4 21.3 28.7 -9.0 36 36 A T E - 0 0 21 8,-2.8 7,-3.2 -2,-0.7 8,-0.5 -0.580 6.2-145.8 -89.0 156.9 20.5 27.5 -12.4 37 37 A F E -E 42 0B 1 56,-0.5 2,-0.7 5,-0.3 3,-0.1 -0.955 16.2-163.4-126.2 133.9 17.9 24.8 -13.1 38 38 A K E > S-E 41 0B 54 3,-2.9 3,-1.8 -2,-0.4 345,-0.2 -0.938 83.4 -47.4-108.0 102.2 17.8 22.1 -15.7 39 39 A G T 3 S- 0 0 1 343,-2.8 57,-0.1 -2,-0.7 58,-0.1 -0.491 123.3 -25.1 63.7-140.0 14.1 21.4 -15.4 40 40 A S T 3 S+ 0 0 26 -2,-0.1 -1,-0.3 -3,-0.1 68,-0.2 0.456 118.2 106.1 -77.1 -1.3 13.4 21.0 -11.7 41 41 A V E < -E 38 0B 72 -3,-1.8 -3,-2.9 67,-0.1 2,-0.4 -0.728 68.4-140.3 -92.5 115.1 17.0 20.1 -11.1 42 42 A P E +E 37 0B 4 0, 0.0 -5,-0.3 0, 0.0 22,-0.2 -0.575 36.6 163.6 -69.5 126.0 19.2 22.7 -9.5 43 43 A T E + 0 0 30 -7,-3.2 20,-2.7 -2,-0.4 2,-0.3 0.846 40.9 12.4-117.8 -55.1 22.4 22.3 -11.4 44 44 A Y E - F 0 62B 50 -8,-0.5 -8,-2.8 18,-0.3 2,-0.7 -0.885 54.0-126.1-126.1 156.0 25.0 25.0 -11.3 45 45 A T E +EF 35 61B 0 16,-2.7 16,-1.5 -2,-0.3 2,-0.3 -0.956 65.5 133.8 -88.3 119.4 25.9 28.1 -9.5 46 46 A Y E - F 0 60B 38 -12,-2.7 14,-0.1 -2,-0.7 -2,-0.1 -0.864 40.8-173.9-173.3 132.5 26.2 30.2 -12.6 47 47 A H - 0 0 37 12,-0.6 11,-0.2 10,-0.6 -1,-0.1 0.881 29.0-162.3 -98.0 -56.7 25.0 33.5 -13.6 48 48 A G - 0 0 5 9,-2.4 11,-0.1 11,-0.2 10,-0.1 -0.177 33.1 -15.1 91.6 170.1 25.9 33.9 -17.3 49 49 A T S S+ 0 0 37 -2,-0.1 2,-0.1 9,-0.1 436,-0.1 -0.636 105.4 46.2 -87.7 149.9 26.2 36.9 -19.5 50 50 A P S S+ 0 0 42 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.654 76.9 149.2 -79.3 162.6 25.3 39.7 -19.3 51 51 A a - 0 0 20 4,-0.2 4,-0.2 1,-0.1 3,-0.1 -0.894 51.8 -46.5-144.4 175.8 26.4 40.6 -15.8 52 52 A D > - 0 0 35 -2,-0.3 3,-1.2 1,-0.1 -1,-0.1 -0.058 68.8 -98.0 -43.4 139.8 27.5 43.5 -13.8 53 53 A F T 3 S+ 0 0 202 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 -0.338 110.8 30.3 -58.8 142.9 30.2 45.6 -15.4 54 54 A G T 3 S+ 0 0 55 1,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.635 102.0 105.8 81.3 11.5 33.6 44.8 -14.2 55 55 A R S < S- 0 0 27 -3,-1.2 2,-0.5 -4,-0.2 -1,-0.2 -0.965 72.4-126.7-126.4 142.6 32.7 41.1 -13.5 56 56 A D - 0 0 88 -2,-0.4 3,-0.4 1,-0.1 -4,-0.1 -0.762 26.7-160.5 -79.7 130.1 33.5 37.9 -15.3 57 57 A a S S+ 0 0 20 -2,-0.5 -9,-2.4 1,-0.2 -10,-0.6 0.567 72.0 62.2 -92.5 -13.4 30.0 36.5 -15.8 58 58 A I + 0 0 25 -11,-0.2 -1,-0.2 -12,-0.1 2,-0.2 0.108 59.5 127.7-116.1 22.8 30.7 32.8 -16.3 59 59 A R + 0 0 96 -3,-0.4 -12,-0.6 -46,-0.1 2,-0.3 -0.530 39.1 164.0 -70.5 146.4 32.3 31.5 -13.2 60 60 A W E -F 46 0B 53 -2,-0.2 -43,-0.3 -14,-0.1 2,-0.3 -0.961 28.7-169.7-157.5 169.4 30.5 28.4 -12.0 61 61 A E E -F 45 0B 35 -16,-1.5 -16,-2.7 -2,-0.3 2,-0.2 -0.958 42.9 -88.9-154.3 158.5 30.3 25.3 -9.9 62 62 A Y E > -F 44 0B 110 -2,-0.3 4,-2.8 -18,-0.2 -18,-0.3 -0.573 43.2-122.4 -61.8 138.1 28.1 22.3 -9.6 63 63 A F H > S+ 0 0 1 -20,-2.7 4,-2.7 -2,-0.2 5,-0.2 0.890 109.7 49.3 -51.9 -47.6 25.4 23.2 -7.2 64 64 A N H > S+ 0 0 51 -21,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.886 112.1 48.2 -63.2 -40.6 26.2 20.3 -4.8 65 65 A V H > S+ 0 0 44 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.889 110.9 51.5 -66.1 -41.1 29.9 21.1 -4.8 66 66 A F H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.954 111.9 46.1 -61.7 -47.8 29.1 24.7 -4.1 67 67 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.889 111.2 52.0 -60.4 -43.8 26.9 23.8 -1.2 68 68 A K H X S+ 0 0 85 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.890 110.2 49.5 -58.8 -39.4 29.5 21.4 0.2 69 69 A T H X S+ 0 0 15 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.910 107.8 52.5 -68.6 -42.2 32.0 24.2 -0.0 70 70 A L H X S+ 0 0 0 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.895 105.9 56.1 -54.8 -45.7 29.7 26.6 1.8 71 71 A R H >X S+ 0 0 59 -4,-2.4 3,-1.0 45,-0.3 4,-0.7 0.920 103.6 54.2 -50.8 -47.2 29.4 24.0 4.5 72 72 A E H >< S+ 0 0 68 -4,-1.6 3,-0.7 1,-0.3 8,-0.3 0.926 111.5 44.1 -53.6 -45.4 33.2 24.0 4.9 73 73 A Y H 3< S+ 0 0 17 -4,-1.7 9,-3.0 1,-0.2 12,-0.3 0.568 120.2 41.3 -79.3 -11.3 33.4 27.7 5.5 74 74 A T H << S+ 0 0 0 -3,-1.0 52,-3.0 -4,-0.9 -1,-0.2 0.220 85.7 98.6-128.7 15.5 30.4 27.7 7.8 75 75 A T S X< S- 0 0 1 -3,-0.7 3,-2.3 -4,-0.7 6,-0.2 -0.921 75.1-123.9-105.9 114.4 30.8 24.7 10.0 76 76 A P T 3 S+ 0 0 61 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.253 98.4 24.4 -51.8 136.3 32.3 25.6 13.4 77 77 A G T 3 S+ 0 0 82 1,-0.3 2,-0.1 2,-0.0 -2,-0.0 0.146 90.2 128.5 90.9 -18.7 35.5 23.5 14.0 78 78 A N X - 0 0 56 -3,-2.3 3,-1.8 1,-0.1 -1,-0.3 -0.448 69.4-123.7 -69.1 145.3 36.0 23.1 10.2 79 79 A A T 3 S+ 0 0 111 1,-0.3 -1,-0.1 -3,-0.1 -6,-0.1 0.773 114.5 45.0 -56.2 -29.2 39.6 24.0 9.2 80 80 A K T 3 S+ 0 0 100 -8,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 0.357 84.5 142.4 -97.7 2.7 38.1 26.4 6.7 81 81 A Y < - 0 0 60 -3,-1.8 2,-0.5 -6,-0.2 -7,-0.2 -0.163 31.2-168.8 -56.0 130.6 35.5 27.9 9.1 82 82 A R > - 0 0 70 -9,-3.0 3,-1.9 3,-0.1 -1,-0.1 -0.947 7.7-166.5-118.0 106.7 34.8 31.6 8.8 83 83 A D T 3 S+ 0 0 112 -2,-0.5 192,-0.4 1,-0.3 -1,-0.1 0.735 88.2 63.1 -67.8 -17.0 32.8 32.8 11.8 84 84 A G T 3 S+ 0 0 40 190,-0.1 2,-0.8 -3,-0.1 -1,-0.3 0.534 81.4 88.1 -78.4 -9.3 32.2 36.0 9.8 85 85 A F < + 0 0 1 -3,-1.9 -55,-0.2 -12,-0.3 -3,-0.1 -0.818 48.3 151.9 -98.6 105.9 30.3 34.1 7.1 86 86 A I + 0 0 2 -57,-3.0 42,-3.1 -2,-0.8 2,-0.3 0.542 51.7 20.9-121.2 -11.8 26.7 34.1 8.3 87 87 A L E -dg 30 128B 0 -58,-1.1 -56,-1.4 40,-0.3 2,-0.4 -0.992 49.2-164.8-157.1 148.0 24.3 34.0 5.4 88 88 A F E -dg 31 129B 0 40,-2.7 42,-2.8 -2,-0.3 2,-0.5 -0.994 13.9-142.9-133.3 151.5 24.0 33.1 1.8 89 89 A V E -dg 32 130B 0 -58,-2.8 -56,-2.5 -2,-0.4 2,-0.7 -0.939 6.9-155.0-107.6 127.5 21.4 34.0 -0.8 90 90 A L E -dg 33 131B 0 40,-3.0 42,-3.1 -2,-0.5 2,-1.3 -0.919 7.0-155.2 -98.0 113.1 20.5 31.4 -3.4 91 91 A D E -dg 34 132B 15 -58,-3.3 -56,-2.6 -2,-0.7 2,-0.5 -0.767 18.3-153.3 -89.2 94.6 19.2 33.3 -6.3 92 92 A L E -d 35 0B 0 40,-2.7 2,-1.7 -2,-1.3 3,-0.2 -0.634 7.1-150.1 -85.1 117.3 17.1 30.5 -7.7 93 93 A K + 0 0 69 -58,-3.1 -56,-0.5 -2,-0.5 3,-0.3 -0.551 48.3 135.8 -91.6 73.2 16.6 30.8 -11.4 94 94 A T > + 0 0 0 -2,-1.7 3,-2.7 1,-0.2 -1,-0.2 0.383 32.1 110.8 -97.4 -0.9 13.2 29.1 -11.6 95 95 A G T 3 S+ 0 0 31 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.598 78.3 46.6 -53.9 -16.8 11.8 31.7 -13.9 96 96 A S T 3 S+ 0 0 27 -3,-0.3 229,-3.3 -57,-0.1 2,-0.3 0.311 85.9 118.9-109.4 8.4 11.7 29.3 -16.9 97 97 A L < - 0 0 3 -3,-2.7 286,-0.1 227,-0.2 5,-0.1 -0.549 63.2-127.6 -78.5 135.5 10.1 26.4 -15.1 98 98 A S >> - 0 0 27 -2,-0.3 3,-2.0 226,-0.1 4,-0.8 -0.355 36.9-100.9 -67.2 158.8 6.8 25.1 -16.1 99 99 A N H >> S+ 0 0 124 1,-0.3 3,-1.2 2,-0.2 4,-0.7 0.875 122.2 57.9 -52.3 -42.7 4.3 25.0 -13.3 100 100 A D H 34 S+ 0 0 136 1,-0.2 -1,-0.3 2,-0.2 -60,-0.0 0.658 105.3 52.7 -60.2 -21.4 4.8 21.2 -12.8 101 101 A Q H <> S+ 0 0 23 -3,-2.0 4,-1.8 2,-0.1 -1,-0.2 0.669 91.8 76.0 -90.5 -17.3 8.5 21.8 -12.2 102 102 A V H S+ 0 0 43 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.816 106.5 58.0 -59.4 -30.3 9.7 19.5 -7.4 105 105 A A H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.890 106.5 48.5 -63.9 -38.3 12.4 22.2 -7.8 106 106 A G H X S+ 0 0 0 -4,-1.7 4,-2.7 -3,-0.4 -1,-0.2 0.924 112.7 48.0 -63.0 -47.1 11.8 23.3 -4.2 107 107 A E H X S+ 0 0 42 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.897 111.5 51.0 -57.8 -42.8 12.0 19.6 -3.1 108 108 A N H X S+ 0 0 36 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.910 111.0 46.8 -66.2 -41.2 15.2 19.3 -5.1 109 109 A V H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.918 111.8 51.4 -65.8 -42.6 16.8 22.3 -3.6 110 110 A A H X S+ 0 0 0 -4,-2.7 4,-3.3 1,-0.2 -2,-0.2 0.930 111.0 48.3 -57.6 -46.9 15.7 21.2 -0.1 111 111 A K H X S+ 0 0 88 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.888 112.2 49.5 -61.1 -41.2 17.3 17.8 -0.8 112 112 A E H X>S+ 0 0 36 -4,-2.3 4,-2.9 2,-0.2 5,-0.6 0.931 114.7 42.8 -63.6 -48.6 20.5 19.4 -2.1 113 113 A L H X>S+ 0 0 0 -4,-2.9 5,-3.0 3,-0.2 4,-1.8 0.911 114.6 51.9 -64.0 -42.5 20.8 21.7 0.9 114 114 A L H <5S+ 0 0 8 -4,-3.3 6,-4.2 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