==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-MAR-11 3R2J . COMPND 2 MOLECULE: ALPHA/BETA-HYDROLASE-LIKE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA INFANTUM; . AUTHOR E.GAZANION,D.GARCIA,J.-F.GUICHOU,G.LABESSE,D.SERENO,B.VERGNE . 796 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31055.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 550 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 147 18.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 3.9 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 53 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 114 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 140 17.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 4 0 0 3 1 2 3 6 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 4 4 4 5 7 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 . 10 1 2 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 . 5 0 0 0 0 0 0 0 0 0 2 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 16 A T 0 0 159 0, 0.0 2,-0.5 0, 0.0 194,-0.0 0.000 360.0 360.0 360.0 60.2 30.6 4.2 -7.3 2 17 A L - 0 0 80 2,-0.0 2,-0.0 0, 0.0 193,-0.0 -0.915 360.0-159.3-127.5 102.7 32.0 1.9 -4.5 3 18 A C - 0 0 86 -2,-0.5 2,-0.3 193,-0.0 193,-0.2 -0.170 17.6-148.5 -90.6 171.2 29.8 1.9 -1.4 4 19 A V E -a 196 0A 22 191,-2.8 193,-1.5 2,-0.0 2,-0.3 -0.873 16.8-148.7-139.8 103.9 30.2 1.0 2.3 5 20 A T E -a 197 0A 79 -2,-0.3 2,-0.5 191,-0.2 193,-0.2 -0.580 15.8-134.3 -81.1 130.6 27.1 -0.4 4.0 6 21 A V - 0 0 0 191,-3.0 2,-0.3 -2,-0.3 -1,-0.1 -0.743 14.8-145.7 -97.8 127.1 26.8 0.5 7.8 7 22 A S > - 0 0 19 -2,-0.5 4,-0.9 1,-0.1 44,-0.9 -0.634 13.9-149.6 -94.4 140.6 25.9 -2.2 10.3 8 23 A S T 4 S+ 0 0 54 -2,-0.3 -1,-0.1 42,-0.2 42,-0.1 0.387 100.4 45.6 -85.2 2.4 23.8 -1.7 13.5 9 24 A T T 4 S+ 0 0 90 3,-0.0 -1,-0.1 43,-0.0 41,-0.1 0.726 127.7 15.6-110.2 -34.8 25.8 -4.5 15.2 10 25 A T T 4 S+ 0 0 22 123,-0.1 124,-2.0 124,-0.1 125,-1.3 0.697 98.4 92.0-115.3 -28.5 29.4 -3.8 14.3 11 26 A D E < -b 135 0B 0 -4,-0.9 40,-2.0 122,-0.2 41,-0.9 -0.608 46.6-177.6 -89.2 131.5 29.9 -0.3 13.1 12 27 A V E -bc 136 52B 0 123,-1.9 125,-3.3 -2,-0.4 2,-0.4 -0.972 14.8-145.2-128.3 136.9 30.7 2.6 15.4 13 28 A L E -bc 137 53B 0 39,-2.3 41,-2.9 -2,-0.4 2,-0.5 -0.884 8.2-164.0-105.2 131.4 31.1 6.3 14.7 14 29 A I E -bc 138 54B 0 123,-3.2 125,-2.2 -2,-0.4 2,-0.7 -0.967 4.0-160.3-114.9 120.4 33.7 8.5 16.5 15 30 A I E -bc 139 55B 1 39,-3.1 41,-2.2 -2,-0.5 2,-0.7 -0.888 20.7-140.3 -99.9 112.1 33.2 12.3 16.3 16 31 A A E -b 140 0B 0 123,-3.6 125,-3.3 -2,-0.7 3,-0.1 -0.653 54.9 -42.5 -89.6 111.8 36.6 13.8 17.1 17 32 A D + 0 0 6 -2,-0.7 2,-1.4 1,-0.2 -1,-0.2 0.854 60.0 173.7 48.6 58.2 36.7 17.0 19.3 18 33 A M + 0 0 1 38,-0.5 70,-2.7 -3,-0.3 2,-0.2 -0.530 32.3 147.3 -89.3 69.2 33.9 19.1 17.8 19 34 A Q B >> -M 87 0C 0 -2,-1.4 4,-1.2 68,-0.3 3,-0.7 -0.598 63.4-104.3-111.9 166.5 34.4 21.7 20.5 20 35 A V H 3> S+ 0 0 34 66,-2.9 4,-2.2 63,-0.3 65,-0.2 0.818 113.4 54.0 -56.7 -41.0 34.0 25.5 20.8 21 36 A D H 34 S+ 0 0 16 63,-2.0 8,-1.4 65,-0.2 -1,-0.2 0.797 112.3 41.2 -68.2 -32.5 37.8 26.3 20.8 22 37 A F H <4 S+ 0 0 19 -3,-0.7 9,-3.2 62,-0.3 12,-0.2 0.722 130.7 24.2 -85.6 -21.9 38.6 24.5 17.5 23 38 A L H < S+ 0 0 2 -4,-1.2 12,-0.3 7,-0.2 -2,-0.2 0.826 98.6 79.5-116.3 -49.2 35.5 25.6 15.7 24 39 A A S >< S- 0 0 16 -4,-2.2 3,-1.8 -5,-0.3 2,-0.0 -0.272 83.2 -95.8 -76.5 153.4 33.8 28.9 17.0 25 40 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.388 116.6 23.6 -55.9 142.2 34.9 32.5 16.3 26 41 A G T 3 S+ 0 0 88 1,-0.3 2,-0.2 -3,-0.1 -2,-0.1 0.539 89.7 143.7 66.2 6.1 37.0 33.7 19.2 27 42 A G < - 0 0 16 -3,-1.8 3,-0.4 -7,-0.2 -1,-0.3 -0.548 56.6-127.0 -69.2 145.9 37.9 30.1 19.9 28 43 A S S S+ 0 0 50 1,-0.2 2,-0.3 -2,-0.2 -6,-0.1 0.674 96.8 33.0 -76.2 -19.2 41.6 29.9 21.1 29 44 A L S S- 0 0 23 -8,-1.4 2,-0.4 45,-0.1 -1,-0.2 -0.696 82.5-160.9-139.9 83.0 42.8 27.2 18.6 30 45 A H - 0 0 88 -3,-0.4 2,-0.7 -2,-0.3 -7,-0.2 -0.509 11.9-156.8 -85.8 123.9 41.0 27.5 15.3 31 46 A V > - 0 0 0 -9,-3.2 3,-2.3 -2,-0.4 4,-0.4 -0.831 30.1-123.1 -91.3 114.7 40.8 24.7 12.7 32 47 A K T 3 S+ 0 0 161 -2,-0.7 138,-0.2 138,-0.3 -9,-0.0 -0.350 94.4 9.0 -62.2 127.6 40.1 26.4 9.4 33 48 A G T 3 S+ 0 0 45 -10,-0.1 4,-0.3 136,-0.1 -1,-0.3 0.547 93.0 122.0 80.3 7.5 36.9 24.9 7.8 34 49 A G X + 0 0 0 -3,-2.3 3,-1.1 -12,-0.2 4,-0.3 0.875 69.9 51.8 -68.7 -43.0 36.1 23.1 11.0 35 50 A E G > S+ 0 0 86 -4,-0.4 3,-2.1 -12,-0.3 4,-0.3 0.888 100.2 64.9 -59.6 -40.1 32.6 24.7 11.5 36 51 A A G 3 S+ 0 0 80 1,-0.3 3,-0.5 2,-0.1 4,-0.4 0.647 89.4 68.4 -61.2 -16.8 31.7 23.8 7.9 37 52 A L G X> S+ 0 0 14 -3,-1.1 4,-1.9 -4,-0.3 3,-0.5 0.737 75.8 86.9 -71.0 -22.9 31.8 20.1 8.9 38 53 A L H <> S+ 0 0 14 -3,-2.1 4,-1.9 -4,-0.3 54,-0.2 0.820 82.1 55.7 -56.5 -38.2 28.8 20.4 11.1 39 54 A D H 3> S+ 0 0 140 -3,-0.5 4,-1.4 -4,-0.3 -1,-0.2 0.953 112.2 41.4 -53.0 -54.4 26.2 19.8 8.4 40 55 A G H <> S+ 0 0 21 -3,-0.5 4,-2.7 -4,-0.4 -2,-0.2 0.834 112.3 50.9 -71.1 -40.1 27.8 16.4 7.2 41 56 A I H X S+ 0 0 0 -4,-1.9 4,-3.4 2,-0.2 -1,-0.2 0.911 109.9 52.5 -64.5 -40.1 28.5 14.9 10.6 42 57 A N H X S+ 0 0 19 -4,-1.9 4,-1.8 -5,-0.3 -2,-0.2 0.862 111.3 47.7 -60.3 -36.3 24.9 15.7 11.7 43 58 A A H X S+ 0 0 33 -4,-1.4 4,-2.8 2,-0.2 5,-0.2 0.943 114.3 44.3 -68.6 -49.1 23.8 13.9 8.6 44 59 A V H X S+ 0 0 9 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.930 114.9 51.0 -63.7 -42.6 26.0 10.9 9.2 45 60 A S H < S+ 0 0 2 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.841 121.8 30.0 -60.9 -38.6 25.0 10.9 12.9 46 61 A S H < S+ 0 0 66 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.728 119.1 49.3-100.1 -23.3 21.3 10.9 12.3 47 62 A Q H < S+ 0 0 140 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.497 99.6 72.4 -97.3 -3.5 20.8 9.1 8.9 48 63 A L S < S- 0 0 16 -4,-1.0 2,-1.7 -5,-0.2 -41,-0.1 -0.937 74.7-131.6-123.4 138.8 22.9 6.0 9.6 49 64 A P + 0 0 37 0, 0.0 -38,-0.2 0, 0.0 2,-0.1 -0.357 39.0 171.1 -84.0 56.1 22.2 3.0 11.9 50 65 A F - 0 0 9 -2,-1.7 -42,-0.2 -5,-0.2 -38,-0.2 -0.429 39.5-131.7 -63.5 140.1 25.5 2.8 13.8 51 66 A R S S- 0 0 40 -40,-2.0 2,-0.3 -44,-0.9 -39,-0.2 0.902 88.2 -5.1 -46.7 -47.4 25.7 0.4 16.7 52 67 A Y E -c 12 0B 2 -41,-0.9 -39,-2.3 2,-0.0 2,-0.4 -0.984 60.2-153.4-156.7 149.1 27.2 3.2 18.7 53 68 A Q E -c 13 0B 1 -2,-0.3 44,-2.3 -41,-0.2 45,-1.1 -1.000 11.5-164.7-136.5 136.5 28.5 6.8 18.4 54 69 A V E -cd 14 98B 0 -41,-2.9 -39,-3.1 -2,-0.4 2,-0.5 -0.978 7.9-158.2-127.2 126.5 31.1 8.5 20.6 55 70 A A E -cd 15 99B 0 43,-2.1 45,-2.3 -2,-0.4 2,-0.2 -0.899 17.2-153.2 -97.4 128.0 32.0 12.2 20.9 56 71 A T E - d 0 100B 0 -41,-2.2 -38,-0.5 -2,-0.5 2,-0.3 -0.611 5.9-158.4 -94.2 162.6 35.5 12.8 22.2 57 72 A Q E - d 0 101B 11 43,-2.0 45,-2.4 -2,-0.2 2,-0.3 -0.923 19.1-136.2-146.2 117.0 36.5 15.9 24.1 58 73 A D E - d 0 102B 8 -2,-0.3 2,-0.2 43,-0.2 45,-0.2 -0.578 33.8-178.0 -62.6 131.8 39.9 17.5 24.6 59 74 A W + 0 0 8 43,-2.6 20,-0.2 -2,-0.3 19,-0.1 -0.638 3.2 177.1-146.4 77.1 39.6 18.3 28.3 60 75 A H B -n 79 0D 0 18,-2.8 20,-3.3 17,-0.3 44,-0.2 -0.629 30.3-121.9 -97.0 142.3 42.6 20.0 29.8 61 76 A P > - 0 0 18 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.434 41.3-104.4 -68.3 155.3 43.4 21.4 33.3 62 77 A E T 3 S+ 0 0 162 1,-0.3 17,-0.1 18,-0.1 -2,-0.0 0.563 119.1 45.0 -67.5 -8.9 44.2 25.2 33.2 63 78 A N T 3 S+ 0 0 70 7,-0.0 -1,-0.3 13,-0.0 16,-0.0 -0.116 84.6 166.9-121.8 33.8 48.0 24.6 33.7 64 79 A H X - 0 0 0 -3,-1.5 3,-1.7 1,-0.1 6,-0.3 -0.126 44.1-126.1 -63.3 144.1 48.4 21.8 31.1 65 80 A C T 3 S+ 0 0 42 41,-2.0 -1,-0.1 1,-0.3 42,-0.1 0.727 107.3 59.3 -57.6 -26.0 51.8 20.6 29.9 66 81 A S T 3 S+ 0 0 4 6,-0.2 8,-2.3 40,-0.2 -1,-0.3 0.482 82.6 102.0 -88.4 -2.3 50.8 21.1 26.3 67 82 A F B X >S-o 74 0E 0 -3,-1.7 5,-3.0 6,-0.2 3,-1.6 -0.564 79.7-125.8 -79.3 144.8 50.0 24.8 26.6 68 83 A V G > 5S+ 0 0 77 6,-2.7 3,-1.4 1,-0.3 -1,-0.1 0.796 109.5 66.5 -56.1 -30.2 52.7 27.3 25.4 69 84 A T G 3 5S+ 0 0 91 5,-0.3 -1,-0.3 1,-0.3 -4,-0.1 0.699 108.7 37.4 -67.1 -18.6 52.6 28.9 28.8 70 85 A H G < 5S- 0 0 99 -3,-1.6 -1,-0.3 -6,-0.3 -2,-0.2 0.122 132.7 -85.8-120.5 17.0 54.1 25.7 30.2 71 86 A G T < 5S+ 0 0 71 -3,-1.4 -3,-0.3 1,-0.3 -2,-0.1 0.556 89.7 121.1 92.7 11.1 56.4 24.9 27.3 72 87 A G S -n 60 0D 37 -20,-0.2 3,-0.5 1,-0.1 6,-0.5 -0.561 36.8 -91.7 -71.7 136.1 40.1 24.0 29.7 80 95 A Q T 3 S+ 0 0 33 -20,-3.3 -18,-0.1 -2,-0.3 215,-0.1 -0.251 109.2 7.0 -50.1 120.4 38.0 21.7 31.9 81 96 A G T 3 S+ 0 0 53 1,-0.3 2,-0.3 213,-0.1 -1,-0.2 0.965 100.4 124.0 68.0 56.6 34.6 23.5 32.5 82 97 A S S X> S- 0 0 36 -3,-0.5 3,-1.0 1,-0.1 4,-0.9 -0.980 76.4-110.1-141.3 151.9 35.0 26.5 30.2 83 98 A A G >4 S+ 0 0 69 -2,-0.3 3,-1.1 1,-0.2 -63,-0.3 0.902 119.2 56.5 -40.6 -47.9 33.0 27.9 27.4 84 99 A G G 34 S+ 0 0 9 1,-0.3 -63,-2.0 -64,-0.1 -62,-0.3 0.772 100.6 54.7 -60.2 -35.3 35.9 26.7 25.1 85 100 A A G <4 S+ 0 0 0 -3,-1.0 -1,-0.3 -6,-0.5 -2,-0.2 0.645 86.1 105.4 -77.0 -18.4 35.8 23.1 26.1 86 101 A Q S << S- 0 0 118 -3,-1.1 -66,-2.9 -4,-0.9 -65,-0.2 -0.245 81.7-103.4 -64.1 149.4 32.1 22.5 25.3 87 102 A L B -M 19 0C 34 -68,-0.3 -68,-0.3 1,-0.1 -1,-0.1 -0.557 53.7 -90.6 -64.4 137.0 31.0 20.6 22.3 88 103 A H > - 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0 0 6 -3,-1.0 -3,-0.4 2,-0.0 2,-0.2 -1.000 61.6-151.3-144.9 141.1 50.4 14.1 30.1 109 124 A D - 0 0 14 -2,-0.3 8,-3.9 -44,-0.1 9,-0.2 -0.458 5.9-165.5-101.5 179.1 48.9 14.8 26.7 110 125 A S + 0 0 0 6,-0.3 6,-0.1 -2,-0.2 36,-0.0 -0.545 21.4 168.4-170.0 94.7 46.7 12.7 24.5 111 126 A Y S S+ 0 0 60 -2,-0.1 39,-0.2 4,-0.1 2,-0.1 0.845 72.7 76.4 -73.7 -34.9 45.9 13.3 20.8 112 127 A S S S- 0 0 7 3,-0.4 -9,-0.1 37,-0.2 35,-0.1 -0.408 74.3-145.4 -73.0 147.7 44.5 9.8 20.6 113 128 A A S S+ 0 0 0 33,-0.3 11,-0.4 -2,-0.1 -1,-0.1 0.536 98.9 55.2 -86.2 -7.3 41.0 9.1 22.1 114 129 A F S S+ 0 0 2 1,-0.3 8,-2.7 10,-0.1 9,-0.5 0.921 113.0 18.1 -87.9 -53.5 42.4 5.6 23.0 115 130 A V B -P 121 0F 53 6,-0.2 -3,-0.4 7,-0.1 -1,-0.3 -0.973 65.8-127.1-130.3 136.1 45.5 6.3 25.1 116 131 A E > - 0 0 18 4,-3.3 3,-1.8 -2,-0.4 -6,-0.3 -0.336 46.3 -98.9 -61.0 158.0 47.0 9.1 27.1 117 132 A D T 3 S+ 0 0 129 -8,-3.9 -7,-0.1 1,-0.3 -1,-0.1 0.525 122.4 55.9 -61.6 -9.7 50.7 9.9 26.1 118 133 A N T 3 S- 0 0 90 -9,-0.2 -1,-0.3 2,-0.2 3,-0.1 -0.012 124.1 -95.0-114.6 24.1 51.9 7.9 29.1 119 134 A G S < S+ 0 0 63 -3,-1.8 2,-0.2 1,-0.3 -2,-0.1 0.195 79.2 138.0 85.7 -17.9 50.2 4.6 28.3 120 135 A V - 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f 0 657N 16 -204,-2.4 2,-0.3 -2,-0.5 -43,-0.2 -0.727 18.7-179.1 -91.8 141.3 85.6 71.3 31.3 702 117 D K E + f 0 658N 1 -45,-2.9 -43,-2.8 -2,-0.3 8,-0.1 -0.918 55.4 40.6-141.4 162.1 82.7 69.1 32.1 703 118 D G S S+ 0 0 0 -2,-0.3 -1,-0.1 -45,-0.2 7,-0.1 0.750 71.4 154.4 69.5 30.7 78.9 68.7 31.3 704 119 D V + 0 0 21 -44,-0.2 2,-0.3 -3,-0.1 5,-0.1 0.521 43.1 61.9 -80.0 -11.4 80.0 69.7 27.8 705 120 D T B > S-R 708 0X 46 3,-0.6 3,-1.2 1,-0.1 -40,-0.2 -0.910 76.9-126.3-120.5 149.9 77.1 68.1 25.7 706 121 D Q T 3 S+ 0 0 27 -2,-0.3 -41,-2.5 1,-0.2 -40,-0.2 0.841 103.4 49.9 -57.7 -42.6 73.4 68.7 25.7 707 122 D Q T 3 S+ 0 0 155 -43,-0.2 2,-0.3 1,-0.1 -1,-0.2 0.485 110.7 45.0 -85.5 -3.2 72.1 65.2 26.3 708 123 D A B < -R 705 0X 12 -3,-1.2 -3,-0.6 -5,-0.1 -1,-0.1 -0.952 62.2-151.5-153.3 128.2 74.3 64.2 29.3 709 124 D D - 0 0 8 -2,-0.3 8,-2.9 7,-0.1 9,-0.2 -0.080 6.1-164.5 -83.9-179.8 75.4 65.8 32.7 710 125 D S + 0 0 0 6,-0.2 6,-0.1 7,-0.1 36,-0.0 -0.386 22.0 167.4-173.3 93.7 78.6 65.2 34.7 711 126 D Y S S+ 0 0 51 -2,-0.1 39,-0.2 34,-0.1 34,-0.1 0.925 70.8 79.6 -67.8 -46.1 79.2 66.2 38.3 712 127 D S S S- 0 0 6 3,-0.2 38,-0.1 37,-0.2 35,-0.1 -0.240 75.5-144.0 -59.6 148.1 82.3 64.1 38.4 713 128 D A S S+ 0 0 0 33,-0.3 11,-0.3 1,-0.1 -1,-0.1 0.324 94.7 54.0 -93.9 6.7 85.5 65.5 36.8 714 129 D F S S+ 0 0 4 1,-0.4 8,-2.6 10,-0.1 9,-0.6 0.750 114.5 14.5-109.5 -36.7 86.6 62.1 35.4 715 130 D V B -S 721 0Y 45 6,-0.3 -1,-0.4 7,-0.1 -3,-0.2 -0.997 65.6-130.7-146.3 138.5 83.6 60.8 33.4 716 131 D E > - 0 0 19 4,-2.5 3,-1.6 -2,-0.3 -6,-0.2 -0.267 43.0 -95.2 -77.0 172.6 80.4 62.2 31.9 717 132 D D T 3 S+ 0 0 111 -8,-2.9 -7,-0.1 1,-0.3 -8,-0.1 0.565 123.1 60.9 -68.8 -8.0 77.0 60.5 32.5 718 133 D N T 3 S- 0 0 80 -9,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.301 119.9-105.1-100.2 5.4 77.4 58.7 29.1 719 134 D G S < S+ 0 0 61 -3,-1.6 2,-0.6 1,-0.3 -2,-0.1 0.492 74.7 143.0 82.6 5.9 80.6 56.9 30.1 720 135 D V - 0 0 54 1,-0.0 -4,-2.5 2,-0.0 -1,-0.3 -0.700 47.8-132.3 -84.2 118.4 82.7 59.2 28.0 721 136 D S B -S 715 0Y 31 -2,-0.6 -6,-0.3 -6,-0.2 -7,-0.1 -0.371 8.3-148.9 -71.9 147.0 86.0 59.9 29.9 722 137 D T - 0 0 4 -8,-2.6 -7,-0.1 -2,-0.1 -1,-0.1 0.587 42.6-118.4 -87.2 -12.2 87.4 63.5 30.3 723 138 D G S > S+ 0 0 0 -9,-0.6 4,-2.5 -193,-0.1 -193,-0.2 0.366 81.5 120.0 91.7 -3.9 90.9 62.1 30.2 724 139 D L H > S+ 0 0 0 -11,-0.3 4,-2.7 -10,-0.2 5,-0.2 0.910 71.5 51.9 -61.1 -48.4 91.7 63.3 33.8 725 140 D A H > S+ 0 0 11 -11,-0.2 4,-2.2 1,-0.2 5,-0.2 0.951 112.7 47.0 -50.6 -53.6 92.4 59.8 35.2 726 141 D G H > S+ 0 0 16 1,-0.2 4,-2.0 2,-0.2 -199,-0.2 0.910 111.4 50.1 -55.4 -50.6 94.9 59.2 32.3 727 142 D L H X S+ 0 0 0 -4,-2.5 4,-0.8 -201,-0.3 -1,-0.2 0.904 112.2 48.7 -53.1 -47.5 96.6 62.5 32.7 728 143 D L H ><>S+ 0 0 0 -4,-2.7 5,-2.0 1,-0.2 3,-0.5 0.896 111.5 46.1 -64.5 -44.5 97.1 62.0 36.5 729 144 D H H ><5S+ 0 0 92 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.910 108.4 57.9 -65.4 -40.0 98.5 58.5 36.3 730 145 D S H 3<5S+ 0 0 59 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.679 105.0 48.9 -69.0 -21.6 100.9 59.4 33.5 731 146 D I T <<5S- 0 0 15 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.398 123.0-107.9 -98.4 0.5 102.6 62.2 35.5 732 147 D G T < 5 + 0 0 41 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.533 58.8 161.8 94.5 11.6 102.9 59.7 38.4 733 148 D A < + 0 0 4 -5,-2.0 -1,-0.2 1,-0.1 -122,-0.2 -0.282 14.7 171.4 -65.8 147.6 100.3 61.0 40.9 734 149 D R + 0 0 180 -124,-2.9 26,-2.7 1,-0.3 2,-0.4 0.555 64.8 44.7-125.9 -25.4 99.2 58.6 43.7 735 150 D R E -dg 611 760N 68 -125,-2.1 -123,-1.8 24,-0.2 2,-0.5 -0.988 63.5-158.6-131.2 130.0 97.1 60.8 45.9 736 151 D V E -dg 612 761N 0 24,-3.1 26,-2.8 -2,-0.4 2,-0.6 -0.941 4.4-155.4-112.2 131.2 94.5 63.4 45.0 737 152 D F E -dg 613 762N 0 -125,-3.6 -123,-3.3 -2,-0.5 2,-0.4 -0.904 16.5-160.6 -99.8 123.0 93.4 66.3 47.3 738 153 D V E +dg 614 763N 0 24,-2.3 26,-2.5 -2,-0.6 2,-0.3 -0.901 21.5 148.8-110.2 131.5 89.9 67.5 46.5 739 154 D C E +d 615 0N 0 -125,-2.4 -123,-2.9 -2,-0.4 2,-0.3 -0.940 29.8 64.6-146.3 171.4 88.4 70.9 47.4 740 155 D G E S+dg 616 768N 0 27,-2.5 29,-0.9 -2,-0.3 2,-0.3 -0.859 71.9 1.4 116.5-154.1 85.8 73.3 46.0 741 156 D V E S+ g 0 769N 1 -125,-2.4 29,-0.1 -2,-0.3 -2,-0.1 -0.937 97.9 24.8-133.9 155.0 82.1 73.1 45.3 742 157 D A > > - 0 0 10 27,-0.6 3,-2.1 -2,-0.3 5,-1.7 0.501 51.4-171.4 -99.9 140.9 79.7 71.5 45.5 743 158 D Y T 3 >S+ 0 0 6 26,-2.5 5,-0.9 1,-0.3 27,-0.2 0.866 92.5 44.2 -48.2 -46.4 80.5 69.0 48.3 744 159 D D T 3 5S+ 0 0 2 25,-0.2 -1,-0.3 3,-0.1 26,-0.1 0.329 129.2 19.9 -86.5 4.4 77.4 67.0 47.6 745 160 D F T <>5S+ 0 0 43 -3,-2.1 4,-3.0 -34,-0.1 5,-0.3 0.296 129.4 15.6-133.5 -94.4 77.9 67.0 43.8 746 161 D C H >5S+ 0 0 2 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.938 129.0 47.5 -51.3 -54.6 81.1 67.6 41.9 747 162 D V H >< S+ 0 0 0 -4,-2.3 3,-0.9 1,-0.2 5,-0.3 0.952 104.6 48.2 -54.2 -50.3 89.1 59.1 41.9 755 170 D R H >< S+ 0 0 78 -4,-1.6 3,-2.3 1,-0.2 4,-0.3 0.912 104.5 59.7 -55.0 -47.9 89.0 56.1 44.1 756 171 D K H 3< S+ 0 0 157 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.754 103.6 52.4 -52.1 -28.3 87.6 54.0 41.3 757 172 D N T << S- 0 0 60 -4,-1.2 -1,-0.3 -3,-0.9 -2,-0.2 0.201 126.1-101.8 -93.2 17.4 90.8 54.8 39.4 758 173 D G S < S+ 0 0 54 -3,-2.3 2,-0.3 1,-0.2 -3,-0.2 0.999 73.0 141.4 52.9 70.8 93.0 53.6 42.3 759 174 D F - 0 0 4 -4,-0.3 2,-0.3 -5,-0.3 -24,-0.2 -0.967 54.0-120.9-126.9 152.1 93.9 57.0 43.8 760 175 D S E -g 735 0N 60 -26,-2.7 -24,-3.1 -2,-0.3 2,-0.5 -0.711 36.9-149.8 -81.4 146.5 94.3 57.8 47.4 761 176 D V E -g 736 0N 5 26,-0.4 28,-2.4 -2,-0.3 2,-0.6 -0.964 21.5-174.6-131.9 121.5 91.9 60.7 48.2 762 177 D V E -gh 737 789N 7 -26,-2.8 -24,-2.3 -2,-0.5 2,-0.6 -0.952 11.6-159.7-111.1 113.9 92.0 63.5 50.7 763 178 D L E -gh 738 790N 0 26,-1.9 28,-2.7 -2,-0.6 2,-1.5 -0.806 13.1-144.1 -83.0 122.0 88.9 65.7 50.8 764 179 D L E > - h 0 791N 0 -26,-2.5 3,-2.4 -2,-0.6 -24,-0.3 -0.662 21.2-175.1 -87.4 85.7 89.8 69.0 52.4 765 180 D E E > S+ 0 0 68 -2,-1.5 3,-1.0 26,-0.9 -1,-0.2 0.764 77.4 59.2 -61.6 -31.1 86.5 69.4 54.2 766 181 D D E 3 S+ 0 0 63 25,-0.4 -1,-0.3 1,-0.3 -126,-0.1 0.683 104.9 55.9 -68.5 -14.7 87.2 72.9 55.6 767 182 D L E < S+ 0 0 9 -3,-2.4 -27,-2.5 -29,-0.2 2,-0.3 -0.184 97.0 74.2-112.0 40.7 87.5 73.9 51.9 768 183 D T E < -g 740 0N 21 -3,-1.0 2,-0.3 -29,-0.2 -27,-0.2 -0.976 53.2-163.3-141.3 159.0 84.1 72.8 50.5 769 184 D A E -g 741 0N 12 -29,-0.9 -26,-2.5 -2,-0.3 -27,-0.6 -0.993 16.1-129.4-142.5 151.6 80.5 73.9 50.6 770 185 D A - 0 0 10 -2,-0.3 -138,-0.4 -28,-0.2 3,-0.3 -0.678 12.4-141.4-104.7 150.7 77.2 72.2 49.7 771 186 D V S S+ 0 0 54 1,-0.3 2,-0.4 -2,-0.3 -139,-0.2 0.932 105.8 12.9 -63.4 -50.2 74.2 73.0 47.6 772 187 D D > - 0 0 90 1,-0.1 3,-1.5 -141,-0.1 -1,-0.3 -0.958 69.9-157.9-134.1 113.9 72.0 71.4 50.3 773 188 D D G > S+ 0 0 123 -2,-0.4 3,-2.0 -3,-0.3 4,-0.3 0.724 85.9 75.0 -64.9 -24.4 73.6 70.7 53.7 774 189 D A G 3 S+ 0 0 86 1,-0.3 3,-0.5 2,-0.1 4,-0.3 0.775 88.5 62.6 -58.3 -25.7 71.0 68.0 54.6 775 190 D A G X> S+ 0 0 26 -3,-1.5 4,-2.3 1,-0.2 3,-0.6 0.635 79.2 91.2 -72.7 -16.1 72.8 65.7 52.1 776 191 D W H <> S+ 0 0 132 -3,-2.0 4,-2.9 1,-0.2 5,-0.3 0.855 80.2 52.5 -51.4 -50.3 76.0 65.8 54.2 777 192 D S H 3> S+ 0 0 82 -3,-0.5 4,-1.8 -4,-0.3 -1,-0.2 0.875 114.2 42.6 -57.2 -41.2 75.3 62.8 56.4 778 193 D A H <> S+ 0 0 64 -3,-0.6 4,-2.1 -4,-0.3 -2,-0.2 0.931 117.1 43.6 -75.1 -48.7 74.6 60.5 53.5 779 194 D R H X S+ 0 0 68 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.909 113.4 52.9 -64.7 -43.6 77.4 61.6 51.2 780 195 D T H X S+ 0 0 12 -4,-2.9 4,-2.3 -5,-0.3 5,-0.2 0.928 109.4 49.7 -54.0 -50.2 79.9 61.6 54.1 781 196 D A H X S+ 0 0 53 -4,-1.8 4,-2.2 -5,-0.3 -2,-0.2 0.934 112.5 45.5 -55.0 -51.3 78.9 58.0 55.0 782 197 D E H X S+ 0 0 115 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.857 110.9 55.1 -65.5 -36.0 79.4 56.8 51.4 783 198 D L H <>S+ 0 0 0 -4,-2.5 5,-2.2 2,-0.2 -1,-0.2 0.920 108.8 46.3 -57.7 -48.4 82.7 58.7 51.1 784 199 D K H ><5S+ 0 0 122 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.869 110.9 53.0 -67.2 -37.3 84.1 57.0 54.2 785 200 D D H 3<5S+ 0 0 151 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.755 106.2 54.4 -63.9 -28.8 82.9 53.6 52.9 786 201 D A T 3<5S- 0 0 29 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.394 122.5-108.4 -89.1 3.8 84.7 54.3 49.6 787 202 D G T < 5 + 0 0 43 -3,-1.1 -26,-0.4 1,-0.3 2,-0.3 0.600 67.6 146.6 84.7 13.2 87.9 54.9 51.6 788 203 D V < - 0 0 5 -5,-2.2 2,-0.5 -28,-0.1 -1,-0.3 -0.609 41.3-137.9 -76.5 140.2 88.2 58.7 51.2 789 204 D V E -h 762 0N 83 -28,-2.4 -26,-1.9 -2,-0.3 2,-0.5 -0.899 6.9-145.5-106.7 126.5 89.7 60.5 54.1 790 205 D L E +h 763 0N 27 -2,-0.5 2,-0.3 -28,-0.2 -26,-0.2 -0.792 31.5 164.7 -93.1 126.7 88.2 63.7 55.3 791 206 D L E -h 764 0N 25 -28,-2.7 -26,-0.9 -2,-0.5 -25,-0.4 -0.991 38.2-117.6-148.0 144.6 90.8 66.2 56.6 792 207 D K > - 0 0 124 -2,-0.3 3,-2.1 -28,-0.2 4,-0.2 -0.690 26.8-128.9 -85.4 137.0 91.3 69.8 57.5 793 208 D S G > S+ 0 0 23 -2,-0.3 3,-1.5 1,-0.3 -1,-0.1 0.658 101.7 76.3 -63.3 -18.6 93.8 71.7 55.4 794 209 D S G 3 S+ 0 0 101 1,-0.3 -1,-0.3 -191,-0.0 -3,-0.0 0.803 87.7 61.9 -59.9 -29.6 95.5 73.0 58.6 795 210 D A G < S+ 0 0 13 -3,-2.1 -191,-2.7 -192,-0.1 -1,-0.3 0.661 83.6 104.2 -67.6 -18.3 97.0 69.5 58.9 796 211 D L E < -n 604 0T 16 -3,-1.5 2,-0.3 -4,-0.2 -191,-0.2 -0.478 48.7-177.5 -74.3 131.5 98.9 69.9 55.5 797 212 D V E -n 605 0T 57 -193,-3.4 -191,-2.8 -2,-0.2 -2,-0.0 -0.962 26.1-128.0-129.7 154.7 102.6 70.6 55.6 798 213 D A 0 0 48 -2,-0.3 -1,-0.1 -193,-0.2 -190,-0.1 0.945 360.0 360.0 -66.8 -63.6 105.1 71.2 52.7 799 214 D E 0 0 149 -194,-0.1 -1,-0.1 -192,-0.1 -192,-0.0 -0.339 360.0 360.0 171.4 360.0 108.2 68.9 53.0