==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-JUN-13 4BRD . COMPND 2 MOLECULE: ECTONUCLEOSIDE TRIPHOSPHATE DIPHOSPHOHYDROLASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: LEGIONELLA PNEUMOPHILA; . AUTHOR M.ZEBISCH,P.SCHAEFER,P.LAUBLE,N.STRAETER . 717 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29107.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 517 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 55 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 95 13.2 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.0 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 . 43 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 85 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.5 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 2 4 2 2 0 0 0 4 5 1 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 0 2 3 1 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 . 3 1 1 2 0 2 2 2 2 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 . 0 0 0 2 0 1 1 0 0 0 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 34 A M 0 0 140 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 133.9 60.1 1.2 -18.6 2 35 A D - 0 0 83 1,-0.1 2,-0.3 3,-0.0 4,-0.1 -0.415 360.0-102.7 -72.9 153.8 62.4 2.9 -21.0 3 36 A T S S+ 0 0 124 1,-0.3 4,-0.1 -2,-0.1 -1,-0.1 -0.679 113.8 10.5 -66.6 134.3 66.2 2.5 -21.1 4 37 A N S > S- 0 0 94 -2,-0.3 3,-2.3 1,-0.1 4,-0.4 0.965 83.1-174.4 55.5 56.0 67.6 5.6 -19.4 5 38 A P G >> S+ 0 0 18 0, 0.0 3,-1.6 0, 0.0 4,-0.9 0.788 74.4 64.2 -57.3 -28.7 64.1 6.6 -18.3 6 39 A a G 34 S+ 0 0 26 1,-0.3 5,-0.1 2,-0.2 -2,-0.1 0.562 93.5 61.9 -77.1 -3.0 65.3 10.0 -16.9 7 40 A E G <4 S+ 0 0 137 -3,-2.3 -1,-0.3 -4,-0.1 -3,-0.1 0.613 115.2 33.2 -89.0 -10.2 66.3 11.1 -20.4 8 41 A K T <4 S+ 0 0 144 -3,-1.6 2,-0.3 -4,-0.4 -2,-0.2 0.442 124.2 29.5-123.3 -8.3 62.6 10.8 -21.4 9 42 A H S < S- 0 0 53 -4,-0.9 21,-0.2 21,-0.1 -1,-0.2 -0.964 87.7 -86.1-147.2 160.0 60.7 11.8 -18.2 10 43 A S E -A 29 0A 61 19,-1.3 19,-2.3 -2,-0.3 2,-0.4 -0.414 47.3-165.3 -64.9 147.6 61.0 13.9 -15.2 11 44 A a E +A 28 0A 11 17,-0.2 2,-0.3 -5,-0.1 17,-0.2 -0.995 13.5 179.5-138.6 144.3 62.8 12.2 -12.3 12 45 A I E -A 27 0A 0 15,-1.9 15,-2.8 -2,-0.4 2,-0.4 -0.971 20.9-136.2-139.3 149.4 63.2 12.9 -8.6 13 46 A A E -Ab 26 80A 0 66,-2.9 68,-2.0 -2,-0.3 2,-0.4 -0.929 19.7-175.5 -99.8 131.9 65.1 11.1 -5.7 14 47 A V E -Ab 25 81A 0 11,-2.8 11,-2.2 -2,-0.4 2,-0.5 -0.997 8.0-159.5-129.0 128.0 63.2 10.7 -2.4 15 48 A I E -Ab 24 82A 0 66,-3.0 68,-2.5 -2,-0.4 2,-0.9 -0.945 7.2-154.9-112.0 122.8 65.1 9.2 0.6 16 49 A D E -Ab 23 83A 6 7,-2.5 7,-2.4 -2,-0.5 2,-1.3 -0.879 10.8-165.7 -89.7 103.9 63.1 7.7 3.5 17 50 A A E +Ab 22 84A 3 66,-2.6 68,-2.1 -2,-0.9 71,-0.3 -0.753 22.2 176.7 -92.5 88.4 65.6 8.1 6.4 18 51 A G - 0 0 6 3,-2.1 34,-0.5 -2,-1.3 3,-0.4 -0.328 44.5 -98.8 -91.3 173.2 63.8 5.8 8.8 19 52 A S S S+ 0 0 30 1,-0.2 32,-0.6 32,-0.1 35,-0.1 0.821 121.0 35.6 -64.2 -27.8 64.8 4.6 12.2 20 53 A T S S- 0 0 61 1,-0.3 2,-0.3 30,-0.2 -1,-0.2 0.555 130.6 -25.4-102.2 -8.9 66.2 1.2 11.1 21 54 A G - 0 0 0 -3,-0.4 -3,-2.1 29,-0.2 2,-0.4 -0.976 60.8 -99.7 176.5 171.4 67.7 2.2 7.7 22 55 A S E -AC 17 48A 0 26,-2.1 26,-2.5 28,-0.3 2,-0.5 -0.943 25.9-160.4-118.2 138.9 67.6 4.7 4.8 23 56 A R E -AC 16 47A 51 -7,-2.4 -7,-2.5 -2,-0.4 2,-0.5 -0.958 2.7-158.3-124.1 117.2 65.8 3.9 1.4 24 57 A L E -AC 15 46A 0 22,-3.3 22,-2.1 -2,-0.5 2,-0.4 -0.774 13.7-177.4 -85.8 131.2 66.7 5.8 -1.7 25 58 A H E -AC 14 45A 2 -11,-2.2 -11,-2.8 -2,-0.5 2,-0.5 -0.996 12.6-161.3-124.7 138.1 64.0 5.8 -4.4 26 59 A I E -AC 13 44A 0 18,-2.7 17,-3.2 -2,-0.4 18,-1.2 -0.982 15.6-167.8-113.8 125.5 64.3 7.4 -7.8 27 60 A Y E -AC 12 42A 7 -15,-2.8 -15,-1.9 -2,-0.5 2,-0.3 -0.943 12.1-156.8-114.0 132.8 60.9 7.9 -9.6 28 61 A S E +AC 11 41A 8 13,-2.5 13,-2.8 -2,-0.5 2,-0.3 -0.744 26.9 160.4 -93.6 148.9 60.2 8.8 -13.1 29 62 A Y E -A 10 0A 16 -19,-2.3 -19,-1.3 -2,-0.3 2,-0.2 -0.983 32.2-138.0-156.2 162.6 56.9 10.5 -13.9 30 63 A D E - C 0 38A 51 8,-2.5 8,-2.6 -2,-0.3 2,-0.4 -0.604 26.5-127.3-107.9 179.0 55.0 12.6 -16.4 31 64 A T E - C 0 37A 52 6,-0.3 2,-0.1 -2,-0.2 -2,-0.0 -0.967 11.7-141.4-130.0 148.5 52.7 15.5 -15.5 32 65 A D > - 0 0 43 4,-2.3 3,-2.2 -2,-0.4 4,-0.1 -0.100 54.5 -59.2 -90.7-165.3 49.1 16.2 -16.5 33 66 A D T 3 S+ 0 0 167 1,-0.3 -2,-0.0 2,-0.1 -1,-0.0 0.624 136.3 44.6 -53.0 -22.9 47.5 19.5 -17.3 34 67 A T T 3 S- 0 0 102 2,-0.1 -1,-0.3 3,-0.0 148,-0.0 0.126 120.3-101.9-112.1 18.2 48.3 21.1 -13.9 35 68 A N S < S+ 0 0 127 -3,-2.2 -2,-0.1 1,-0.2 -4,-0.0 0.773 75.2 147.2 62.7 29.7 51.9 19.9 -13.8 36 69 A T - 0 0 28 -4,-0.1 -4,-2.3 1,-0.1 -1,-0.2 -0.812 53.3-106.1 -94.9 130.7 50.8 17.1 -11.3 37 70 A P E +C 31 0A 13 0, 0.0 2,-0.3 0, 0.0 -6,-0.3 -0.311 43.7 168.6 -59.8 143.4 52.8 13.8 -11.6 38 71 A I E +C 30 0A 32 -8,-2.6 -8,-2.5 1,-0.1 0, 0.0 -0.880 57.3 36.3-142.5 165.7 51.1 10.8 -13.2 39 72 A H E S- 0 0 118 -2,-0.3 2,-0.4 -10,-0.2 -1,-0.1 0.910 75.8-171.4 53.1 47.9 52.6 7.4 -14.3 40 73 A I E + 0 0 6 -11,-0.2 2,-0.4 -3,-0.1 -11,-0.2 -0.587 6.4 179.3 -72.6 128.6 55.0 7.4 -11.3 41 74 A E E -C 28 0A 93 -13,-2.8 -13,-2.5 -2,-0.4 2,-0.6 -0.996 29.2-129.0-134.6 130.8 57.4 4.5 -11.7 42 75 A E E +C 27 0A 74 -2,-0.4 -15,-0.3 -15,-0.2 3,-0.1 -0.715 28.4 173.9 -76.3 123.2 60.3 3.5 -9.4 43 76 A I E + 0 0 29 -17,-3.2 2,-0.3 -2,-0.6 -16,-0.2 0.595 65.4 16.9-105.1 -11.7 63.4 3.2 -11.5 44 77 A W E -C 26 0A 74 -18,-1.2 -18,-2.7 29,-0.0 -1,-0.3 -0.970 58.5-179.9-158.2 147.3 65.9 2.6 -8.8 45 78 A N E +C 25 0A 36 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.989 2.4 175.0-146.7 133.1 65.8 1.7 -5.1 46 79 A K E -C 24 0A 47 -22,-2.1 -22,-3.3 -2,-0.3 2,-0.5 -0.956 8.3-168.0-139.3 132.6 68.7 1.2 -2.6 47 80 A K E -C 23 0A 96 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.2 -0.968 8.1-177.7-120.6 129.8 68.2 0.4 1.1 48 81 A I E -C 22 0A 12 -26,-2.5 -26,-2.1 -2,-0.5 -2,-0.0 -0.901 19.3-110.9-122.0 151.1 71.1 0.6 3.6 49 82 A K S S+ 0 0 135 -2,-0.3 -28,-0.2 -28,-0.2 2,-0.1 -0.912 73.3 44.5-121.8 156.0 71.2 -0.1 7.3 50 83 A P S S- 0 0 31 0, 0.0 -28,-0.3 0, 0.0 -29,-0.2 0.597 87.9 -94.1 -87.0-168.1 71.5 1.2 10.0 51 84 A G > - 0 0 1 -32,-0.6 3,-1.2 -30,-0.2 4,-0.4 -0.269 27.8-119.6 -67.3 149.4 69.4 4.4 10.4 52 85 A F G > S+ 0 0 2 -34,-0.5 3,-1.5 1,-0.3 -1,-0.1 0.887 112.6 57.2 -55.0 -41.7 70.9 7.8 9.7 53 86 A A G 3 S+ 0 0 16 -35,-0.3 -1,-0.3 1,-0.3 -34,-0.1 0.653 97.4 64.1 -70.4 -17.1 70.2 9.0 13.3 54 87 A S G < S+ 0 0 74 -3,-1.2 -1,-0.3 -35,-0.1 -2,-0.2 0.608 85.8 88.1 -85.3 -6.1 72.3 6.1 14.6 55 88 A I S < S- 0 0 23 -3,-1.5 357,-0.0 -4,-0.4 7,-0.0 -0.490 89.9-103.7 -85.3 158.0 75.6 7.2 13.1 56 89 A Q - 0 0 91 -2,-0.1 2,-1.6 1,-0.1 5,-0.2 -0.729 40.1-122.3 -75.1 121.9 78.0 9.6 14.8 57 90 A P + 0 0 26 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.441 63.7 120.1 -75.8 87.1 77.5 13.0 13.0 58 91 A N S > S- 0 0 67 -2,-1.6 4,-2.6 1,-0.1 5,-0.3 -0.924 74.9-101.5-135.7 167.1 80.9 14.0 11.6 59 92 A S H > S+ 0 0 67 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.869 117.9 50.2 -57.9 -38.0 82.1 14.7 8.0 60 93 A V H > S+ 0 0 106 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.943 115.4 39.2 -65.9 -49.9 83.8 11.2 7.6 61 94 A T H > S+ 0 0 45 2,-0.2 4,-2.4 -5,-0.2 -2,-0.2 0.895 117.4 50.2 -73.2 -37.3 80.9 9.0 8.8 62 95 A I H X S+ 0 0 1 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.933 111.6 49.7 -65.1 -45.4 78.3 11.2 7.0 63 96 A D H X S+ 0 0 76 -4,-2.3 4,-2.4 -5,-0.3 5,-0.2 0.944 112.3 46.8 -55.1 -47.2 80.4 11.0 3.8 64 97 A A H X S+ 0 0 55 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.913 113.7 49.2 -67.0 -37.3 80.7 7.3 4.0 65 98 A Y H X S+ 0 0 17 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.949 114.4 41.8 -66.0 -50.6 77.0 6.9 4.7 66 99 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 5,-0.4 0.867 112.8 54.9 -68.5 -36.0 75.7 9.1 1.8 67 100 A T H X S+ 0 0 57 -4,-2.4 4,-2.4 -5,-0.3 5,-0.4 0.957 110.2 46.8 -56.5 -50.4 78.3 7.5 -0.5 68 101 A M H < S+ 0 0 114 -4,-2.4 4,-0.2 -5,-0.2 -2,-0.2 0.878 117.5 43.7 -59.1 -39.0 77.0 4.1 0.4 69 102 A L H < S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.872 131.3 15.3 -71.3 -37.8 73.4 5.3 -0.1 70 103 A L H >< S+ 0 0 0 -4,-2.4 3,-1.7 -5,-0.2 -3,-0.2 0.679 95.3 87.0-116.1 -30.7 73.8 7.3 -3.4 71 104 A A T 3< S+ 0 0 55 -4,-2.4 -3,-0.1 -5,-0.4 -4,-0.1 0.817 93.6 45.0 -58.4 -38.5 77.1 6.7 -5.3 72 105 A D T 3 S+ 0 0 86 -5,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.417 79.9 128.0 -90.8 6.2 75.9 3.7 -7.4 73 106 A A < - 0 0 8 -3,-1.7 3,-0.1 1,-0.1 -3,-0.1 -0.305 66.5-126.5 -55.9 145.2 72.5 5.2 -8.4 74 107 A P S S+ 0 0 86 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.636 94.0 28.2 -76.4 -13.1 72.1 5.1 -12.3 75 108 A I + 0 0 36 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 -0.988 56.1 170.7-147.7 136.2 71.4 8.9 -12.5 76 109 A H + 0 0 51 -2,-0.3 2,-1.7 1,-0.1 38,-0.2 0.589 58.1 87.1-117.2 -21.5 72.6 11.6 -10.1 77 110 A N S S+ 0 0 87 36,-0.2 36,-0.2 2,-0.0 -1,-0.1 -0.371 73.0 96.0 -84.8 61.6 71.7 15.0 -11.7 78 111 A I S S- 0 0 10 -2,-1.7 36,-2.5 -3,-0.1 -66,-0.2 -0.927 83.0 -78.3-146.4 159.1 68.1 15.2 -10.3 79 112 A P E - d 0 114A 26 0, 0.0 -66,-2.9 0, 0.0 2,-0.4 -0.352 44.5-155.5 -63.6 146.1 66.3 16.8 -7.3 80 113 A V E -bd 13 115A 0 34,-2.3 36,-3.2 -68,-0.2 37,-1.2 -0.984 12.6-167.1-129.2 132.5 66.7 15.1 -4.0 81 114 A Y E -bd 14 117A 18 -68,-2.0 -66,-3.0 -2,-0.4 2,-0.6 -0.989 6.0-167.9-113.8 120.7 64.4 15.1 -0.9 82 115 A F E +bd 15 118A 0 35,-3.0 37,-2.2 -2,-0.5 2,-0.5 -0.951 12.7 176.9-111.4 108.0 66.0 13.7 2.2 83 116 A Y E -bd 16 119A 17 -68,-2.5 -66,-2.6 -2,-0.6 2,-0.2 -0.936 10.1-164.0-120.1 115.7 63.3 13.2 4.8 84 117 A A E -bd 17 120A 0 35,-2.4 37,-2.4 -2,-0.5 -66,-0.2 -0.626 9.2-171.1 -97.4 155.7 64.1 11.7 8.1 85 118 A T >> - 0 0 5 -68,-2.1 4,-1.6 -2,-0.2 3,-0.8 0.115 52.6 -22.3-123.3-135.7 61.4 10.3 10.4 86 119 A A H 3> S+ 0 0 2 1,-0.3 4,-1.2 2,-0.2 -68,-0.1 0.746 122.1 64.3 -64.3 -29.2 61.1 9.0 14.0 87 120 A G H >4 S+ 0 0 10 1,-0.2 3,-0.6 -70,-0.2 -1,-0.3 0.950 112.1 37.7 -54.4 -45.7 64.9 8.0 14.4 88 121 A M H X4 S+ 0 0 3 -3,-0.8 3,-1.7 -71,-0.3 -1,-0.2 0.855 108.9 64.0 -76.8 -30.6 65.8 11.7 14.1 89 122 A R H 3< S+ 0 0 8 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.694 90.8 66.7 -65.8 -16.9 62.6 12.8 16.1 90 123 A L T << S+ 0 0 20 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.622 94.7 74.3 -73.4 -18.0 64.1 11.0 19.1 91 124 A L S < S- 0 0 45 -3,-1.7 -38,-0.0 -4,-0.2 5,-0.0 -0.751 88.9-111.0 -98.5 144.6 66.9 13.6 19.2 92 125 A P >> - 0 0 18 0, 0.0 4,-2.4 0, 0.0 3,-0.6 -0.302 37.0-106.0 -68.2 160.0 66.7 17.3 20.3 93 126 A Q H 3> S+ 0 0 113 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.864 119.5 57.9 -54.3 -42.7 67.1 19.9 17.6 94 127 A S H 3> S+ 0 0 51 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.868 110.5 43.7 -58.9 -37.1 70.6 20.8 18.6 95 128 A Q H X> S+ 0 0 52 -3,-0.6 4,-1.0 2,-0.2 3,-0.8 0.915 113.3 50.8 -72.7 -44.3 71.7 17.2 18.1 96 129 A Q H >X S+ 0 0 9 -4,-2.4 4,-1.9 1,-0.2 3,-0.5 0.879 100.4 65.1 -57.1 -39.5 69.8 16.9 14.8 97 130 A K H 3X S+ 0 0 123 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.816 93.3 60.0 -57.8 -34.9 71.4 20.1 13.5 98 131 A K H < S+ 0 0 41 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.938 110.4 46.5 -59.9 -48.2 78.3 17.0 1.7 107 140 A F H >< S+ 0 0 8 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.883 110.6 52.8 -59.6 -38.3 75.7 18.0 -0.9 108 141 A R H 3< S+ 0 0 168 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.740 102.2 60.2 -72.0 -21.0 77.3 21.4 -1.6 109 142 A Q T << S+ 0 0 127 -4,-1.4 2,-0.3 -3,-0.6 -1,-0.2 0.326 102.6 57.6 -88.3 2.5 80.7 19.8 -2.2 110 143 A Q < - 0 0 49 -3,-1.2 0, 0.0 -4,-0.2 0, 0.0 -0.818 69.7-147.7-127.1 170.4 79.5 17.7 -5.1 111 144 A S S S+ 0 0 105 -2,-0.3 -3,-0.1 3,-0.0 3,-0.1 0.182 77.9 61.0-133.0 24.1 77.9 18.9 -8.3 112 145 A Q S S+ 0 0 94 -5,-0.1 -5,-0.0 1,-0.1 -36,-0.0 0.738 84.4 67.1-110.2 -68.2 75.4 16.2 -9.5 113 146 A W S S- 0 0 12 -36,-0.2 2,-0.8 1,-0.1 -36,-0.2 -0.241 71.6-144.4 -56.5 141.5 72.6 15.7 -6.9 114 147 A Q E -d 79 0A 106 -36,-2.5 -34,-2.3 -38,-0.2 2,-0.3 -0.829 13.2-149.8-113.9 90.8 70.4 18.7 -6.5 115 148 A L E +d 80 0A 52 -2,-0.8 -34,-0.2 -36,-0.2 3,-0.1 -0.434 24.3 169.5 -67.1 119.2 69.5 18.9 -2.8 116 149 A V E - 0 0 71 -36,-3.2 2,-0.3 1,-0.4 -35,-0.2 0.848 67.4 -8.0 -93.1 -49.2 66.0 20.4 -2.4 117 150 A E E -d 81 0A 72 -37,-1.2 -35,-3.0 2,-0.1 -1,-0.4 -0.989 49.5-176.6-148.1 141.7 65.3 19.7 1.2 118 151 A A E +d 82 0A 19 -2,-0.3 2,-0.3 -37,-0.2 -35,-0.2 -0.929 41.1 119.6-136.2 112.5 67.0 17.7 4.0 119 152 A K E -d 83 0A 79 -37,-2.2 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74.5 20.7 36.7 631 307 B Q T 3 S+ 0 0 106 1,-0.2 -1,-0.1 3,-0.1 -4,-0.1 0.648 115.5 60.7 -68.2 -14.1 74.5 24.5 36.6 632 308 B L T 3 S+ 0 0 4 -5,-0.2 2,-0.2 33,-0.0 -1,-0.2 0.785 99.7 62.3 -85.8 -27.7 70.7 24.6 36.7 633 309 B F < - 0 0 9 -3,-0.6 2,-0.4 -6,-0.3 12,-0.1 -0.639 65.3-153.0-105.4 157.1 70.3 22.8 40.0 634 310 B H + 0 0 139 -2,-0.2 2,-0.3 2,-0.0 -5,-0.1 -0.933 26.0 152.9-136.0 107.1 71.5 23.7 43.5 635 311 B F - 0 0 32 -2,-0.4 3,-0.3 -7,-0.2 2,-0.2 -0.995 27.7-144.0-132.6 142.4 72.3 21.0 46.1 636 312 B E S > S+ 0 0 149 -2,-0.3 3,-1.5 3,-0.2 -2,-0.0 -0.644 77.1 15.0 -96.8 155.0 74.6 21.1 49.1 637 313 B N T 3 S- 0 0 127 1,-0.3 -1,-0.2 -2,-0.2 3,-0.1 0.687 119.0 -77.1 60.7 23.6 76.7 18.2 50.5 638 314 B S T 3 S+ 0 0 44 -3,-0.3 61,-2.6 1,-0.2 2,-0.3 0.886 105.3 109.2 53.4 44.2 76.3 16.1 47.3 639 315 B E E < -W 698 0F 56 -3,-1.5 2,-0.3 59,-0.2 59,-0.2 -0.989 42.6-178.0-146.6 157.0 72.8 15.1 48.3 640 316 B L E -W 697 0F 4 57,-2.5 57,-3.1 -2,-0.3 2,-0.3 -0.878 18.9-134.5-136.7 172.8 69.3 15.8 47.2 641 317 B T E > -W 696 0F 31 -2,-0.3 4,-2.7 55,-0.2 5,-0.2 -0.952 24.9-124.1-125.7 156.9 65.7 15.1 48.1 642 318 B N H > S+ 0 0 0 53,-0.5 4,-2.8 50,-0.4 5,-0.3 0.901 112.4 55.2 -63.0 -39.1 63.0 14.1 45.6 643 319 B Q H > S+ 0 0 83 50,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.949 112.0 41.8 -58.5 -48.5 60.8 17.0 46.8 644 320 B S H > S+ 0 0 32 49,-0.4 4,-2.7 2,-0.2 5,-0.2 0.884 113.4 52.9 -68.5 -36.0 63.6 19.5 46.1 645 321 B L H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.949 112.4 45.3 -65.5 -44.4 64.6 17.9 42.8 646 322 B L H X S+ 0 0 19 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.938 114.8 47.6 -65.4 -42.2 61.0 18.1 41.5 647 323 B Q H X S+ 0 0 94 -4,-2.4 4,-2.5 -5,-0.3 5,-0.3 0.914 113.0 47.9 -64.5 -45.2 60.5 21.7 42.7 648 324 B Q H X S+ 0 0 31 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.920 113.6 46.9 -64.8 -43.1 63.8 22.8 41.2 649 325 B G H X>S+ 0 0 0 -4,-2.5 5,-2.3 -5,-0.2 4,-1.9 0.946 113.6 50.5 -63.7 -40.3 63.0 21.1 37.8 650 326 B D H <>S+ 0 0 21 -4,-2.9 5,-2.2 -5,-0.2 -2,-0.2 0.897 120.6 32.4 -59.9 -47.6 59.5 22.6 37.8 651 327 B N H <5S+ 0 0 85 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.860 124.4 40.5 -86.1 -34.6 60.6 26.2 38.5 652 328 B Q H <5S+ 0 0 89 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.668 135.9 5.7 -92.6 -18.9 64.0 26.4 36.8 653 329 B I T ><5S+ 0 0 0 -4,-1.9 3,-1.7 -5,-0.3 -82,-0.4 0.596 124.2 49.7-125.0 -57.0 63.1 24.4 33.6 654 330 B f T 3 -x 571 0G 73 -2,-0.2 4,-2.8 -87,-0.2 5,-0.2 -0.757 32.2-140.2 -79.5 123.4 60.3 29.9 28.2 658 334 B W H > S+ 0 0 27 -87,-3.2 4,-3.3 -2,-0.5 5,-0.3 0.895 94.3 46.8 -57.3 -52.2 62.4 27.5 26.2 659 335 B D H > S+ 0 0 113 -88,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.900 116.4 46.9 -61.4 -36.2 64.1 29.9 23.7 660 336 B I H > S+ 0 0 103 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.945 116.0 44.0 -67.3 -51.9 65.0 32.3 26.5 661 337 B L H X S+ 0 0 3 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.929 113.2 51.1 -60.7 -46.8 66.3 29.5 28.9 662 338 B N H < S+ 0 0 63 -4,-3.3 3,-0.3 -5,-0.2 6,-0.2 0.910 111.3 48.8 -53.5 -45.7 68.3 27.8 26.1 663 339 B G H < S+ 0 0 56 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.822 106.7 56.2 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-97.3 -0.6 65.5 17.3 29.1 674 350 B Y H <> S+ 0 0 13 -3,-2.3 4,-2.1 2,-0.2 5,-0.2 0.769 79.3 56.2 -71.8 -23.5 65.8 18.5 32.7 675 351 B f H > S+ 0 0 0 -4,-0.4 4,-1.9 -3,-0.3 -1,-0.2 0.953 115.2 40.3 -63.5 -50.2 62.0 19.1 33.2 676 352 B L H > S+ 0 0 0 -108,-0.7 4,-2.7 -4,-0.3 -2,-0.2 0.906 116.1 49.1 -64.6 -43.7 61.4 15.5 32.1 677 353 B L H X S+ 0 0 3 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.922 110.4 49.3 -71.0 -43.8 64.4 14.0 34.1 678 354 B S H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.948 115.2 45.9 -58.0 -41.0 63.6 15.7 37.3 679 355 B S H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.897 113.4 49.7 -64.0 -44.9 59.9 14.5 36.9 680 356 B Y H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.873 106.9 52.4 -63.3 -44.9 61.1 11.0 36.0 681 357 B Y H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.908 112.3 47.5 -63.5 -39.0 63.5 10.6 39.0 682 358 B Y H X>S+ 0 0 34 -4,-1.8 4,-2.5 -5,-0.3 5,-1.2 0.930 112.7 48.5 -63.9 -48.8 60.7 11.6 41.3 683 359 B A H <>S+ 0 0 0 -4,-2.6 5,-1.6 3,-0.2 -2,-0.2 0.926 116.5 43.4 -55.0 -45.7 58.3 9.2 39.6 684 360 B L H <>S+ 0 0 0 -4,-3.0 5,-2.7 3,-0.2 6,-0.2 0.967 123.9 32.9 -66.7 -51.4 60.8 6.4 39.8 685 361 B M H <5S+ 0 0 0 -4,-2.8 6,-2.7 3,-0.2 5,-0.3 0.914 131.6 28.4 -79.0 -38.9 62.0 6.9 43.4 686 362 B V T X5S+ 0 0 17 -4,-2.5 4,-0.6 -5,-0.3 -3,-0.2 0.964 132.6 27.3 -88.2 -59.7 58.8 8.2 45.0 687 363 B D T 4 - 0 0 95 1,-0.1 3,-2.0 4,-0.1 -50,-0.4 -0.491 23.9-127.6 -62.4 136.9 59.7 9.5 51.1 693 369 B P T 3 S+ 0 0 32 0, 0.0 -50,-2.9 0, 0.0 -49,-0.4 0.741 110.3 49.5 -61.0 -20.6 60.0 12.8 49.0 694 370 B N T 3 S+ 0 0 93 -52,-0.2 2,-0.3 -53,-0.2 -2,-0.1 0.425 83.1 116.4 -93.9 -0.5 62.0 14.3 52.0 695 371 B Q S < S- 0 0 59 -3,-2.0 -53,-0.5 1,-0.1 2,-0.2 -0.495 72.5-114.2 -67.6 128.4 64.4 11.4 52.3 696 372 B T E - W 0 641F 42 -2,-0.3 -78,-0.6 -55,-0.1 2,-0.5 -0.475 27.0-164.1 -60.3 133.2 68.0 12.3 51.6 697 373 B I E -vW 618 640F 0 -57,-3.1 -57,-2.5 -2,-0.2 2,-0.3 -0.985 11.0-148.4-118.8 113.7 69.5 10.7 48.5 698 374 B H E -vW 619 639F 31 -80,-2.9 -78,-2.8 -2,-0.5 2,-0.3 -0.648 13.6-165.3 -79.2 140.0 73.3 10.9 48.4 699 375 B Y E -v 620 0F 11 -61,-2.6 -78,-0.2 -2,-0.3 -80,-0.0 -0.949 21.2-117.0-122.1 152.3 74.8 11.1 45.0 700 376 B I - 0 0 21 -80,-1.4 5,-0.1 -2,-0.3 -78,-0.1 -0.716 35.6-105.5 -90.4 128.7 78.5 10.6 44.1 701 377 B P > - 0 0 24 0, 0.0 3,-2.2 0, 0.0 5,-0.4 -0.281 27.5-132.0 -46.0 128.5 80.3 13.6 42.6 702 378 B P G > S+ 0 0 29 0, 0.0 3,-2.8 0, 0.0 -76,-0.1 0.782 101.4 75.8 -58.5 -26.3 80.7 12.8 38.8 703 379 B E G 3 S+ 0 0 141 1,-0.3 -3,-0.0 2,-0.1 0, 0.0 0.718 85.9 63.1 -56.5 -26.1 84.3 13.8 39.1 704 380 B Q G < S- 0 0 99 -3,-2.2 -1,-0.3 2,-0.1 3,-0.2 0.623 94.2-145.7 -76.2 -11.3 84.9 10.5 40.8 705 381 B N < + 0 0 51 -3,-2.8 2,-0.7 1,-0.2 -2,-0.1 0.802 33.2 177.6 52.6 30.2 83.8 8.6 37.6 706 382 B L + 0 0 26 -5,-0.4 -84,-0.6 -84,-0.1 -1,-0.2 -0.537 10.9 151.2 -75.9 112.9 82.3 6.1 40.1 707 383 B D - 0 0 17 -2,-0.7 3,-0.5 -3,-0.2 4,-0.1 -0.491 61.9 -84.3-117.4-159.6 80.5 3.2 38.4 708 384 B W S >> S+ 0 0 2 1,-0.2 3,-1.4 -2,-0.2 4,-0.5 0.424 95.1 104.6 -90.1 1.1 80.0 -0.5 39.5 709 385 B T H >> + 0 0 0 1,-0.3 4,-1.2 2,-0.2 3,-1.1 0.795 68.4 64.3 -63.4 -28.0 83.4 -1.8 38.3 710 386 B I H 3> S+ 0 0 9 -3,-0.5 4,-2.0 1,-0.2 -1,-0.3 0.857 94.1 65.4 -58.8 -33.3 85.0 -1.9 41.8 711 387 B G H <> S+ 0 0 0 -3,-1.4 4,-1.6 -225,-0.3 -1,-0.2 0.866 96.9 54.1 -56.2 -31.9 82.4 -4.6 42.5 712 388 B V H << S+ 0 0 0 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.878 103.5 55.1 -69.6 -37.5 84.1 -6.8 39.8 713 389 B V H < S+ 0 0 1 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.940 115.8 39.4 -56.6 -45.1 87.4 -6.5 41.6 714 390 B L H < S+ 0 0 17 -4,-2.0 2,-0.4 1,-0.2 -2,-0.2 0.748 124.4 35.9 -71.9 -29.3 85.8 -7.7 44.8 715 391 B H < + 0 0 43 -4,-1.6 -1,-0.2 -5,-0.2 -226,-0.0 -0.910 54.0 177.1-141.2 96.0 83.5 -10.4 43.2 716 392 B R + 0 0 84 -2,-0.4 2,-0.1 -3,-0.2 -1,-0.1 0.446 59.5 86.0 -83.0 -5.6 84.7 -12.5 40.2 717 393 B A 0 0 60 -5,-0.0 -2,-0.1 0, 0.0 0, 0.0 -0.452 360.0 360.0 -86.5 168.8 81.6 -14.7 39.9 718 394 B L 0 0 79 -2,-0.1 -2,-0.0 -240,-0.0 -240,-0.0 -0.992 360.0 360.0-142.6 360.0 78.3 -13.9 38.0